*HEADER    STRUCTURAL GENOMICS, UNKNOWN FUNCTION   05-APR-06   2GM2              
*TITLE     NMR STRUCTURE OF XANTHOMONAS CAMPESTRIS XCC1710: NORTHEAST            
*TITLE    2 STRUCTURAL GENOMICS CONSORTIUM TARGET XCR35                          
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: CONSERVED HYPOTHETICAL PROTEIN;                            
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: XANTHOMONAS CAMPESTRIS PV. CAMPESTRIS           
*SOURCE   3 STR. ATCC 33913;                                                     
*SOURCE   4 GENE: XCC1710;                                                       
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3)+MAGIC;                           
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET21                                     
*KEYWDS    MTH938-LIKE FOLD, STRUCTURAL GENOMICS, PSI, PROTEIN                   
*KEYWDS   2 STRUCTURE INITIATIVE, NORTHEAST STRUCTURAL GENOMICS                  
*KEYWDS   3 CONSORTIUM, NESG                                                     
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    J.R.CORT, R.XIAO, D.Y.WANG, L.C.MA, M.CIANO, G.T.MONTELIONE,          
*AUTHOR   2 T.A.RAMELOT, M.A.KENNEDY, NORTHEAST STRUCTURAL GENOMICS              
*AUTHOR   3 CONSORTIUM (NESG)                                                    
*REVDAT   1   25-APR-06 2GM2    0                                                


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 assign(resid 112 and name HN   )(resid 112 and name HG#  )  1.80  0.00  3.20
 assign(resid 112 and name HN   )(resid 113 and name HN   )  1.80  0.00  1.70
 assign(resid 113 and name HN   )(resid 114 and name HN   )  1.80  0.00  1.70
 assign(resid 114 and name HA   )(resid 114 and name HD#  )  1.80  0.00  3.20
 assign(resid 114 and name HA   )(resid 115 and name HN   )  1.80  0.00  0.90
 assign(resid 114 and name HB#  )(resid 114 and name HD1  )  1.80  0.00  3.20
 assign(resid 114 and name HB#  )(resid 114 and name HD2  )  1.80  0.00  3.20
 assign(resid 114 and name HB#  )(resid 115 and name HN   )  1.80  0.00  2.70
 assign(resid 114 and name HN   )(resid 114 and name HG#  )  1.80  0.00  3.20
 assign(resid 115 and name HA   )(resid 116 and name HN   )  1.80  0.00  0.90
 assign(resid 115 and name HB#  )(resid 115 and name HD1  )  1.80  0.00  3.20
 assign(resid 115 and name HB#  )(resid 115 and name HD2  )  1.80  0.00  3.20
 assign(resid 116 and name HA   )(resid 116 and name HG2# )  1.80  0.00  1.20
 assign(resid 116 and name HA   )(resid 117 and name HN   )  1.80  0.00  0.90
 assign(resid 116 and name HA   )(resid 67 and name HG1# )  1.80  0.00  3.20
 assign(resid 116 and name HA   )(resid 67 and name HN   )  1.80  0.00  3.20
 assign(resid 116 and name HB   )(resid 117 and name HN   )  1.80  0.00  3.20
 assign(resid 116 and name HG1# )(resid 118 and name HD1# )  1.80  0.00  3.20
 assign(resid 116 and name HG2# )(resid 117 and name HN   )  1.80  0.00  2.70
 assign(resid 116 and name HN   )(resid 116 and name HB   )  1.80  0.00  2.20
 assign(resid 116 and name HN   )(resid 116 and name HG1# )  1.80  0.00  1.70
 assign(resid 117 and name HA   )(resid 118 and name HN   )  1.80  0.00  0.90
 assign(resid 118 and name HA   )(resid 118 and name HD1# )  1.80  0.00  1.40
 assign(resid 118 and name HA   )(resid 119 and name HN   )  1.80  0.00  0.90
 assign(resid 118 and name HA   )(resid 69 and name HN   )  1.80  0.00  3.20
 assign(resid 118 and name HB#  )(resid 118 and name HD1# )  1.80  0.00  3.20
 assign(resid 118 and name HD1# )(resid 119 and name HN   )  1.80  0.00  2.20
 assign(resid 118 and name HD1# )(resid 120 and name HE#  )  1.80  0.00  3.20
 assign(resid 118 and name HD2# )(resid 120 and name HE#  )  1.80  0.00  3.20
 assign(resid 118 and name HG   )(resid 119 and name HN   )  1.80  0.00  3.20
 assign(resid 118 and name HG   )(resid 120 and name HE#  )  1.80  0.00  3.20
 assign(resid 119 and name HA   )(resid 120 and name HN   )  1.80  0.00  0.90
 assign(resid 119 and name HA   )(resid 35 and name HN   )  1.80  0.00  3.20
 assign(resid 120 and name HA   )(resid 121 and name HN   )  1.80  0.00  0.90
 assign(resid 120 and name HA   )(resid 71 and name HN   )  1.80  0.00  3.20
 assign(resid 120 and name HB1  )(resid 120 and name HE#  )  1.80  0.00  3.20
 assign(resid 120 and name HB2  )(resid 120 and name HE#  )  1.80  0.00  3.20
 assign(resid 120 and name HG#  )(resid 122 and name HG2# )  1.80  0.00  3.20
 assign(resid 121 and name HA   )(resid 121 and name HD1# )  1.80  0.00  3.20
 assign(resid 121 and name HA   )(resid 122 and name HN   )  1.80  0.00  0.90
 assign(resid 121 and name HB   )(resid 122 and name HN   )  1.80  0.00  3.20
 assign(resid 121 and name HG11 )(resid 121 and name HG2# )  1.80  0.00  3.20
 assign(resid 121 and name HG12 )(resid 121 and name HG2# )  1.80  0.00  3.20
 assign(resid 121 and name HG2# )(resid 122 and name HA   )  1.80  0.00  3.20
 assign(resid 121 and name HG2# )(resid 122 and name HN   )  1.80  0.00  2.20
 assign(resid 121 and name HN   )(resid 121 and name HD1# )  1.80  0.00  3.20
 assign(resid 121 and name HN   )(resid 121 and name HG1# )  1.80  0.00  3.20
 assign(resid 122 and name HA   )(resid 123 and name HN   )  1.80  0.00  1.70
 assign(resid 122 and name HB   )(resid 123 and name HN   )  1.80  0.00  3.20
 assign(resid 122 and name HG1# )(resid 123 and name HN   )  1.80  0.00  2.20
 assign(resid 122 and name HN   )(resid 122 and name HG1# )  1.80  0.00  3.20
 assign(resid 122 and name HN   )(resid 122 and name HG2# )  1.80  0.00  1.70
 assign(resid 123 and name HA1  )(resid 124 and name HN   )  1.80  0.00  1.70
 assign(resid 123 and name HA2  )(resid 124 and name HN   )  1.80  0.00  1.70
 assign(resid 125 and name HA   )(resid 125 and name HD1# )  1.80  0.00  3.20
 assign(resid 125 and name HA   )(resid 125 and name HD2# )  1.80  0.00  3.20 
! PHI for ALA 17
assign (resid  16   and name C   )  (resid  17  and name N   )
       (resid  17   and name CA  )  (resid  17  and name C   )  1.0 -141.16 30 2

! PSI for ALA 17
assign (resid  17   and name N   )  (resid  17  and name CA  )
       (resid  17   and name C   )  (resid  18  and name N   )  1.0 148.35 40 2

! PHI for ALA 22
assign (resid  21   and name C   )  (resid  22  and name N   )
       (resid  22   and name CA  )  (resid  22  and name C   )  1.0 -148.14 30 2

! PSI for ALA 22
assign (resid  22   and name N   )  (resid  22  and name CA  )
       (resid  22   and name C   )  (resid  23  and name N   )  1.0 155.68 40 2

! PHI for LYS 23
assign (resid  22   and name C   )  (resid  23  and name N   )
       (resid  23   and name CA  )  (resid  23  and name C   )  1.0 -121.4 30 2

! PSI for LYS 23
assign (resid  23   and name N   )  (resid  23  and name CA  )
       (resid  23   and name C   )  (resid  24  and name N   )  1.0 131.45 40 2

! PHI for VAL 24
assign (resid  23   and name C   )  (resid  24  and name N   )
       (resid  24   and name CA  )  (resid  24  and name C   )  1.0 -118.63 30 2

! PSI for VAL 24
assign (resid  24   and name N   )  (resid  24  and name CA  )
       (resid  24   and name C   )  (resid  25  and name N   )  1.0 125.38 40 2

! PHI for GLN 27
assign (resid  26   and name C   )  (resid  27  and name N   )
       (resid  27   and name CA  )  (resid  27  and name C   )  1.0 -99.61 30 2

! PSI for GLN 27
assign (resid  27   and name N   )  (resid  27  and name CA  )
       (resid  27   and name C   )  (resid  28  and name N   )  1.0 127.33 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 -103.11 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   )  1.0 116.37 40 2

! PHI for GLN 31
assign (resid  30   and name C   )  (resid  31  and name N   )
       (resid  31   and name CA  )  (resid  31  and name C   )  1.0 -128.73 30 2

! PHI for ILE 34
assign (resid  33   and name C   )  (resid  34  and name N   )
       (resid  34   and name CA  )  (resid  34  and name C   )  1.0 -128.36 30 2

! PSI for ILE 34
assign (resid  34   and name N   )  (resid  34  and name CA  )
       (resid  34   and name C   )  (resid  35  and name N   )  1.0 139.71 40 2

! PHI for LEU 35
assign (resid  34   and name C   )  (resid  35  and name N   )
       (resid  35   and name CA  )  (resid  35  and name C   )  1.0 -135.41 30 2

! PSI for LEU 35
assign (resid  35   and name N   )  (resid  35  and name CA  )
       (resid  35   and name C   )  (resid  36  and name N   )  1.0 135.93 40 2

! PHI for MET 36
assign (resid  35   and name C   )  (resid  36  and name N   )
       (resid  36   and name CA  )  (resid  36  and name C   )  1.0 -106.99 30 2

! PSI for MET 36
assign (resid  36   and name N   )  (resid  36  and name CA  )
       (resid  36   and name C   )  (resid  37  and name N   )  1.0 123.69 40 2

! PHI for LEU 40
assign (resid  39   and name C   )  (resid  40  and name N   )
       (resid  40   and name CA  )  (resid  40  and name C   )  1.0 -107.77 30 2

! PSI for LEU 40
assign (resid  40   and name N   )  (resid  40  and name CA  )
       (resid  40   and name C   )  (resid  41  and name N   )  1.0 123.67 40 2

! PHI for VAL 41
assign (resid  40   and name C   )  (resid  41  and name N   )
       (resid  41   and name CA  )  (resid  41  and name C   )  1.0 -106.34 30 2

! PSI for VAL 41
assign (resid  41   and name N   )  (resid  41  and name CA  )
       (resid  41   and name C   )  (resid  42  and name N   )  1.0 123.36 40 2

! PHI for ALA 55
assign (resid  54   and name C   )  (resid  55  and name N   )
       (resid  55   and name CA  )  (resid  55  and name C   )  1.0 -61.15 30 2

! PSI for ALA 55
assign (resid  55   and name N   )  (resid  55  and name CA  )
       (resid  55   and name C   )  (resid  56  and name N   )  1.0 -40.88 40 2

! PHI for MET 57
assign (resid  56   and name C   )  (resid  57  and name N   )
       (resid  57   and name CA  )  (resid  57  and name C   )  1.0 -66.03 30 2

! PSI for MET 57
assign (resid  57   and name N   )  (resid  57  and name CA  )
       (resid  57   and name C   )  (resid  58  and name N   )  1.0 -34.57 40 2

! PHI for ASP 58
assign (resid  57   and name C   )  (resid  58  and name N   )
       (resid  58   and name CA  )  (resid  58  and name C   )  1.0 -63.86 30 2

! PSI for ASP 58
assign (resid  58   and name N   )  (resid  58  and name CA  )
       (resid  58   and name C   )  (resid  59  and name N   )  1.0 -36.73 40 2

! PHI for ALA 59
assign (resid  58   and name C   )  (resid  59  and name N   )
       (resid  59   and name CA  )  (resid  59  and name C   )  1.0 -66.39 30 2

! PSI for ALA 59
assign (resid  59   and name N   )  (resid  59  and name CA  )
       (resid  59   and name C   )  (resid  60  and name N   )  1.0 -39.9 40 2

! PHI for VAL 60
assign (resid  59   and name C   )  (resid  60  and name N   )
       (resid  60   and name CA  )  (resid  60  and name C   )  1.0 -68.67 30 2

! PSI for VAL 60
assign (resid  60   and name N   )  (resid  60  and name CA  )
       (resid  60   and name C   )  (resid  61  and name N   )  1.0 -41.21 40 2

! PHI for LEU 61
assign (resid  60   and name C   )  (resid  61  and name N   )
       (resid  61   and name CA  )  (resid  61  and name C   )  1.0 -63.53 30 2

! PSI for LEU 61
assign (resid  61   and name N   )  (resid  61  and name CA  )
       (resid  61   and name C   )  (resid  62  and name N   )  1.0 -37.93 40 2

! PHI for ALA 62
assign (resid  61   and name C   )  (resid  62  and name N   )
       (resid  62   and name CA  )  (resid  62  and name C   )  1.0 -66.09 30 2

! PSI for ALA 62
assign (resid  62   and name N   )  (resid  62  and name CA  )
       (resid  62   and name C   )  (resid  63  and name N   )  1.0 -30.5 40 2

! PHI for LEU 63
assign (resid  62   and name C   )  (resid  63  and name N   )
       (resid  63   and name CA  )  (resid  63  and name C   )  1.0 -90.87 30 2

! PSI for LEU 63
assign (resid  63   and name N   )  (resid  63  and name CA  )
       (resid  63   and name C   )  (resid  64  and name N   )  1.0 4.09 40 2

! PHI for VAL 67
assign (resid  66   and name C   )  (resid  67  and name N   )
       (resid  67   and name CA  )  (resid  67  and name C   )  1.0 -126.67 30 2

! PSI for VAL 67
assign (resid  67   and name N   )  (resid  67  and name CA  )
       (resid  67   and name C   )  (resid  68  and name N   )  1.0 144.31 40 2

! PHI for ILE 68
assign (resid  67   and name C   )  (resid  68  and name N   )
       (resid  68   and name CA  )  (resid  68  and name C   )  1.0 -113.54 30 2

! PSI for ILE 68
assign (resid  68   and name N   )  (resid  68  and name CA  )
       (resid  68   and name C   )  (resid  69  and name N   )  1.0 132.44 40 2

! PHI for LEU 69
assign (resid  68   and name C   )  (resid  69  and name N   )
       (resid  69   and name CA  )  (resid  69  and name C   )  1.0 -116.63 30 2

! PSI for LEU 69
assign (resid  69   and name N   )  (resid  69  and name CA  )
       (resid  69   and name C   )  (resid  70  and name N   )  1.0 126.18 40 2

! PHI for LEU 70
assign (resid  69   and name C   )  (resid  70  and name N   )
       (resid  70   and name CA  )  (resid  70  and name C   )  1.0 -119.57 30 2

! PSI for LEU 70
assign (resid  70   and name N   )  (resid  70  and name CA  )
       (resid  70   and name C   )  (resid  71  and name N   )  1.0 133.94 40 2

! PHI for GLN 76
assign (resid  75   and name C   )  (resid  76  and name N   )
       (resid  76   and name CA  )  (resid  76  and name C   )  1.0 -79.48 30 2

! PSI for GLN 76
assign (resid  76   and name N   )  (resid  76  and name CA  )
       (resid  76   and name C   )  (resid  77  and name N   )  1.0 134.53 40 2

! PHI for GLN 77
assign (resid  76   and name C   )  (resid  77  and name N   )
      (resid  77   and name CA  )  (resid  77  and name C   )  1.0 -123.67 30 2

! PSI for GLN 77
assign (resid  77   and name N   )  (resid  77  and name CA  )
       (resid  77   and name C   )  (resid  78  and name N   )  1.0 152.36 40 2

! PHI for SER 80
assign (resid  79   and name C   )  (resid  80  and name N   )
       (resid  80   and name CA  )  (resid  80  and name C   )  1.0 -88.45 30 2

! PSI for SER 80
assign (resid  80   and name N   )  (resid  80  and name CA  )
       (resid  80   and name C   )  (resid  81  and name N   )  1.0 163.24 40 2

! PHI for THR 81
assign (resid  80   and name C   )  (resid  81  and name N   )
       (resid  81   and name CA  )  (resid  81  and name C   )  1.0 -60.03 30 2

! PSI for THR 81
assign (resid  81   and name N   )  (resid  81  and name CA  )
       (resid  81   and name C   )  (resid  82  and name N   )  1.0 -37.86 40 2

! PHI for ASP 82
assign (resid  81   and name C   )  (resid  82  and name N   )
       (resid  82   and name CA  )  (resid  82  and name C   )  1.0 -66.61 30 2

! PSI for ASP 82
assign (resid  82   and name N   )  (resid  82  and name CA  )
       (resid  82   and name C   )  (resid  83  and name N   )  1.0 -35.71 40 2

! PHI for VAL 83
assign (resid  82   and name C   )  (resid  83  and name N   )
       (resid  83   and name CA  )  (resid  83  and name C   )  1.0 -65.91 30 2

! PSI for VAL 83
assign (resid  83   and name N   )  (resid  83  and name CA  )
       (resid  83   and name C   )  (resid  84  and name N   )  1.0 -43.62 40 2

! PHI for LEU 84
assign (resid  83   and name C   )  (resid  84  and name N   )
       (resid  84   and name CA  )  (resid  84  and name C   )  1.0 -61.59 30 2

! PSI for LEU 84
assign (resid  84   and name N   )  (resid  84  and name CA  )
       (resid  84   and name C   )  (resid  85  and name N   )  1.0 -38.28 40 2

! PHI for ALA 85
assign (resid  84   and name C   )  (resid  85  and name N   )
       (resid  85   and name CA  )  (resid  85  and name C   )  1.0 -62.12 30 2

! PSI for ALA 85
assign (resid  85   and name N   )  (resid  85  and name CA  )
       (resid  85   and name C   )  (resid  86  and name N   )  1.0 -38.85 40 2

! PHI for ALA 86
assign (resid  85   and name C   )  (resid  86  and name N   )
       (resid  86   and name CA  )  (resid  86  and name C   )  1.0 -64.37 30 2

! PSI for ALA 86
assign (resid  86   and name N   )  (resid  86  and name CA  )
       (resid  86   and name C   )  (resid  87  and name N   )  1.0 -41.71 40 2

! PHI for CYS 87
assign (resid  86   and name C   )  (resid  87  and name N   )
       (resid  87   and name CA  )  (resid  87  and name C   )  1.0 -62.87 30 2

! PSI for CYS 87
assign (resid  87   and name N   )  (resid  87  and name CA  )
       (resid  87   and name C   )  (resid  88  and name N   )  1.0 -40.08 40 2

! PHI for LEU 88
assign (resid  87   and name C   )  (resid  88  and name N   )
       (resid  88   and name CA  )  (resid  88  and name C   )  1.0 -64.8 30 2

! PSI for LEU 88
assign (resid  88   and name N   )  (resid  88  and name CA  )
       (resid  88   and name C   )  (resid  89  and name N   )  1.0 -38.13 40 2

! PHI for THR 89
assign (resid  88   and name C   )  (resid  89  and name N   )
       (resid  89   and name CA  )  (resid  89  and name C   )  1.0 -65.05 30 2

! PSI for THR 89
assign (resid  89   and name N   )  (resid  89  and name CA  )
       (resid  89   and name C   )  (resid  90  and name N   )  1.0 -35.72 40 2

! PHI for LEU 94
assign (resid  93   and name C   )  (resid  94  and name N   )
       (resid  94   and name CA  )  (resid  94  and name C   )  1.0 -118.97 30 2

! PSI for LEU 94
assign (resid  94   and name N   )  (resid  94  and name CA  )
       (resid  94   and name C   )  (resid  95  and name N   )  1.0 128.9 40 2

! PHI for GLU 95
assign (resid  94   and name C   )  (resid  95  and name N   )
       (resid  95   and name CA  )  (resid  95  and name C   )  1.0 -118.94 30 2

! PSI for GLU 95
assign (resid  95   and name N   )  (resid  95  and name CA  )
       (resid  95   and name C   )  (resid  96  and name N   )  1.0 131.1 40 2

! PHI for ALA 96
assign (resid  95   and name C   )  (resid  96  and name N   )
       (resid  96   and name CA  )  (resid  96  and name C   )  1.0 -107.32 30 2

! PSI for ALA 96
assign (resid  96   and name N   )  (resid  96  and name CA  )
       (resid  96   and name C   )  (resid  97  and name N   )  1.0 136.15 40 2

! PHI for MET 97
assign (resid  96   and name C   )  (resid  97  and name N   )
       (resid  97   and name CA  )  (resid  97  and name C   )  1.0 -119.77 30 2

! PSI for MET 97
assign (resid  97   and name N   )  (resid  97  and name CA  )
       (resid  97   and name C   )  (resid  98  and name N   )  1.0 159.63 40 2

! PHI for ASN 99
assign (resid  98   and name C   )  (resid  99  and name N   )
       (resid  99   and name CA  )  (resid  99  and name C   )  1.0 -62.11 30 2

! PSI for ASN 99
assign (resid  99   and name N   )  (resid  99  and name CA  )
       (resid  99   and name C   )  (resid  100  and name N   )  1.0 -40.99 40 2

! PHI for ALA 100
assign (resid  99   and name C   )  (resid  100  and name N   )
       (resid  100   and name CA  )  (resid  100  and name C   )  1.0 -61.59 30 2

! PSI for ALA 100
assign (resid  100   and name N   )  (resid  100  and name CA  )
       (resid  100   and name C   )  (resid  101  and name N   )  1.0 -42.28 40 2

! PHI for ALA 101
assign (resid  100   and name C   )  (resid  101  and name N   )
       (resid  101   and name CA  )  (resid  101  and name C   )  1.0 -66.22 30 2

! PSI for ALA 101
assign (resid  101   and name N   )  (resid  101  and name CA  )
       (resid  101   and name C   )  (resid  102  and name N   )  1.0 -39.12 40 2

! PHI for ALA 102
assign (resid  101   and name C   )  (resid  102  and name N   )
       (resid  102   and name CA  )  (resid  102  and name C   )  1.0 -69.16 30 2

! PSI for ALA 102
assign (resid  102   and name N   )  (resid  102  and name CA  )
       (resid  102   and name C   )  (resid  103  and name N   )  1.0 -34.8 40 2

! PHI for ALA 103
assign (resid  102   and name C   )  (resid  103  and name N   )
       (resid  103   and name CA  )  (resid  103  and name C   )  1.0 -63.7 30 2

! PSI for ALA 103
assign (resid  103   and name N   )  (resid  103  and name CA  )
       (resid  103   and name C   )  (resid  104  and name N   )  1.0 -39.1 40 2

! PHI for ARG 104
assign (resid  103   and name C   )  (resid  104  and name N   )
       (resid  104   and name CA  )  (resid  104  and name C   )  1.0 -63.72 30 2

! PSI for ARG 104
assign (resid  104   and name N   )  (resid  104  and name CA  )
       (resid  104   and name C   )  (resid  105  and name N   )  1.0 -41.71 40 2

! PHI for THR 105
assign (resid  104   and name C   )  (resid  105  and name N   )
       (resid  105   and name CA  )  (resid  105  and name C   )  1.0 -63.35 30 2

! PSI for THR 105
assign (resid  105   and name N   )  (resid  105  and name CA  )
       (resid  105   and name C   )  (resid  106  and name N   )  1.0 -40.79 40 2

! PHI for TYR 106
assign (resid  105   and name C   )  (resid  106  and name N   )
       (resid  106   and name CA  )  (resid  106  and name C   )  1.0 -63.46 30 2

! PSI for TYR 106
assign (resid  106   and name N   )  (resid  106  and name CA  )
       (resid  106   and name C   )  (resid  107  and name N   )  1.0 -44.86 40 2

! PHI for ASN 107
assign (resid  106   and name C   )  (resid  107  and name N   )
       (resid  107   and name CA  )  (resid  107  and name C   )  1.0 -62.79 30 2

! PSI for ASN 107
assign (resid  107   and name N   )  (resid  107  and name CA  )
       (resid  107   and name C   )  (resid  108  and name N   )  1.0 -37.2 40 2

! PHI for VAL 108
assign (resid  107   and name C   )  (resid  108  and name N   )
       (resid  108   and name CA  )  (resid  108  and name C   )  1.0 -65.59 30 2

! PSI for VAL 108
assign (resid  108   and name N   )  (resid  108  and name CA  )
       (resid  108   and name C   )  (resid  109  and name N   )  1.0 -43.93 40 2

! PHI for LEU 109
assign (resid  108   and name C   )  (resid  109  and name N   )
       (resid  109   and name CA  )  (resid  109  and name C   )  1.0 -62.27 30 2

! PSI for LEU 109
assign (resid  109   and name N   )  (resid  109  and name CA  )
       (resid  109   and name C   )  (resid  110  and name N   )  1.0 -39.6 40 2

! PHI for ALA 110
assign (resid  109   and name C   )  (resid  110  and name N   )
       (resid  110   and name CA  )  (resid  110  and name C   )  1.0 -68.47 30 2

! PSI for ALA 110
assign (resid  110   and name N   )  (resid  110  and name CA  )
       (resid  110   and name C   )  (resid  111  and name N   )  1.0 -38.24 40 2

! PHI for SER 111
assign (resid  110   and name C   )  (resid  111  and name N   )
       (resid  111   and name CA  )  (resid  111  and name C   )  1.0 -65.55 30 2

! PSI for SER 111
assign (resid  111   and name N   )  (resid  111  and name CA  )
       (resid  111   and name C   )  (resid  112  and name N   )  1.0 -25.08 40 2

! PHI for GLU 112
assign (resid  111   and name C   )  (resid  112  and name N   )
       (resid  112   and name CA  )  (resid  112  and name C   )  1.0 -87.07 30 2

! PSI for GLU 112
assign (resid  112   and name N   )  (resid  112  and name CA  )
       (resid  112   and name C   )  (resid  113  and name N   )  1.0 1.88 40 2

! PHI for ALA 117
assign (resid  116   and name C   )  (resid  117  and name N   )
       (resid  117   and name CA  )  (resid  117  and name C   )  1.0 -116.43 30 2

! PSI for ALA 117
assign (resid  117   and name N   )  (resid  117  and name CA  )
       (resid  117   and name C   )  (resid  118  and name N   )  1.0 137.51 40 2

! PHI for LEU 118
assign (resid  117   and name C   )  (resid  118  and name N   )
       (resid  118   and name CA  )  (resid  118  and name C   )  1.0 -117.49 30 2

! PSI for LEU 118
assign (resid  118   and name N   )  (resid  118  and name CA  )
       (resid  118   and name C   )  (resid  119  and name N   )  1.0 125.65 40 2

! PHI for ALA 119
assign (resid  118   and name C   )  (resid  119  and name N   )
       (resid  119   and name CA  )  (resid  119  and name C   )  1.0 -103.84 30 2

! PSI for ALA 119
assign (resid  119   and name N   )  (resid  119  and name CA  )
       (resid  119   and name C   )  (resid  120  and name N   )  1.0 122.1 40 2

! PHI for MET 120
assign (resid  119   and name C   )  (resid  120  and name N   )
       (resid  120   and name CA  )  (resid  120  and name C   )  1.0 -103.64 30 2

! PSI for MET 120
assign (resid  120   and name N   )  (resid  120  and name CA  )
       (resid  120   and name C   )  (resid  121  and name N   )  1.0 126.23 40 2

! PHI for ILE 121
assign (resid  120   and name C   )  (resid  121  and name N   )
       (resid  121   and name CA  )  (resid  121  and name C   )  1.0 -106.72 30 2

! PSI for ILE 121
assign (resid  121   and name N   )  (resid  121  and name CA  )
       (resid  121   and name C   )  (resid  122  and name N   )  1.0 128.81 40 2

! PHI for VAL 122
assign (resid  121   and name C   )  (resid  122  and name N   )
       (resid  122   and name CA  )  (resid  122  and name C   )  1.0 -117.97 30 2

! PSI for VAL 122
assign (resid  122   and name N   )  (resid  122  and name CA  )
       (resid  122   and name C   )  (resid  123  and name N   )  1.0 141.24 40 2

! CHI-1 for VAL 67
assign (resid  67        and name N   )  (resid  67     and name CA  )
       (resid  67        and name CB  )  (resid  67     and name CG1 )  1.0 60.0 30 2

! CHI-1 for VAL 116
assign (resid  116       and name N   )  (resid  116     and name CA  )
       (resid  116       and name CB  )  (resid  116     and name CG1 )  1.0 60.0 30 2



  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1          1HT       MET   1   7.433   7.779 -32.916
    2   2H    MET   1          2HT       MET   1   6.376   6.580 -32.344
    3   3H    MET   1          3HT       MET   1   7.923   6.738 -31.672
    4    HA   MET   1           HA       MET   1   7.348   8.937 -30.839
    5   1HB   MET   1          1HB       MET   1   4.600   8.195 -31.870
    6   2HB   MET   1          2HB       MET   1   4.939   9.560 -30.818
    7   1HG   MET   1          1HG       MET   1   6.381  10.515 -32.568
    8   2HG   MET   1          2HG       MET   1   5.949   9.171 -33.623
    9   1HE   MET   1          1HE       MET   1   5.632  12.199 -34.468
   10   2HE   MET   1          2HE       MET   1   4.037  12.185 -35.222
   11   3HE   MET   1          3HE       MET   1   5.161  10.857 -35.511
   12    HA   PRO   2           HA       PRO   2   6.379   6.602 -27.158
   13   1HB   PRO   2          1HB       PRO   2   5.574   9.162 -25.945
   14   2HB   PRO   2          2HB       PRO   2   6.873   8.061 -25.476
   15   1HG   PRO   2          1HG       PRO   2   7.375  10.445 -26.614
   16   2HG   PRO   2          2HG       PRO   2   8.391   9.025 -26.919
   17   1HD   PRO   2          1HD       PRO   2   6.259  10.238 -28.637
   18   2HD   PRO   2          2HD       PRO   2   7.836   9.564 -29.103
   19    H    LEU   3           H        LEU   3   4.538   5.463 -27.006
   20    HA   LEU   3           HA       LEU   3   2.063   6.711 -27.892
   21   1HB   LEU   3          1HB       LEU   3   2.704   3.835 -27.250
   22   2HB   LEU   3          2HB       LEU   3   1.170   4.407 -27.878
   23    HG   LEU   3           HG       LEU   3   3.831   4.507 -29.301
   24   1HD1  LEU   3          1HD1      LEU   3   2.859   2.280 -29.209
   25   2HD1  LEU   3          2HD1      LEU   3   1.334   2.907 -29.837
   26   3HD1  LEU   3          3HD1      LEU   3   2.781   2.934 -30.845
   27   1HD2  LEU   3          1HD2      LEU   3   1.113   5.424 -30.228
   28   2HD2  LEU   3          2HD2      LEU   3   2.484   6.465 -29.844
   29   3HD2  LEU   3          3HD2      LEU   3   2.573   5.359 -31.214
   30    H    ASN   4           H        ASN   4   3.486   6.799 -25.070
   31    HA   ASN   4           HA       ASN   4   1.025   6.308 -23.547
   32   1HB   ASN   4          1HB       ASN   4   3.862   6.703 -22.567
   33   2HB   ASN   4          2HB       ASN   4   2.459   6.552 -21.515
   34   1HD2  ASN   4          2HD2      ASN   4   1.320   4.559 -21.484
   35   2HD2  ASN   4          1HD2      ASN   4   2.115   3.085 -21.938
   36    H    GLN   5           H        GLN   5   0.119   8.222 -24.536
   37    HA   GLN   5           HA       GLN   5   0.866  10.637 -23.054
   38   1HB   GLN   5          1HB       GLN   5   0.523  10.413 -26.044
   39   2HB   GLN   5          2HB       GLN   5   0.363  11.945 -25.195
   40   1HG   GLN   5          1HG       GLN   5   2.821  10.209 -25.128
   41   2HG   GLN   5          2HG       GLN   5   2.589  11.578 -26.215
   42   1HE2  GLN   5          2HE2      GLN   5   3.134  10.582 -22.925
   43   2HE2  GLN   5          1HE2      GLN   5   3.579  12.144 -22.321
   44    H    GLU   6           H        GLU   6  -1.063  12.207 -24.572
   45    HA   GLU   6           HA       GLU   6  -3.199  12.883 -24.410
   46   1HB   GLU   6          1HB       GLU   6  -3.797   9.929 -24.223
   47   2HB   GLU   6          2HB       GLU   6  -5.020  11.185 -24.374
   48   1HG   GLU   6          1HG       GLU   6  -3.828  11.880 -26.502
   49   2HG   GLU   6          2HG       GLU   6  -2.945  10.358 -26.375
   50    H    HIS   7           H        HIS   7  -3.045  14.016 -22.617
   51    HA   HIS   7           HA       HIS   7  -2.997  14.611 -20.447
   52   1HB   HIS   7          1HB       HIS   7  -5.102  14.104 -19.220
   53   2HB   HIS   7          2HB       HIS   7  -5.339  14.751 -20.834
   54    HD1  HIS   7           HD1      HIS   7  -6.419  13.210 -22.588
   55    HD2  HIS   7           HD2      HIS   7  -6.051  11.495 -18.818
   56    HE1  HIS   7           HE1      HIS   7  -7.895  11.173 -22.621
   57    HE2  HIS   7           HE2      HIS   7  -7.842  10.303 -20.261
   58    HA   PRO   8           HA       PRO   8  -1.374  10.856 -18.299
   59   1HB   PRO   8          1HB       PRO   8   1.328  11.710 -18.789
   60   2HB   PRO   8          2HB       PRO   8   0.553  10.215 -19.317
   61   1HG   PRO   8          1HG       PRO   8   1.369  12.230 -21.009
   62   2HG   PRO   8          2HG       PRO   8   0.117  11.036 -21.396
   63   1HD   PRO   8          1HD       PRO   8  -0.180  13.865 -20.470
   64   2HD   PRO   8          2HD       PRO   8  -1.134  12.959 -21.665
   65    H    ASP   9           H        ASP   9  -0.974  14.201 -18.571
   66    HA   ASP   9           HA       ASP   9  -0.596  15.921 -17.160
   67   1HB   ASP   9          1HB       ASP   9  -2.354  14.432 -15.884
   68   2HB   ASP   9          2HB       ASP   9  -1.008  14.141 -14.785
   69    H    TYR  10           H        TYR  10   0.519  15.607 -14.393
   70    HA   TYR  10           HA       TYR  10   3.295  15.177 -15.256
   71   1HB   TYR  10          1HB       TYR  10   2.160  16.770 -12.954
   72   2HB   TYR  10          2HB       TYR  10   3.884  16.501 -13.203
   73    HD1  TYR  10           HD1      TYR  10   4.957  17.373 -15.309
   74    HD2  TYR  10           HD2      TYR  10   1.008  18.454 -14.149
   75    HE1  TYR  10           HE1      TYR  10   5.041  19.298 -16.837
   76    HE2  TYR  10           HE2      TYR  10   1.082  20.382 -15.673
   77    HH   TYR  10           HH       TYR  10   3.461  20.753 -18.062
   78    H    THR  11           H        THR  11   4.552  13.672 -14.393
   79    HA   THR  11           HA       THR  11   3.368  11.543 -12.943
   80    HB   THR  11           HB       THR  11   6.319  12.006 -13.415
   81    HG1  THR  11           HG1      THR  11   4.615  11.912 -15.294
   82   1HG2  THR  11          1HG2      THR  11   5.815  10.228 -11.814
   83   2HG2  THR  11          2HG2      THR  11   4.720   9.479 -12.976
   84   3HG2  THR  11          3HG2      THR  11   6.450   9.556 -13.316
   85    H    TYR  12           H        TYR  12   2.907  11.609 -10.862
   86    HA   TYR  12           HA       TYR  12   4.051  13.443  -9.024
   87   1HB   TYR  12          1HB       TYR  12   2.354  10.984  -8.548
   88   2HB   TYR  12          2HB       TYR  12   2.751  12.179  -7.320
   89    HD1  TYR  12           HD1      TYR  12   0.818  11.542 -10.379
   90    HD2  TYR  12           HD2      TYR  12   1.640  14.308  -7.255
   91    HE1  TYR  12           HE1      TYR  12  -1.165  12.843 -11.018
   92    HE2  TYR  12           HE2      TYR  12  -0.341  15.618  -7.888
   93    HH   TYR  12           HH       TYR  12  -1.769  15.985  -9.780
   94    H    ALA  13           H        ALA  13   5.598  13.180  -7.486
   95    HA   ALA  13           HA       ALA  13   6.861  10.528  -7.255
   96   1HB   ALA  13          1HB       ALA  13   8.272  12.005  -8.601
   97   2HB   ALA  13          2HB       ALA  13   8.286  13.185  -7.290
   98   3HB   ALA  13          3HB       ALA  13   9.036  11.606  -7.062
   99    H    LEU  14           H        LEU  14   7.335   9.855  -5.227
  100    HA   LEU  14           HA       LEU  14   6.412  11.456  -2.995
  101   1HB   LEU  14          1HB       LEU  14   5.949   9.033  -3.082
  102   2HB   LEU  14          2HB       LEU  14   7.670   8.707  -3.072
  103    HG   LEU  14           HG       LEU  14   7.825   9.707  -0.811
  104   1HD1  LEU  14          1HD1      LEU  14   4.821   9.837  -0.998
  105   2HD1  LEU  14          2HD1      LEU  14   5.781  10.141   0.450
  106   3HD1  LEU  14          3HD1      LEU  14   5.917  11.218  -0.941
  107   1HD2  LEU  14          1HD2      LEU  14   5.809   7.484  -1.092
  108   2HD2  LEU  14          2HD2      LEU  14   7.564   7.301  -1.079
  109   3HD2  LEU  14          3HD2      LEU  14   6.725   7.868   0.366
  110    H    ARG  15           H        ARG  15   7.712  12.831  -1.949
  111    HA   ARG  15           HA       ARG  15  10.525  12.836  -2.658
  112   1HB   ARG  15          1HB       ARG  15   9.241  14.938  -2.733
  113   2HB   ARG  15          2HB       ARG  15   8.944  14.810  -1.004
  114   1HG   ARG  15          1HG       ARG  15  11.303  15.045  -0.540
  115   2HG   ARG  15          2HG       ARG  15  11.667  15.051  -2.266
  116   1HD   ARG  15          1HD       ARG  15  10.005  17.104  -0.810
  117   2HD   ARG  15          2HD       ARG  15  11.681  17.312  -1.315
  118    HE   ARG  15           HE       ARG  15  10.011  16.608  -3.514
  119   1HH1  ARG  15          1HH1      ARG  15  10.927  19.299  -1.466
  120   2HH1  ARG  15          2HH1      ARG  15  10.565  20.502  -2.663
  121   1HH2  ARG  15          1HH2      ARG  15   9.522  18.164  -5.076
  122   2HH2  ARG  15          2HH2      ARG  15   9.736  19.853  -4.728
  123    H    ALA  16           H        ALA  16   8.575  12.748   0.318
  124    HA   ALA  16           HA       ALA  16  10.575  11.143   1.617
  125   1HB   ALA  16          1HB       ALA  16  10.058  13.919   2.678
  126   2HB   ALA  16          2HB       ALA  16  11.051  12.679   3.444
  127   3HB   ALA  16          3HB       ALA  16  11.546  13.376   1.901
  128    H    ALA  17           H        ALA  17   9.695   9.894   3.139
  129    HA   ALA  17           HA       ALA  17   7.098  10.702   4.281
  130   1HB   ALA  17          1HB       ALA  17   6.454   8.343   4.362
  131   2HB   ALA  17          2HB       ALA  17   6.787   8.851   2.706
  132   3HB   ALA  17          3HB       ALA  17   7.976   7.895   3.591
  133    H    ASP  18           H        ASP  18   7.485  11.273   6.320
  134    HA   ASP  18           HA       ASP  18   9.796  10.238   7.720
  135   1HB   ASP  18          1HB       ASP  18   9.162  11.860   9.487
  136   2HB   ASP  18          2HB       ASP  18   9.332  12.610   7.903
  137    H    GLY  19           H        GLY  19   6.387   9.688   7.670
  138   1HA   GLY  19          1HA       GLY  19   5.773   7.458   8.577
  139   2HA   GLY  19          2HA       GLY  19   6.706   7.896  10.001
  140    H    ARG  20           H        ARG  20   5.714  10.670   9.942
  141    HA   ARG  20           HA       ARG  20   2.996  10.144  10.949
  142   1HB   ARG  20          1HB       ARG  20   4.865  12.445  11.567
  143   2HB   ARG  20          2HB       ARG  20   3.262  12.211  12.259
  144   1HG   ARG  20          1HG       ARG  20   4.022  10.101  13.258
  145   2HG   ARG  20          2HG       ARG  20   5.632  10.391  12.604
  146   1HD   ARG  20          1HD       ARG  20   5.712  12.508  13.916
  147   2HD   ARG  20          2HD       ARG  20   4.175  12.050  14.655
  148    HE   ARG  20           HE       ARG  20   6.182  10.007  14.854
  149   1HH1  ARG  20          1HH1      ARG  20   4.945  12.919  16.392
  150   2HH1  ARG  20          2HH1      ARG  20   5.612  12.511  17.940
  151   1HH2  ARG  20          1HH2      ARG  20   6.990   9.470  16.878
  152   2HH2  ARG  20          2HH2      ARG  20   6.778  10.550  18.222
  153    H    HIS  21           H        HIS  21   4.942  12.065   8.785
  154    HA   HIS  21           HA       HIS  21   2.445  12.878   7.454
  155   1HB   HIS  21          1HB       HIS  21   4.987  14.512   7.646
  156   2HB   HIS  21          2HB       HIS  21   3.560  14.951   6.715
  157    HD1  HIS  21           HD1      HIS  21   1.445  14.246   8.947
  158    HD2  HIS  21           HD2      HIS  21   4.883  16.512   9.507
  159    HE1  HIS  21           HE1      HIS  21   0.978  15.697  10.943
  160    HE2  HIS  21           HE2      HIS  21   2.980  17.215  11.107
  161    H    ALA  22           H        ALA  22   2.650  13.133   5.130
  162    HA   ALA  22           HA       ALA  22   4.989  11.765   3.979
  163   1HB   ALA  22          1HB       ALA  22   2.120  11.421   3.108
  164   2HB   ALA  22          2HB       ALA  22   3.529  10.691   2.339
  165   3HB   ALA  22          3HB       ALA  22   3.081  10.231   3.983
  166    H    LYS  23           H        LYS  23   6.022  13.015   2.567
  167    HA   LYS  23           HA       LYS  23   4.610  15.340   1.488
  168   1HB   LYS  23          1HB       LYS  23   7.554  14.707   1.705
  169   2HB   LYS  23          2HB       LYS  23   6.933  16.090   0.818
  170   1HG   LYS  23          1HG       LYS  23   7.476  17.028   2.845
  171   2HG   LYS  23          2HG       LYS  23   5.762  16.680   3.057
  172   1HD   LYS  23          1HD       LYS  23   6.343  14.607   4.245
  173   2HD   LYS  23          2HD       LYS  23   8.057  14.987   4.051
  174   1HE   LYS  23          1HE       LYS  23   7.614  17.137   5.274
  175   2HE   LYS  23          2HE       LYS  23   5.996  16.531   5.620
  176   1HZ   LYS  23          1HZ       LYS  23   7.060  14.606   6.739
  177   2HZ   LYS  23          2HZ       LYS  23   8.572  15.336   6.504
  178   3HZ   LYS  23          3HZ       LYS  23   7.410  16.091   7.480
  179    H    VAL  24           H        VAL  24   3.513  14.647  -0.246
  180    HA   VAL  24           HA       VAL  24   4.912  13.086  -2.299
  181    HB   VAL  24           HB       VAL  24   1.998  13.900  -2.256
  182   1HG1  VAL  24          1HG1      VAL  24   2.846  13.291  -4.454
  183   2HG1  VAL  24          2HG1      VAL  24   3.461  11.770  -3.810
  184   3HG1  VAL  24          3HG1      VAL  24   1.724  12.068  -3.859
  185   1HG2  VAL  24          1HG2      VAL  24   2.469  12.559  -0.283
  186   2HG2  VAL  24          2HG2      VAL  24   1.516  11.636  -1.445
  187   3HG2  VAL  24          3HG2      VAL  24   3.246  11.332  -1.283
  188    H    ASN  25           H        ASN  25   6.121  14.402  -3.510
  189    HA   ASN  25           HA       ASN  25   6.824  16.108  -4.814
  190   1HB   ASN  25          1HB       ASN  25   3.888  16.746  -5.230
  191   2HB   ASN  25          2HB       ASN  25   5.230  17.297  -6.226
  192   1HD2  ASN  25          2HD2      ASN  25   3.090  14.734  -5.468
  193   2HD2  ASN  25          1HD2      ASN  25   3.567  13.665  -6.737
  194    H    GLU  26           H        GLU  26   3.940  17.883  -3.849
  195    HA   GLU  26           HA       GLU  26   5.508  19.390  -1.885
  196   1HB   GLU  26          1HB       GLU  26   3.695  20.577  -4.000
  197   2HB   GLU  26          2HB       GLU  26   4.402  21.479  -2.667
  198   1HG   GLU  26          1HG       GLU  26   6.627  21.053  -3.522
  199   2HG   GLU  26          2HG       GLU  26   5.959  20.068  -4.823
  200    H    GLN  27           H        GLN  27   3.059  17.392  -2.360
  201    HA   GLN  27           HA       GLN  27   1.040  18.774  -0.769
  202   1HB   GLN  27          1HB       GLN  27   0.315  17.552  -2.774
  203   2HB   GLN  27          2HB       GLN  27   1.007  16.071  -2.130
  204   1HG   GLN  27          1HG       GLN  27  -0.588  16.210  -0.237
  205   2HG   GLN  27          2HG       GLN  27  -1.327  17.609  -1.016
  206   1HE2  GLN  27          2HE2      GLN  27  -3.312  16.567  -1.238
  207   2HE2  GLN  27          1HE2      GLN  27  -3.560  15.304  -2.391
  208    H    ILE  28           H        ILE  28   0.938  18.511   1.357
  209    HA   ILE  28           HA       ILE  28   2.476  16.326   2.572
  210    HB   ILE  28           HB       ILE  28   1.322  18.803   3.866
  211   1HG1  ILE  28          1HG1      ILE  28   4.185  18.108   3.171
  212   2HG1  ILE  28          2HG1      ILE  28   3.186  19.281   2.318
  213   1HG2  ILE  28          1HG2      ILE  28   1.448  16.936   5.418
  214   2HG2  ILE  28          2HG2      ILE  28   3.135  16.665   4.983
  215   3HG2  ILE  28          3HG2      ILE  28   2.666  18.149   5.813
  216   1HD1  ILE  28          1HD1      ILE  28   4.731  20.376   3.834
  217   2HD1  ILE  28          2HD1      ILE  28   3.061  20.641   4.338
  218   3HD1  ILE  28          3HD1      ILE  28   4.064  19.467   5.191
  219    H    LEU  29           H        LEU  29   1.292  14.562   2.862
  220    HA   LEU  29           HA       LEU  29  -1.518  14.866   3.642
  221   1HB   LEU  29          1HB       LEU  29  -0.012  12.506   2.517
  222   2HB   LEU  29          2HB       LEU  29  -1.687  12.444   3.037
  223    HG   LEU  29           HG       LEU  29  -0.640  14.235   0.839
  224   1HD1  LEU  29          1HD1      LEU  29  -0.517  11.890   0.191
  225   2HD1  LEU  29          2HD1      LEU  29  -2.202  11.664   0.661
  226   3HD1  LEU  29          3HD1      LEU  29  -1.798  12.725  -0.688
  227   1HD2  LEU  29          1HD2      LEU  29  -3.451  13.611   1.730
  228   2HD2  LEU  29          2HD2      LEU  29  -2.600  15.134   1.980
  229   3HD2  LEU  29          3HD2      LEU  29  -3.002  14.608   0.346
  230    H    GLN  30           H        GLN  30  -2.323  14.016   5.483
  231    HA   GLN  30           HA       GLN  30  -0.419  12.794   7.361
  232   1HB   GLN  30          1HB       GLN  30  -1.945  14.115   9.093
  233   2HB   GLN  30          2HB       GLN  30  -0.531  14.849   8.355
  234   1HG   GLN  30          1HG       GLN  30  -2.384  16.395   8.349
  235   2HG   GLN  30          2HG       GLN  30  -1.959  15.946   6.701
  236   1HE2  GLN  30          2HE2      GLN  30  -4.340  15.744   9.212
  237   2HE2  GLN  30          1HE2      GLN  30  -5.615  15.110   8.224
  238    H    GLN  31           H        GLN  31  -2.294  11.491   5.659
  239    HA   GLN  31           HA       GLN  31  -3.931  10.161   7.674
  240   1HB   GLN  31          1HB       GLN  31  -5.918  10.196   6.272
  241   2HB   GLN  31          2HB       GLN  31  -5.392  11.842   6.589
  242   1HG   GLN  31          1HG       GLN  31  -4.324  11.890   4.361
  243   2HG   GLN  31          2HG       GLN  31  -4.970  10.279   4.051
  244   1HE2  GLN  31          2HE2      GLN  31  -6.263  10.861   2.358
  245   2HE2  GLN  31          1HE2      GLN  31  -7.652  11.874   2.526
  246    H    SER  32           H        SER  32  -5.275   8.502   5.750
  247    HA   SER  32           HA       SER  32  -2.999   6.945   4.749
  248   1HB   SER  32          1HB       SER  32  -5.851   6.047   5.217
  249   2HB   SER  32          2HB       SER  32  -4.472   5.020   4.821
  250    HG   SER  32           HG       SER  32  -4.881   4.998   7.055
  251    H    PHE  33           H        PHE  33  -2.794   6.516   2.602
  252    HA   PHE  33           HA       PHE  33  -4.996   7.063   0.792
  253   1HB   PHE  33          1HB       PHE  33  -3.716   8.641  -0.587
  254   2HB   PHE  33          2HB       PHE  33  -3.969   9.272   1.036
  255    HD1  PHE  33           HD1      PHE  33  -1.546   8.265  -1.444
  256    HD2  PHE  33           HD2      PHE  33  -2.079   9.286   2.655
  257    HE1  PHE  33           HE1      PHE  33   0.874   8.650  -1.230
  258    HE2  PHE  33           HE2      PHE  33   0.341   9.673   2.875
  259    HZ   PHE  33           HZ       PHE  33   1.819   9.355   0.931
  260    H    ILE  34           H        ILE  34  -4.441   6.499  -1.472
  261    HA   ILE  34           HA       ILE  34  -2.452   4.315  -1.533
  262    HB   ILE  34           HB       ILE  34  -5.011   4.425  -3.133
  263   1HG1  ILE  34          1HG1      ILE  34  -4.457   2.710  -0.706
  264   2HG1  ILE  34          2HG1      ILE  34  -5.368   4.215  -0.640
  265   1HG2  ILE  34          1HG2      ILE  34  -3.029   2.205  -2.659
  266   2HG2  ILE  34          2HG2      ILE  34  -4.528   2.064  -3.576
  267   3HG2  ILE  34          3HG2      ILE  34  -3.237   3.117  -4.155
  268   1HD1  ILE  34          1HD1      ILE  34  -7.040   3.290  -2.129
  269   2HD1  ILE  34          2HD1      ILE  34  -6.115   1.794  -2.259
  270   3HD1  ILE  34          3HD1      ILE  34  -6.823   2.262  -0.713
  271    H    LEU  35           H        LEU  35  -0.826   4.746  -2.853
  272    HA   LEU  35           HA       LEU  35  -1.285   6.527  -5.155
  273   1HB   LEU  35          1HB       LEU  35   0.366   7.374  -3.579
  274   2HB   LEU  35          2HB       LEU  35   1.258   5.868  -3.663
  275    HG   LEU  35           HG       LEU  35   1.764   6.323  -6.043
  276   1HD1  LEU  35          1HD1      LEU  35  -0.167   7.723  -6.565
  277   2HD1  LEU  35          2HD1      LEU  35   0.458   8.986  -5.505
  278   3HD1  LEU  35          3HD1      LEU  35   1.344   8.542  -6.962
  279   1HD2  LEU  35          1HD2      LEU  35   3.379   8.116  -5.634
  280   2HD2  LEU  35          2HD2      LEU  35   2.555   8.512  -4.125
  281   3HD2  LEU  35          3HD2      LEU  35   3.353   6.951  -4.310
  282    H    MET  36           H        MET  36  -1.263   5.630  -7.118
  283    HA   MET  36           HA       MET  36   0.442   3.278  -7.560
  284   1HB   MET  36          1HB       MET  36  -2.460   3.531  -8.373
  285   2HB   MET  36          2HB       MET  36  -1.369   2.319  -9.027
  286   1HG   MET  36          1HG       MET  36  -1.011   1.499  -6.698
  287   2HG   MET  36          2HG       MET  36  -2.278   2.609  -6.177
  288   1HE   MET  36          1HE       MET  36  -2.076   0.523  -9.521
  289   2HE   MET  36          2HE       MET  36  -2.955  -0.935  -9.058
  290   3HE   MET  36          3HE       MET  36  -1.405  -0.562  -8.304
  291    HA   PRO  37           HA       PRO  37   1.626   5.387 -11.291
  292   1HB   PRO  37          1HB       PRO  37   1.739   2.820 -12.708
  293   2HB   PRO  37          2HB       PRO  37   3.052   3.917 -12.275
  294   1HG   PRO  37          1HG       PRO  37   2.735   1.532 -11.072
  295   2HG   PRO  37          2HG       PRO  37   3.355   2.949 -10.205
  296   1HD   PRO  37          1HD       PRO  37   0.596   1.775 -10.186
  297   2HD   PRO  37          2HD       PRO  37   1.567   2.390  -8.831
  298    H    ASP  38           H        ASP  38  -1.208   5.151 -10.903
  299    HA   ASP  38           HA       ASP  38  -2.076   5.209 -13.700
  300   1HB   ASP  38          1HB       ASP  38  -2.706   2.986 -12.670
  301   2HB   ASP  38          2HB       ASP  38  -3.703   3.874 -11.522
  302    H    GLU  39           H        GLU  39  -2.922   5.804 -10.315
  303    HA   GLU  39           HA       GLU  39  -3.231   8.581 -10.746
  304   1HB   GLU  39          1HB       GLU  39  -5.598   8.803 -10.116
  305   2HB   GLU  39          2HB       GLU  39  -5.406   7.955 -11.641
  306   1HG   GLU  39          1HG       GLU  39  -5.817   5.833 -10.539
  307   2HG   GLU  39          2HG       GLU  39  -5.937   6.649  -8.980
  308    H    LEU  40           H        LEU  40  -4.338   9.537  -8.629
  309    HA   LEU  40           HA       LEU  40  -3.095   8.131  -6.363
  310   1HB   LEU  40          1HB       LEU  40  -2.027  10.252  -6.791
  311   2HB   LEU  40          2HB       LEU  40  -3.574  11.074  -6.835
  312    HG   LEU  40           HG       LEU  40  -3.879  10.586  -4.426
  313   1HD1  LEU  40          1HD1      LEU  40  -1.979   9.793  -3.113
  314   2HD1  LEU  40          2HD1      LEU  40  -2.513   8.576  -4.274
  315   3HD1  LEU  40          3HD1      LEU  40  -1.063   9.528  -4.596
  316   1HD2  LEU  40          1HD2      LEU  40  -1.324  12.022  -5.133
  317   2HD2  LEU  40          2HD2      LEU  40  -2.945  12.716  -5.132
  318   3HD2  LEU  40          3HD2      LEU  40  -2.211  12.187  -3.618
  319    H    VAL  41           H        VAL  41  -4.497   7.214  -5.034
  320    HA   VAL  41           HA       VAL  41  -7.236   8.240  -4.916
  321    HB   VAL  41           HB       VAL  41  -6.139   5.714  -3.671
  322   1HG1  VAL  41          1HG1      VAL  41  -8.495   5.051  -3.522
  323   2HG1  VAL  41          2HG1      VAL  41  -8.167   6.519  -2.602
  324   3HG1  VAL  41          3HG1      VAL  41  -8.970   6.622  -4.168
  325   1HG2  VAL  41          1HG2      VAL  41  -7.605   6.065  -6.284
  326   2HG2  VAL  41          2HG2      VAL  41  -5.914   5.605  -6.092
  327   3HG2  VAL  41          3HG2      VAL  41  -7.191   4.522  -5.540
  328    H    GLU  42           H        GLU  42  -7.218   9.959  -3.598
  329    HA   GLU  42           HA       GLU  42  -5.700  10.045  -1.155
  330   1HB   GLU  42          1HB       GLU  42  -6.161  12.063  -2.501
  331   2HB   GLU  42          2HB       GLU  42  -7.882  11.866  -2.203
  332   1HG   GLU  42          1HG       GLU  42  -7.291  12.054   0.274
  333   2HG   GLU  42          2HG       GLU  42  -5.725  12.648  -0.278
  334    H    HIS  43           H        HIS  43  -8.801   8.978  -2.131
  335    HA   HIS  43           HA       HIS  43 -10.007   9.347   0.478
  336   1HB   HIS  43          1HB       HIS  43 -11.086   8.302  -2.136
  337   2HB   HIS  43          2HB       HIS  43 -12.022   8.297  -0.645
  338    HD1  HIS  43           HD1      HIS  43 -13.512  10.237  -0.445
  339    HD2  HIS  43           HD2      HIS  43 -10.092  11.139  -2.637
  340    HE1  HIS  43           HE1      HIS  43 -13.756  12.646  -1.136
  341    HE2  HIS  43           HE2      HIS  43 -11.594  13.212  -2.298
  342    H    TRP  44           H        TRP  44  -8.758   7.931   1.732
  343    HA   TRP  44           HA       TRP  44  -9.908   5.247   1.630
  344   1HB   TRP  44          1HB       TRP  44  -7.496   5.296   0.709
  345   2HB   TRP  44          2HB       TRP  44  -7.010   5.611   2.372
  346    HD1  TRP  44           HD1      TRP  44  -9.708   3.106   1.179
  347    HE1  TRP  44           HE1      TRP  44  -9.053   0.762   2.006
  348    HE3  TRP  44           HE3      TRP  44  -5.177   4.228   3.265
  349    HZ2  TRP  44           HZ2      TRP  44  -6.895  -0.452   3.355
  350    HZ3  TRP  44           HZ3      TRP  44  -3.877   2.412   4.299
  351    HH2  TRP  44           HH2      TRP  44  -4.720   0.121   4.342
  352    HA   PRO  45           HA       PRO  45 -10.645   7.223   5.594
  353   1HB   PRO  45          1HB       PRO  45 -12.930   5.949   6.179
  354   2HB   PRO  45          2HB       PRO  45 -12.854   7.192   4.926
  355   1HG   PRO  45          1HG       PRO  45 -12.861   4.213   4.643
  356   2HG   PRO  45          2HG       PRO  45 -13.724   5.432   3.687
  357   1HD   PRO  45          1HD       PRO  45 -11.379   4.237   2.903
  358   2HD   PRO  45          2HD       PRO  45 -11.918   5.833   2.348
  359    H    VAL  46           H        VAL  46  -8.811   4.889   5.411
  360    HA   VAL  46           HA       VAL  46  -9.513   3.606   7.974
  361    HB   VAL  46           HB       VAL  46  -7.723   2.435   5.832
  362   1HG1  VAL  46          1HG1      VAL  46  -7.177   1.676   8.077
  363   2HG1  VAL  46          2HG1      VAL  46  -8.862   1.235   8.355
  364   3HG1  VAL  46          3HG1      VAL  46  -7.913   0.373   7.145
  365   1HG2  VAL  46          1HG2      VAL  46 -10.022   2.528   5.035
  366   2HG2  VAL  46          2HG2      VAL  46  -9.555   0.866   5.388
  367   3HG2  VAL  46          3HG2      VAL  46 -10.583   1.750   6.515
  368    HA   PRO  47           HA       PRO  47  -5.679   6.015   8.775
  369   1HB   PRO  47          1HB       PRO  47  -6.442   7.140  11.083
  370   2HB   PRO  47          2HB       PRO  47  -6.993   7.771   9.526
  371   1HG   PRO  47          1HG       PRO  47  -8.438   6.044  11.492
  372   2HG   PRO  47          2HG       PRO  47  -9.051   7.397  10.525
  373   1HD   PRO  47          1HD       PRO  47  -9.383   4.724   9.893
  374   2HD   PRO  47          2HD       PRO  47  -9.481   6.059   8.730
  375    H    SER  48           H        SER  48  -7.459   3.664  10.529
  376    HA   SER  48           HA       SER  48  -5.020   2.848  11.941
  377   1HB   SER  48          1HB       SER  48  -7.810   2.754  13.120
  378   2HB   SER  48          2HB       SER  48  -6.308   2.299  13.924
  379    HG   SER  48           HG       SER  48  -5.873   4.717  13.147
  380    H    LEU  49           H        LEU  49  -4.639   0.658  11.900
  381    HA   LEU  49           HA       LEU  49  -6.178  -0.751   9.905
  382   1HB   LEU  49          1HB       LEU  49  -4.449  -2.509  10.142
  383   2HB   LEU  49          2HB       LEU  49  -3.829  -0.930   9.706
  384    HG   LEU  49           HG       LEU  49  -3.439  -0.744  12.318
  385   1HD1  LEU  49          1HD1      LEU  49  -2.758  -2.884  13.268
  386   2HD1  LEU  49          2HD1      LEU  49  -4.474  -2.879  12.859
  387   3HD1  LEU  49          3HD1      LEU  49  -3.321  -3.711  11.815
  388   1HD2  LEU  49          1HD2      LEU  49  -1.161  -1.514  11.938
  389   2HD2  LEU  49          2HD2      LEU  49  -1.673  -2.325  10.458
  390   3HD2  LEU  49          3HD2      LEU  49  -1.745  -0.567  10.570
  391    H    GLY  50           H        GLY  50  -6.653  -0.328  13.096
  392   1HA   GLY  50          1HA       GLY  50  -7.487  -2.926  13.909
  393   2HA   GLY  50          2HA       GLY  50  -8.000  -1.402  14.624
  394    H    GLN  51           H        GLN  51  -8.735  -0.683  11.707
  395    HA   GLN  51           HA       GLN  51 -11.313  -2.102  11.623
  396   1HB   GLN  51          1HB       GLN  51 -10.539   0.630  10.577
  397   2HB   GLN  51          2HB       GLN  51 -12.087  -0.141  10.266
  398   1HG   GLN  51          1HG       GLN  51 -11.105   0.357  13.054
  399   2HG   GLN  51          2HG       GLN  51 -11.959   1.591  12.132
  400   1HE2  GLN  51          2HE2      GLN  51 -12.690  -1.816  11.836
  401   2HE2  GLN  51          1HE2      GLN  51 -14.240  -1.747  12.598
  402    H    LEU  52           H        LEU  52  -8.462  -2.565  10.437
  403    HA   LEU  52           HA       LEU  52  -8.838  -2.282   7.611
  404   1HB   LEU  52          1HB       LEU  52  -6.622  -2.190   8.823
  405   2HB   LEU  52          2HB       LEU  52  -6.735  -3.931   9.001
  406    HG   LEU  52           HG       LEU  52  -6.734  -4.190   6.561
  407   1HD1  LEU  52          1HD1      LEU  52  -7.807  -2.083   5.970
  408   2HD1  LEU  52          2HD1      LEU  52  -6.387  -1.194   6.520
  409   3HD1  LEU  52          3HD1      LEU  52  -6.271  -2.266   5.124
  410   1HD2  LEU  52          1HD2      LEU  52  -4.618  -4.206   7.803
  411   2HD2  LEU  52          2HD2      LEU  52  -4.419  -3.558   6.175
  412   3HD2  LEU  52          3HD2      LEU  52  -4.470  -2.467   7.560
  413    H    GLN  53           H        GLN  53 -10.007  -3.524   6.435
  414    HA   GLN  53           HA       GLN  53 -10.117  -6.397   6.821
  415   1HB   GLN  53          1HB       GLN  53 -11.906  -5.519   8.278
  416   2HB   GLN  53          2HB       GLN  53 -12.568  -4.613   6.929
  417   1HG   GLN  53          1HG       GLN  53 -13.150  -6.660   5.792
  418   2HG   GLN  53          2HG       GLN  53 -12.390  -7.612   7.067
  419   1HE2  GLN  53          2HE2      GLN  53 -13.401  -7.812   9.049
  420   2HE2  GLN  53          1HE2      GLN  53 -15.068  -7.405   9.276
  421    HA   PRO  54           HA       PRO  54 -10.063  -6.350   2.368
  422   1HB   PRO  54          1HB       PRO  54 -12.174  -8.452   2.594
  423   2HB   PRO  54          2HB       PRO  54 -10.676  -8.457   1.655
  424   1HG   PRO  54          1HG       PRO  54 -10.841  -9.841   3.913
  425   2HG   PRO  54          2HG       PRO  54  -9.362  -8.952   3.506
  426   1HD   PRO  54          1HD       PRO  54 -11.499  -8.278   5.474
  427   2HD   PRO  54          2HD       PRO  54  -9.749  -8.000   5.565
  428    H    ALA  55           H        ALA  55 -13.064  -6.082   4.133
  429    HA   ALA  55           HA       ALA  55 -14.748  -5.352   1.986
  430   1HB   ALA  55          1HB       ALA  55 -16.266  -4.523   3.702
  431   2HB   ALA  55          2HB       ALA  55 -15.599  -6.090   4.159
  432   3HB   ALA  55          3HB       ALA  55 -14.977  -4.617   4.902
  433    H    HIS  56           H        HIS  56 -12.421  -3.568   3.877
  434    HA   HIS  56           HA       HIS  56 -13.287  -1.058   2.609
  435   1HB   HIS  56          1HB       HIS  56 -11.516  -1.594   4.992
  436   2HB   HIS  56          2HB       HIS  56 -11.603  -0.014   4.221
  437    HD1  HIS  56           HD1      HIS  56 -14.166   0.980   4.094
  438    HD2  HIS  56           HD2      HIS  56 -13.363  -1.937   6.951
  439    HE1  HIS  56           HE1      HIS  56 -16.029   1.141   5.769
  440    HE2  HIS  56           HE2      HIS  56 -15.615  -0.735   7.398
  441    H    MET  57           H        MET  57 -11.020  -3.522   2.381
  442    HA   MET  57           HA       MET  57  -9.157  -1.888   0.830
  443   1HB   MET  57          1HB       MET  57  -9.040  -4.784   1.685
  444   2HB   MET  57          2HB       MET  57  -7.823  -4.002   0.685
  445   1HG   MET  57          1HG       MET  57  -7.361  -2.420   2.489
  446   2HG   MET  57          2HG       MET  57  -8.570  -3.218   3.494
  447   1HE   MET  57          1HE       MET  57  -4.658  -5.227   2.094
  448   2HE   MET  57          2HE       MET  57  -5.093  -3.563   1.708
  449   3HE   MET  57          3HE       MET  57  -6.011  -4.899   1.011
  450    H    ASP  58           H        ASP  58 -12.022  -3.125   0.301
  451    HA   ASP  58           HA       ASP  58 -11.843  -4.837  -1.901
  452   1HB   ASP  58          1HB       ASP  58 -13.916  -4.523  -0.645
  453   2HB   ASP  58          2HB       ASP  58 -14.014  -2.850  -1.183
  454    H    ALA  59           H        ALA  59 -11.975  -1.312  -1.700
  455    HA   ALA  59           HA       ALA  59 -12.045  -0.721  -4.431
  456   1HB   ALA  59          1HB       ALA  59 -12.345   0.960  -2.674
  457   2HB   ALA  59          2HB       ALA  59 -10.641   0.814  -2.244
  458   3HB   ALA  59          3HB       ALA  59 -11.101   1.446  -3.826
  459    H    VAL  60           H        VAL  60  -9.340  -1.512  -2.316
  460    HA   VAL  60           HA       VAL  60  -7.282  -1.019  -4.216
  461    HB   VAL  60           HB       VAL  60  -7.154  -2.949  -1.891
  462   1HG1  VAL  60          1HG1      VAL  60  -5.285  -3.100  -3.441
  463   2HG1  VAL  60          2HG1      VAL  60  -5.014  -1.363  -3.305
  464   3HG1  VAL  60          3HG1      VAL  60  -4.765  -2.406  -1.905
  465   1HG2  VAL  60          1HG2      VAL  60  -7.983  -0.810  -1.085
  466   2HG2  VAL  60          2HG2      VAL  60  -6.325  -1.075  -0.543
  467   3HG2  VAL  60          3HG2      VAL  60  -6.651   0.025  -1.883
  468    H    LEU  61           H        LEU  61  -9.078  -3.889  -3.211
  469    HA   LEU  61           HA       LEU  61  -7.737  -5.732  -4.883
  470   1HB   LEU  61          1HB       LEU  61 -10.550  -5.830  -3.787
  471   2HB   LEU  61          2HB       LEU  61  -9.688  -7.186  -4.487
  472    HG   LEU  61           HG       LEU  61  -8.882  -5.725  -1.968
  473   1HD1  LEU  61          1HD1      LEU  61 -10.149  -8.433  -2.354
  474   2HD1  LEU  61          2HD1      LEU  61  -9.567  -7.776  -0.823
  475   3HD1  LEU  61          3HD1      LEU  61 -10.922  -7.010  -1.654
  476   1HD2  LEU  61          1HD2      LEU  61  -7.281  -7.554  -1.690
  477   2HD2  LEU  61          2HD2      LEU  61  -7.759  -8.211  -3.255
  478   3HD2  LEU  61          3HD2      LEU  61  -6.966  -6.639  -3.165
  479    H    ALA  62           H        ALA  62 -10.416  -3.543  -5.385
  480    HA   ALA  62           HA       ALA  62 -11.332  -4.612  -7.839
  481   1HB   ALA  62          1HB       ALA  62 -12.510  -2.498  -8.110
  482   2HB   ALA  62          2HB       ALA  62 -12.679  -3.101  -6.460
  483   3HB   ALA  62          3HB       ALA  62 -11.555  -1.787  -6.807
  484    H    LEU  63           H        LEU  63  -8.849  -2.251  -7.024
  485    HA   LEU  63           HA       LEU  63  -8.303  -1.435  -9.690
  486   1HB   LEU  63          1HB       LEU  63  -6.519  -1.428  -7.252
  487   2HB   LEU  63          2HB       LEU  63  -6.166  -0.603  -8.759
  488    HG   LEU  63           HG       LEU  63  -8.498   0.014  -6.941
  489   1HD1  LEU  63          1HD1      LEU  63  -6.376   0.661  -5.946
  490   2HD1  LEU  63          2HD1      LEU  63  -5.926   1.512  -7.423
  491   3HD1  LEU  63          3HD1      LEU  63  -7.285   2.084  -6.456
  492   1HD2  LEU  63          1HD2      LEU  63  -8.998   0.457  -9.285
  493   2HD2  LEU  63          2HD2      LEU  63  -8.814   1.963  -8.386
  494   3HD2  LEU  63          3HD2      LEU  63  -7.514   1.396  -9.435
  495    H    ASN  64           H        ASN  64  -7.398  -4.127  -7.749
  496    HA   ASN  64           HA       ASN  64  -6.321  -6.067  -8.141
  497   1HB   ASN  64          1HB       ASN  64  -7.907  -6.173 -10.043
  498   2HB   ASN  64          2HB       ASN  64  -6.703  -5.394 -11.065
  499   1HD2  ASN  64          2HD2      ASN  64  -4.924  -6.553 -11.747
  500   2HD2  ASN  64          1HD2      ASN  64  -4.802  -8.275 -11.586
  501    HA   PRO  65           HA       PRO  65  -2.194  -4.414  -9.055
  502   1HB   PRO  65          1HB       PRO  65  -1.224  -4.363  -6.562
  503   2HB   PRO  65          2HB       PRO  65  -2.260  -3.067  -7.168
  504   1HG   PRO  65          1HG       PRO  65  -2.878  -5.238  -5.252
  505   2HG   PRO  65          2HG       PRO  65  -3.593  -3.624  -5.394
  506   1HD   PRO  65          1HD       PRO  65  -4.632  -6.095  -6.391
  507   2HD   PRO  65          2HD       PRO  65  -5.308  -4.468  -6.603
  508    H    ALA  66           H        ALA  66  -0.037  -5.437  -8.345
  509    HA   ALA  66           HA       ALA  66  -0.375  -8.349  -8.182
  510   1HB   ALA  66          1HB       ALA  66   2.049  -6.718  -8.939
  511   2HB   ALA  66          2HB       ALA  66   1.936  -8.479  -8.970
  512   3HB   ALA  66          3HB       ALA  66   0.946  -7.512 -10.064
  513    H    VAL  67           H        VAL  67   1.393  -5.647  -6.767
  514    HA   VAL  67           HA       VAL  67   1.673  -7.207  -4.294
  515    HB   VAL  67           HB       VAL  67   3.849  -7.282  -5.334
  516   1HG1  VAL  67          1HG1      VAL  67   5.103  -5.256  -5.909
  517   2HG1  VAL  67          2HG1      VAL  67   3.632  -5.419  -6.867
  518   3HG1  VAL  67          3HG1      VAL  67   3.687  -4.280  -5.522
  519   1HG2  VAL  67          1HG2      VAL  67   5.229  -6.169  -3.642
  520   2HG2  VAL  67          2HG2      VAL  67   3.830  -5.230  -3.123
  521   3HG2  VAL  67          3HG2      VAL  67   3.839  -6.981  -2.919
  522    H    ILE  68           H        ILE  68   1.336  -6.067  -2.421
  523    HA   ILE  68           HA       ILE  68   0.586  -3.232  -2.753
  524    HB   ILE  68           HB       ILE  68  -0.639  -5.208  -0.814
  525   1HG1  ILE  68          1HG1      ILE  68  -1.835  -3.926  -3.286
  526   2HG1  ILE  68          2HG1      ILE  68  -1.328  -5.607  -3.160
  527   1HG2  ILE  68          1HG2      ILE  68  -1.317  -2.326  -1.392
  528   2HG2  ILE  68          2HG2      ILE  68  -2.221  -3.398  -0.321
  529   3HG2  ILE  68          3HG2      ILE  68  -0.563  -2.947   0.076
  530   1HD1  ILE  68          1HD1      ILE  68  -3.011  -5.987  -1.438
  531   2HD1  ILE  68          2HD1      ILE  68  -3.515  -4.301  -1.558
  532   3HD1  ILE  68          3HD1      ILE  68  -3.732  -5.387  -2.931
  533    H    LEU  69           H        LEU  69   1.884  -1.917  -1.701
  534    HA   LEU  69           HA       LEU  69   3.425  -2.937   0.575
  535   1HB   LEU  69          1HB       LEU  69   3.770  -0.472  -1.130
  536   2HB   LEU  69          2HB       LEU  69   4.749  -0.832   0.278
  537    HG   LEU  69           HG       LEU  69   4.594  -2.564  -2.190
  538   1HD1  LEU  69          1HD1      LEU  69   6.839  -1.729  -2.668
  539   2HD1  LEU  69          2HD1      LEU  69   5.653  -0.425  -2.669
  540   3HD1  LEU  69          3HD1      LEU  69   6.729  -0.636  -1.288
  541   1HD2  LEU  69          1HD2      LEU  69   6.407  -2.672   0.217
  542   2HD2  LEU  69          2HD2      LEU  69   5.120  -3.814  -0.167
  543   3HD2  LEU  69          3HD2      LEU  69   6.533  -3.693  -1.215
  544    H    LEU  70           H        LEU  70   2.442  -2.643   2.448
  545    HA   LEU  70           HA       LEU  70   0.748  -0.289   2.835
  546   1HB   LEU  70          1HB       LEU  70  -0.190  -2.491   3.409
  547   2HB   LEU  70          2HB       LEU  70   1.113  -2.749   4.552
  548    HG   LEU  70           HG       LEU  70   0.297  -0.803   5.866
  549   1HD1  LEU  70          1HD1      LEU  70  -1.935   0.078   5.408
  550   2HD1  LEU  70          2HD1      LEU  70  -0.824   0.406   4.078
  551   3HD1  LEU  70          3HD1      LEU  70  -2.015  -0.887   3.934
  552   1HD2  LEU  70          1HD2      LEU  70  -1.724  -2.988   5.379
  553   2HD2  LEU  70          2HD2      LEU  70  -0.351  -3.066   6.484
  554   3HD2  LEU  70          3HD2      LEU  70  -1.668  -1.935   6.792
  555    H    GLY  71           H        GLY  71   1.685   1.436   3.638
  556   1HA   GLY  71          1HA       GLY  71   4.052   1.168   5.333
  557   2HA   GLY  71          2HA       GLY  71   3.428   2.663   4.644
  558    H    THR  72           H        THR  72   3.883   1.132   7.460
  559    HA   THR  72           HA       THR  72   1.375   1.986   8.706
  560    HB   THR  72           HB       THR  72   2.423   0.802  10.738
  561    HG1  THR  72           HG1      THR  72   4.109  -0.196   8.654
  562   1HG2  THR  72          1HG2      THR  72   1.770  -0.793   8.257
  563   2HG2  THR  72          2HG2      THR  72   1.743  -1.404   9.912
  564   3HG2  THR  72          3HG2      THR  72   0.602  -0.154   9.414
  565    H    GLY  73           H        GLY  73   3.093   4.035   7.835
  566   1HA   GLY  73          1HA       GLY  73   4.334   5.844   8.484
  567   2HA   GLY  73          2HA       GLY  73   3.411   5.723   9.973
  568    H    GLU  74           H        GLU  74   4.540   5.544  11.726
  569    HA   GLU  74           HA       GLU  74   7.229   4.336  11.644
  570   1HB   GLU  74          1HB       GLU  74   7.652   5.714  13.696
  571   2HB   GLU  74          2HB       GLU  74   7.370   6.668  12.244
  572   1HG   GLU  74          1HG       GLU  74   5.183   7.236  12.921
  573   2HG   GLU  74          2HG       GLU  74   5.192   6.033  14.208
  574    H    ARG  75           H        ARG  75   4.175   3.640  12.382
  575    HA   ARG  75           HA       ARG  75   4.765   2.356  14.964
  576   1HB   ARG  75          1HB       ARG  75   2.944   4.280  14.577
  577   2HB   ARG  75          2HB       ARG  75   1.964   2.900  14.108
  578   1HG   ARG  75          1HG       ARG  75   1.844   2.091  16.222
  579   2HG   ARG  75          2HG       ARG  75   3.441   2.703  16.665
  580   1HD   ARG  75          1HD       ARG  75   0.957   4.379  16.293
  581   2HD   ARG  75          2HD       ARG  75   1.653   3.904  17.844
  582    HE   ARG  75           HE       ARG  75   3.667   5.170  16.401
  583   1HH1  ARG  75          1HH1      ARG  75   0.553   6.024  17.782
  584   2HH1  ARG  75          2HH1      ARG  75   1.003   7.680  18.056
  585   1HH2  ARG  75          1HH2      ARG  75   4.240   7.358  16.745
  586   2HH2  ARG  75          2HH2      ARG  75   3.089   8.433  17.484
  587    H    GLN  76           H        GLN  76   5.601   0.559  13.811
  588    HA   GLN  76           HA       GLN  76   4.236  -0.682  11.673
  589   1HB   GLN  76          1HB       GLN  76   6.659  -0.840  11.976
  590   2HB   GLN  76          2HB       GLN  76   6.422  -1.768  13.450
  591   1HG   GLN  76          1HG       GLN  76   5.406  -3.567  12.185
  592   2HG   GLN  76          2HG       GLN  76   5.558  -2.631  10.698
  593   1HE2  GLN  76          2HE2      GLN  76   6.674  -5.248  11.434
  594   2HE2  GLN  76          1HE2      GLN  76   8.386  -5.099  11.226
  595    H    GLN  77           H        GLN  77   2.533  -1.908  11.708
  596    HA   GLN  77           HA       GLN  77   2.212  -3.950  13.738
  597   1HB   GLN  77          1HB       GLN  77   1.004  -2.055  14.694
  598   2HB   GLN  77          2HB       GLN  77   0.108  -1.843  13.200
  599   1HG   GLN  77          1HG       GLN  77  -1.100  -3.841  13.530
  600   2HG   GLN  77          2HG       GLN  77  -0.030  -4.354  14.834
  601   1HE2  GLN  77          2HE2      GLN  77  -1.788  -4.592  16.223
  602   2HE2  GLN  77          1HE2      GLN  77  -2.576  -3.224  16.939
  603    H    PHE  78           H        PHE  78   1.170  -5.745  12.947
  604    HA   PHE  78           HA       PHE  78   1.013  -5.812  10.049
  605   1HB   PHE  78          1HB       PHE  78   0.926  -7.986  12.144
  606   2HB   PHE  78          2HB       PHE  78   0.770  -8.294  10.417
  607    HD1  PHE  78           HD1      PHE  78   2.656  -7.924   8.915
  608    HD2  PHE  78           HD2      PHE  78   3.042  -7.442  13.123
  609    HE1  PHE  78           HE1      PHE  78   5.105  -8.001   8.695
  610    HE2  PHE  78           HE2      PHE  78   5.490  -7.518  12.912
  611    HZ   PHE  78           HZ       PHE  78   6.525  -7.795  10.696
  612    HA   PRO  79           HA       PRO  79  -3.375  -5.571   9.684
  613   1HB   PRO  79          1HB       PRO  79  -3.060  -7.411   7.393
  614   2HB   PRO  79          2HB       PRO  79  -3.717  -5.773   7.435
  615   1HG   PRO  79          1HG       PRO  79  -1.328  -6.283   6.352
  616   2HG   PRO  79          2HG       PRO  79  -1.629  -4.790   7.263
  617   1HD   PRO  79          1HD       PRO  79  -0.208  -7.281   8.117
  618   2HD   PRO  79          2HD       PRO  79   0.202  -5.583   8.438
  619    H    SER  80           H        SER  80  -5.279  -6.882   9.709
  620    HA   SER  80           HA       SER  80  -5.207  -9.096  11.392
  621   1HB   SER  80          1HB       SER  80  -7.390  -8.503   9.383
  622   2HB   SER  80          2HB       SER  80  -7.553  -9.295  10.952
  623    HG   SER  80           HG       SER  80  -7.835  -6.743  10.440
  624    H    THR  81           H        THR  81  -5.179 -11.300  11.050
  625    HA   THR  81           HA       THR  81  -4.015 -12.314   8.704
  626    HB   THR  81           HB       THR  81  -3.824 -13.501  10.826
  627    HG1  THR  81           HG1      THR  81  -4.751 -14.701   8.511
  628   1HG2  THR  81          1HG2      THR  81  -6.766 -14.112  10.511
  629   2HG2  THR  81          2HG2      THR  81  -5.697 -14.810  11.727
  630   3HG2  THR  81          3HG2      THR  81  -6.044 -13.081  11.747
  631    H    ASP  82           H        ASP  82  -7.304 -11.696   9.539
  632    HA   ASP  82           HA       ASP  82  -8.685 -13.239   7.674
  633   1HB   ASP  82          1HB       ASP  82  -9.893 -12.028   9.351
  634   2HB   ASP  82          2HB       ASP  82  -9.232 -10.490   8.804
  635    H    VAL  83           H        VAL  83  -7.003 -10.169   7.308
  636    HA   VAL  83           HA       VAL  83  -7.880  -9.615   4.662
  637    HB   VAL  83           HB       VAL  83  -5.360  -8.672   6.048
  638   1HG1  VAL  83          1HG1      VAL  83  -5.458  -6.795   4.473
  639   2HG1  VAL  83          2HG1      VAL  83  -5.272  -8.341   3.645
  640   3HG1  VAL  83          3HG1      VAL  83  -6.844  -7.541   3.678
  641   1HG2  VAL  83          1HG2      VAL  83  -6.628  -6.679   6.652
  642   2HG2  VAL  83          2HG2      VAL  83  -8.075  -7.362   5.913
  643   3HG2  VAL  83          3HG2      VAL  83  -7.369  -8.125   7.336
  644    H    LEU  84           H        LEU  84  -5.168 -11.346   6.048
  645    HA   LEU  84           HA       LEU  84  -3.601 -11.601   3.725
  646   1HB   LEU  84          1HB       LEU  84  -3.751 -13.421   6.131
  647   2HB   LEU  84          2HB       LEU  84  -2.472 -13.429   4.931
  648    HG   LEU  84           HG       LEU  84  -3.109 -11.138   6.795
  649   1HD1  LEU  84          1HD1      LEU  84  -0.820 -13.100   6.791
  650   2HD1  LEU  84          2HD1      LEU  84  -0.988 -11.709   7.862
  651   3HD1  LEU  84          3HD1      LEU  84  -2.137 -13.043   7.963
  652   1HD2  LEU  84          1HD2      LEU  84  -0.868 -11.495   4.808
  653   2HD2  LEU  84          2HD2      LEU  84  -2.219 -10.372   4.656
  654   3HD2  LEU  84          3HD2      LEU  84  -1.036 -10.158   5.946
  655    H    ALA  85           H        ALA  85  -6.305 -13.451   4.954
  656    HA   ALA  85           HA       ALA  85  -6.024 -15.752   3.369
  657   1HB   ALA  85          1HB       ALA  85  -8.386 -16.149   3.833
  658   2HB   ALA  85          2HB       ALA  85  -7.542 -15.617   5.287
  659   3HB   ALA  85          3HB       ALA  85  -8.563 -14.487   4.398
  660    H    ALA  86           H        ALA  86  -7.715 -12.699   2.771
  661    HA   ALA  86           HA       ALA  86  -8.780 -13.455   0.249
  662   1HB   ALA  86          1HB       ALA  86  -9.295 -11.089  -0.028
  663   2HB   ALA  86          2HB       ALA  86  -9.732 -11.640   1.590
  664   3HB   ALA  86          3HB       ALA  86  -8.265 -10.693   1.347
  665    H    CYS  87           H        CYS  87  -5.797 -11.944   1.288
  666    HA   CYS  87           HA       CYS  87  -4.942 -11.176  -1.321
  667   1HB   CYS  87          1HB       CYS  87  -3.305 -11.592   1.189
  668   2HB   CYS  87          2HB       CYS  87  -2.783 -10.734  -0.258
  669    HG   CYS  87           HG       CYS  87  -5.239  -9.755   1.916
  670    H    LEU  88           H        LEU  88  -4.217 -13.916   0.811
  671    HA   LEU  88           HA       LEU  88  -2.226 -15.100  -0.759
  672   1HB   LEU  88          1HB       LEU  88  -2.759 -15.621   1.627
  673   2HB   LEU  88          2HB       LEU  88  -4.176 -16.491   1.083
  674    HG   LEU  88           HG       LEU  88  -1.465 -17.301   0.085
  675   1HD1  LEU  88          1HD1      LEU  88  -2.703 -18.121   2.711
  676   2HD1  LEU  88          2HD1      LEU  88  -1.271 -18.843   1.977
  677   3HD1  LEU  88          3HD1      LEU  88  -1.239 -17.161   2.508
  678   1HD2  LEU  88          1HD2      LEU  88  -3.454 -18.311  -0.931
  679   2HD2  LEU  88          2HD2      LEU  88  -2.521 -19.501  -0.022
  680   3HD2  LEU  88          3HD2      LEU  88  -4.003 -18.833   0.661
  681    H    THR  89           H        THR  89  -5.736 -15.593  -0.739
  682    HA   THR  89           HA       THR  89  -5.778 -17.766  -2.518
  683    HB   THR  89           HB       THR  89  -8.192 -16.995  -2.931
  684    HG1  THR  89           HG1      THR  89  -7.908 -15.394  -0.648
  685   1HG2  THR  89          1HG2      THR  89  -7.264 -17.517  -0.103
  686   2HG2  THR  89          2HG2      THR  89  -8.907 -17.741  -0.705
  687   3HG2  THR  89          3HG2      THR  89  -7.594 -18.744  -1.326
  688    H    ARG  90           H        ARG  90  -5.957 -14.270  -3.098
  689    HA   ARG  90           HA       ARG  90  -6.281 -14.608  -5.940
  690   1HB   ARG  90          1HB       ARG  90  -5.737 -12.205  -4.210
  691   2HB   ARG  90          2HB       ARG  90  -5.766 -12.105  -5.964
  692   1HG   ARG  90          1HG       ARG  90  -8.100 -13.084  -5.839
  693   2HG   ARG  90          2HG       ARG  90  -8.022 -12.768  -4.102
  694   1HD   ARG  90          1HD       ARG  90  -7.672 -10.421  -4.494
  695   2HD   ARG  90          2HD       ARG  90  -7.562 -10.687  -6.232
  696    HE   ARG  90           HE       ARG  90 -10.031 -11.083  -4.653
  697   1HH1  ARG  90          1HH1      ARG  90  -8.373 -10.210  -7.617
  698   2HH1  ARG  90          2HH1      ARG  90  -9.821  -9.658  -8.414
  699   1HH2  ARG  90          1HH2      ARG  90 -11.941 -10.352  -5.708
  700   2HH2  ARG  90          2HH2      ARG  90 -11.832  -9.740  -7.328
  701    H    GLY  91           H        GLY  91  -3.640 -14.581  -3.779
  702   1HA   GLY  91          1HA       GLY  91  -1.402 -15.022  -4.287
  703   2HA   GLY  91          2HA       GLY  91  -1.757 -14.737  -5.987
  704    H    ILE  92           H        ILE  92  -2.690 -12.522  -3.476
  705    HA   ILE  92           HA       ILE  92  -1.151 -10.424  -4.773
  706    HB   ILE  92           HB       ILE  92  -3.046 -10.228  -2.421
  707   1HG1  ILE  92          1HG1      ILE  92  -4.212 -11.040  -4.414
  708   2HG1  ILE  92          2HG1      ILE  92  -4.693  -9.388  -4.044
  709   1HG2  ILE  92          1HG2      ILE  92  -3.107  -7.836  -2.957
  710   2HG2  ILE  92          2HG2      ILE  92  -1.484  -8.373  -2.527
  711   3HG2  ILE  92          3HG2      ILE  92  -1.902  -8.094  -4.218
  712   1HD1  ILE  92          1HD1      ILE  92  -2.735 -10.224  -6.169
  713   2HD1  ILE  92          2HD1      ILE  92  -4.400  -9.705  -6.428
  714   3HD1  ILE  92          3HD1      ILE  92  -3.209  -8.566  -5.800
  715    H    GLY  93           H        GLY  93   0.744  -9.707  -4.052
  716   1HA   GLY  93          1HA       GLY  93   1.850 -10.794  -1.607
  717   2HA   GLY  93          2HA       GLY  93   2.683  -9.770  -2.769
  718    H    LEU  94           H        LEU  94   0.661  -9.845   0.058
  719    HA   LEU  94           HA       LEU  94   0.637  -6.945   0.271
  720   1HB   LEU  94          1HB       LEU  94  -1.356  -8.204   0.936
  721   2HB   LEU  94          2HB       LEU  94  -0.419  -9.085   2.126
  722    HG   LEU  94           HG       LEU  94  -0.025  -6.961   3.347
  723   1HD1  LEU  94          1HD1      LEU  94  -1.356  -4.997   2.782
  724   2HD1  LEU  94          2HD1      LEU  94  -0.252  -5.419   1.473
  725   3HD1  LEU  94          3HD1      LEU  94  -1.965  -5.817   1.343
  726   1HD2  LEU  94          1HD2      LEU  94  -2.919  -7.650   2.852
  727   2HD2  LEU  94          2HD2      LEU  94  -1.842  -8.442   4.002
  728   3HD2  LEU  94          3HD2      LEU  94  -2.294  -6.754   4.237
  729    H    GLU  95           H        GLU  95   2.251  -5.879   1.149
  730    HA   GLU  95           HA       GLU  95   4.012  -7.272   3.063
  731   1HB   GLU  95          1HB       GLU  95   5.092  -6.846   0.890
  732   2HB   GLU  95          2HB       GLU  95   4.717  -5.135   1.040
  733   1HG   GLU  95          1HG       GLU  95   7.012  -5.487   1.592
  734   2HG   GLU  95          2HG       GLU  95   6.137  -5.037   3.053
  735    H    ALA  96           H        ALA  96   4.094  -6.397   5.034
  736    HA   ALA  96           HA       ALA  96   3.051  -3.671   5.398
  737   1HB   ALA  96          1HB       ALA  96   1.915  -5.437   6.662
  738   2HB   ALA  96          2HB       ALA  96   3.440  -5.857   7.442
  739   3HB   ALA  96          3HB       ALA  96   2.706  -4.280   7.732
  740    H    MET  97           H        MET  97   4.560  -2.158   5.471
  741    HA   MET  97           HA       MET  97   7.008  -2.660   7.033
  742   1HB   MET  97          1HB       MET  97   6.829  -1.393   4.294
  743   2HB   MET  97          2HB       MET  97   8.227  -1.218   5.342
  744   1HG   MET  97          1HG       MET  97   8.553  -3.645   5.296
  745   2HG   MET  97          2HG       MET  97   7.168  -3.799   4.211
  746   1HE   MET  97          1HE       MET  97   8.787  -5.157   2.532
  747   2HE   MET  97          2HE       MET  97  10.161  -4.907   3.609
  748   3HE   MET  97          3HE       MET  97  10.294  -4.499   1.898
  749    H    THR  98           H        THR  98   8.192  -0.392   7.225
  750    HA   THR  98           HA       THR  98   6.250   1.578   8.110
  751    HB   THR  98           HB       THR  98   8.314   2.888   8.747
  752    HG1  THR  98           HG1      THR  98  10.270   1.495   8.794
  753   1HG2  THR  98          1HG2      THR  98   7.153   1.493  10.380
  754   2HG2  THR  98          2HG2      THR  98   8.087   0.090   9.864
  755   3HG2  THR  98          3HG2      THR  98   8.895   1.448  10.648
  756    H    ASN  99           H        ASN  99   6.532   3.873   7.343
  757    HA   ASN  99           HA       ASN  99   6.221   3.931   4.557
  758   1HB   ASN  99          1HB       ASN  99   6.581   6.120   6.585
  759   2HB   ASN  99          2HB       ASN  99   6.408   6.474   4.867
  760   1HD2  ASN  99          2HD2      ASN  99   4.456   7.504   5.092
  761   2HD2  ASN  99          1HD2      ASN  99   2.999   6.675   5.505
  762    H    ALA 100           H        ALA 100   9.028   4.528   6.552
  763    HA   ALA 100           HA       ALA 100  10.644   5.724   4.569
  764   1HB   ALA 100          1HB       ALA 100  12.518   5.201   6.036
  765   2HB   ALA 100          2HB       ALA 100  11.164   5.850   6.961
  766   3HB   ALA 100          3HB       ALA 100  11.493   4.117   6.978
  767    H    ALA 101           H        ALA 101  10.219   2.359   5.598
  768    HA   ALA 101           HA       ALA 101  12.187   1.342   3.783
  769   1HB   ALA 101          1HB       ALA 101  11.655   0.197   5.882
  770   2HB   ALA 101          2HB       ALA 101  10.024  -0.123   5.292
  771   3HB   ALA 101          3HB       ALA 101  11.413  -0.857   4.490
  772    H    ALA 102           H        ALA 102   8.662   1.588   3.799
  773    HA   ALA 102           HA       ALA 102   8.167   0.064   1.490
  774   1HB   ALA 102          1HB       ALA 102   6.419   0.684   3.090
  775   2HB   ALA 102          2HB       ALA 102   6.557   2.368   2.589
  776   3HB   ALA 102          3HB       ALA 102   5.986   1.152   1.446
  777    H    ALA 103           H        ALA 103   9.072   3.426   1.930
  778    HA   ALA 103           HA       ALA 103   8.517   4.340  -0.675
  779   1HB   ALA 103          1HB       ALA 103   9.990   6.205  -0.144
  780   2HB   ALA 103          2HB       ALA 103   8.924   5.843   1.213
  781   3HB   ALA 103          3HB       ALA 103  10.611   5.331   1.256
  782    H    ARG 104           H        ARG 104  11.190   2.543   0.660
  783    HA   ARG 104           HA       ARG 104  12.942   3.001  -1.576
  784   1HB   ARG 104          1HB       ARG 104  13.120   0.840   0.533
  785   2HB   ARG 104          2HB       ARG 104  14.410   1.368  -0.537
  786   1HG   ARG 104          1HG       ARG 104  13.137   2.959   1.676
  787   2HG   ARG 104          2HG       ARG 104  14.758   2.267   1.660
  788   1HD   ARG 104          1HD       ARG 104  15.339   3.721  -0.237
  789   2HD   ARG 104          2HD       ARG 104  13.725   4.431  -0.171
  790    HE   ARG 104           HE       ARG 104  15.534   4.574   2.153
  791   1HH1  ARG 104          1HH1      ARG 104  13.572   6.161  -0.294
  792   2HH1  ARG 104          2HH1      ARG 104  13.720   7.737   0.433
  793   1HH2  ARG 104          1HH2      ARG 104  15.753   6.645   3.080
  794   2HH2  ARG 104          2HH2      ARG 104  14.974   8.017   2.339
  795    H    THR 105           H        THR 105  10.969   0.297  -0.409
  796    HA   THR 105           HA       THR 105  11.531  -1.475  -2.511
  797    HB   THR 105           HB       THR 105   8.978  -1.342  -0.889
  798    HG1  THR 105           HG1      THR 105  10.078  -2.234   0.727
  799   1HG2  THR 105          1HG2      THR 105  10.363  -3.649  -2.267
  800   2HG2  THR 105          2HG2      THR 105   8.907  -3.765  -1.279
  801   3HG2  THR 105          3HG2      THR 105   8.871  -2.872  -2.800
  802    H    TYR 106           H        TYR 106   9.037   1.012  -2.135
  803    HA   TYR 106           HA       TYR 106   7.569   0.409  -4.463
  804   1HB   TYR 106          1HB       TYR 106   6.717   1.887  -2.685
  805   2HB   TYR 106          2HB       TYR 106   7.937   3.087  -3.099
  806    HD1  TYR 106           HD1      TYR 106   5.028   1.246  -4.518
  807    HD2  TYR 106           HD2      TYR 106   7.468   4.726  -4.699
  808    HE1  TYR 106           HE1      TYR 106   3.477   2.242  -6.146
  809    HE2  TYR 106           HE2      TYR 106   5.923   5.732  -6.328
  810    HH   TYR 106           HH       TYR 106   4.236   5.014  -7.957
  811    H    ASN 107           H        ASN 107  10.424   2.373  -3.905
  812    HA   ASN 107           HA       ASN 107  10.619   3.636  -6.392
  813   1HB   ASN 107          1HB       ASN 107  12.018   4.312  -4.540
  814   2HB   ASN 107          2HB       ASN 107  12.765   2.723  -4.463
  815   1HD2  ASN 107          2HD2      ASN 107  12.111   4.434  -7.460
  816   2HD2  ASN 107          1HD2      ASN 107  13.768   4.702  -7.873
  817    H    VAL 108           H        VAL 108  11.910   0.518  -5.298
  818    HA   VAL 108           HA       VAL 108  13.201  -0.186  -7.696
  819    HB   VAL 108           HB       VAL 108  12.016  -2.014  -5.597
  820   1HG1  VAL 108          1HG1      VAL 108  13.644  -3.661  -6.409
  821   2HG1  VAL 108          2HG1      VAL 108  12.489  -3.206  -7.663
  822   3HG1  VAL 108          3HG1      VAL 108  14.125  -2.546  -7.687
  823   1HG2  VAL 108          1HG2      VAL 108  13.596  -0.434  -4.636
  824   2HG2  VAL 108          2HG2      VAL 108  14.279  -2.061  -4.656
  825   3HG2  VAL 108          3HG2      VAL 108  14.796  -0.873  -5.852
  826    H    LEU 109           H        LEU 109   9.970  -0.981  -6.464
  827    HA   LEU 109           HA       LEU 109   9.235  -2.613  -8.651
  828   1HB   LEU 109          1HB       LEU 109   7.506  -1.142  -6.664
  829   2HB   LEU 109          2HB       LEU 109   6.945  -2.399  -7.752
  830    HG   LEU 109           HG       LEU 109   9.015  -2.786  -5.585
  831   1HD1  LEU 109          1HD1      LEU 109   7.277  -4.050  -4.429
  832   2HD1  LEU 109          2HD1      LEU 109   6.807  -2.366  -4.650
  833   3HD1  LEU 109          3HD1      LEU 109   6.120  -3.618  -5.685
  834   1HD2  LEU 109          1HD2      LEU 109   9.332  -4.292  -7.473
  835   2HD2  LEU 109          2HD2      LEU 109   8.731  -5.169  -6.067
  836   3HD2  LEU 109          3HD2      LEU 109   7.636  -4.771  -7.392
  837    H    ALA 110           H        ALA 110   8.975   0.834  -8.060
  838    HA   ALA 110           HA       ALA 110   7.237   1.466 -10.192
  839   1HB   ALA 110          1HB       ALA 110   7.756   3.047  -8.394
  840   2HB   ALA 110          2HB       ALA 110   9.417   3.165  -8.975
  841   3HB   ALA 110          3HB       ALA 110   8.088   3.745  -9.979
  842    H    SER 111           H        SER 111  10.711   0.966 -10.011
  843    HA   SER 111           HA       SER 111  11.170   1.735 -12.739
  844   1HB   SER 111          1HB       SER 111  12.917   0.295 -10.730
  845   2HB   SER 111          2HB       SER 111  13.453   0.807 -12.331
  846    HG   SER 111           HG       SER 111  12.429   2.955 -11.377
  847    H    GLU 112           H        GLU 112  10.393  -1.196 -11.025
  848    HA   GLU 112           HA       GLU 112  11.023  -3.010 -13.121
  849   1HB   GLU 112          1HB       GLU 112  10.756  -3.777 -10.821
  850   2HB   GLU 112          2HB       GLU 112   9.078  -3.254 -10.813
  851   1HG   GLU 112          1HG       GLU 112   8.462  -4.939 -12.372
  852   2HG   GLU 112          2HG       GLU 112  10.147  -5.354 -12.679
  853    H    GLY 113           H        GLY 113   8.148  -1.182 -12.222
  854   1HA   GLY 113          1HA       GLY 113   6.590  -0.335 -13.765
  855   2HA   GLY 113          2HA       GLY 113   7.181  -1.477 -14.961
  856    H    ARG 114           H        ARG 114   6.725  -3.037 -12.070
  857    HA   ARG 114           HA       ARG 114   4.355  -4.364 -13.062
  858   1HB   ARG 114          1HB       ARG 114   6.183  -5.691 -12.148
  859   2HB   ARG 114          2HB       ARG 114   6.074  -4.835 -10.618
  860   1HG   ARG 114          1HG       ARG 114   4.041  -5.866 -10.063
  861   2HG   ARG 114          2HG       ARG 114   3.789  -6.439 -11.714
  862   1HD   ARG 114          1HD       ARG 114   6.126  -7.317 -10.039
  863   2HD   ARG 114          2HD       ARG 114   4.574  -8.153 -10.007
  864    HE   ARG 114           HE       ARG 114   4.939  -8.372 -12.526
  865   1HH1  ARG 114          1HH1      ARG 114   7.619  -8.130 -10.292
  866   2HH1  ARG 114          2HH1      ARG 114   8.632  -9.220 -11.185
  867   1HH2  ARG 114          1HH2      ARG 114   6.278  -9.770 -13.732
  868   2HH2  ARG 114          2HH2      ARG 114   7.870 -10.157 -13.147
  869    H    ARG 115           H        ARG 115   2.364  -4.471 -11.961
  870    HA   ARG 115           HA       ARG 115   1.575  -1.978 -10.901
  871   1HB   ARG 115          1HB       ARG 115   0.217  -4.573 -11.404
  872   2HB   ARG 115          2HB       ARG 115  -0.571  -3.432 -10.322
  873   1HG   ARG 115          1HG       ARG 115  -0.553  -1.734 -12.048
  874   2HG   ARG 115          2HG       ARG 115   0.320  -2.816 -13.132
  875   1HD   ARG 115          1HD       ARG 115  -1.537  -4.269 -13.328
  876   2HD   ARG 115          2HD       ARG 115  -2.366  -3.509 -11.970
  877    HE   ARG 115           HE       ARG 115  -2.977  -1.726 -13.345
  878   1HH1  ARG 115          1HH1      ARG 115  -1.011  -4.045 -15.088
  879   2HH1  ARG 115          2HH1      ARG 115  -1.426  -3.419 -16.655
  880   1HH2  ARG 115          1HH2      ARG 115  -3.558  -0.920 -15.406
  881   2HH2  ARG 115          2HH2      ARG 115  -2.924  -1.686 -16.837
  882    H    VAL 116           H        VAL 116   2.464  -1.372  -9.065
  883    HA   VAL 116           HA       VAL 116   2.010  -3.035  -6.687
  884    HB   VAL 116           HB       VAL 116   4.356  -2.561  -6.954
  885   1HG1  VAL 116          1HG1      VAL 116   5.242  -0.276  -7.047
  886   2HG1  VAL 116          2HG1      VAL 116   4.216  -0.642  -8.435
  887   3HG1  VAL 116          3HG1      VAL 116   3.594   0.352  -7.117
  888   1HG2  VAL 116          1HG2      VAL 116   4.846  -1.341  -4.882
  889   2HG2  VAL 116          2HG2      VAL 116   3.178  -0.771  -4.829
  890   3HG2  VAL 116          3HG2      VAL 116   3.528  -2.493  -4.669
  891    H    ALA 117           H        ALA 117   0.770  -2.271  -5.068
  892    HA   ALA 117           HA       ALA 117  -0.430   0.393  -5.416
  893   1HB   ALA 117          1HB       ALA 117  -2.232  -0.402  -3.970
  894   2HB   ALA 117          2HB       ALA 117  -2.019  -1.475  -5.354
  895   3HB   ALA 117          3HB       ALA 117  -1.401  -1.945  -3.770
  896    H    LEU 118           H        LEU 118   0.549   1.913  -4.243
  897    HA   LEU 118           HA       LEU 118   1.916   1.164  -1.777
  898   1HB   LEU 118          1HB       LEU 118   3.041   2.599  -3.480
  899   2HB   LEU 118          2HB       LEU 118   1.834   3.836  -3.179
  900    HG   LEU 118           HG       LEU 118   2.605   3.947  -0.812
  901   1HD1  LEU 118          1HD1      LEU 118   3.559   1.706  -0.649
  902   2HD1  LEU 118          2HD1      LEU 118   4.812   2.148  -1.808
  903   3HD1  LEU 118          3HD1      LEU 118   4.752   2.936  -0.232
  904   1HD2  LEU 118          1HD2      LEU 118   4.657   5.177  -1.300
  905   2HD2  LEU 118          2HD2      LEU 118   4.717   4.448  -2.905
  906   3HD2  LEU 118          3HD2      LEU 118   3.399   5.540  -2.481
  907    H    ALA 119           H        ALA 119   0.514   0.987  -0.134
  908    HA   ALA 119           HA       ALA 119  -1.500   3.094   0.230
  909   1HB   ALA 119          1HB       ALA 119  -1.266   0.406   1.587
  910   2HB   ALA 119          2HB       ALA 119  -2.570   1.571   1.812
  911   3HB   ALA 119          3HB       ALA 119  -2.344   0.795   0.244
  912    H    MET 120           H        MET 120  -0.577   4.751   1.273
  913    HA   MET 120           HA       MET 120   1.337   4.188   3.413
  914   1HB   MET 120          1HB       MET 120   0.687   6.676   1.854
  915   2HB   MET 120          2HB       MET 120   1.637   6.734   3.329
  916   1HG   MET 120          1HG       MET 120   2.333   5.248   0.810
  917   2HG   MET 120          2HG       MET 120   3.068   6.739   1.398
  918   1HE   MET 120          1HE       MET 120   5.567   5.968   1.479
  919   2HE   MET 120          2HE       MET 120   4.988   4.568   0.577
  920   3HE   MET 120          3HE       MET 120   6.047   4.344   1.970
  921    H    ILE 121           H        ILE 121   0.577   4.043   5.389
  922    HA   ILE 121           HA       ILE 121  -1.541   5.898   6.241
  923    HB   ILE 121           HB       ILE 121  -0.436   3.473   7.686
  924   1HG1  ILE 121          1HG1      ILE 121  -3.091   3.829   6.274
  925   2HG1  ILE 121          2HG1      ILE 121  -1.743   2.867   5.677
  926   1HG2  ILE 121          1HG2      ILE 121  -2.770   5.262   8.354
  927   2HG2  ILE 121          2HG2      ILE 121  -2.325   3.791   9.218
  928   3HG2  ILE 121          3HG2      ILE 121  -1.235   5.178   9.220
  929   1HD1  ILE 121          1HD1      ILE 121  -3.291   2.353   8.209
  930   2HD1  ILE 121          2HD1      ILE 121  -3.455   1.470   6.691
  931   3HD1  ILE 121          3HD1      ILE 121  -1.947   1.384   7.604
  932    H    VAL 122           H        VAL 122  -0.703   7.754   7.025
  933    HA   VAL 122           HA       VAL 122   1.839   7.554   8.499
  934    HB   VAL 122           HB       VAL 122   1.612  10.206   8.292
  935   1HG1  VAL 122          1HG1      VAL 122   3.085  10.068   6.342
  936   2HG1  VAL 122          2HG1      VAL 122   3.509   8.873   7.567
  937   3HG1  VAL 122          3HG1      VAL 122   2.627   8.379   6.122
  938   1HG2  VAL 122          1HG2      VAL 122   0.768  10.854   6.115
  939   2HG2  VAL 122          2HG2      VAL 122   0.285   9.189   5.781
  940   3HG2  VAL 122          3HG2      VAL 122  -0.517  10.103   7.061
  941    H    GLY 123           H        GLY 123   1.668   7.424  10.581
  942   1HA   GLY 123          1HA       GLY 123  -0.752   8.219  11.946
  943   2HA   GLY 123          2HA       GLY 123   0.633   7.413  12.656
  944    H    GLY 124           H        GLY 124  -0.239  10.498  11.215
  945   1HA   GLY 124          1HA       GLY 124   0.888  11.877  13.541
  946   2HA   GLY 124          2HA       GLY 124   1.523  12.297  11.953
  947    H    LEU 125           H        LEU 125  -1.655  11.728  13.417
  948    HA   LEU 125           HA       LEU 125  -2.826  13.750  11.694
  949   1HB   LEU 125          1HB       LEU 125  -3.950  11.586  12.088
  950   2HB   LEU 125          2HB       LEU 125  -4.079  11.973  13.793
  951    HG   LEU 125           HG       LEU 125  -5.521  13.917  13.188
  952   1HD1  LEU 125          1HD1      LEU 125  -6.487  13.998  10.945
  953   2HD1  LEU 125          2HD1      LEU 125  -4.741  14.246  10.903
  954   3HD1  LEU 125          3HD1      LEU 125  -5.422  12.687  10.439
  955   1HD2  LEU 125          1HD2      LEU 125  -6.489  11.799  13.907
  956   2HD2  LEU 125          2HD2      LEU 125  -7.501  12.573  12.687
  957   3HD2  LEU 125          3HD2      LEU 125  -6.467  11.214  12.244
  958    H    GLU 126           H        GLU 126  -1.590  13.490  14.874
  959    HA   GLU 126           HA       GLU 126  -3.250  15.521  16.035
  960   1HB   GLU 126          1HB       GLU 126  -1.753  15.343  17.986
  961   2HB   GLU 126          2HB       GLU 126  -2.376  13.785  17.470
  962   1HG   GLU 126          1HG       GLU 126  -0.271  13.228  16.446
  963   2HG   GLU 126          2HG       GLU 126   0.361  14.837  16.793
  964    H    HIS 127           H        HIS 127  -1.716  17.158  17.420
  965    HA   HIS 127           HA       HIS 127  -0.060  18.608  15.482
  966   1HB   HIS 127          1HB       HIS 127  -1.202  20.704  16.018
  967   2HB   HIS 127          2HB       HIS 127  -2.359  19.534  15.403
  968    HD1  HIS 127           HD1      HIS 127  -3.917  18.370  17.310
  969    HD2  HIS 127           HD2      HIS 127  -1.853  21.810  18.422
  970    HE1  HIS 127           HE1      HIS 127  -5.032  19.188  19.412
  971    HE2  HIS 127           HE2      HIS 127  -3.891  21.372  19.953
  972    H    HIS 128           H        HIS 128   0.169  20.897  17.308
  973    HA   HIS 128           HA       HIS 128   2.195  20.434  19.052
  974   1HB   HIS 128          1HB       HIS 128   0.579  22.537  18.556
  975   2HB   HIS 128          2HB       HIS 128  -0.057  22.066  20.123
  976    HD1  HIS 128           HD1      HIS 128   0.777  24.289  21.123
  977    HD2  HIS 128           HD2      HIS 128   3.801  21.849  19.642
  978    HE1  HIS 128           HE1      HIS 128   2.928  25.322  21.916
  979    HE2  HIS 128           HE2      HIS 128   4.728  23.728  21.175
  980    H    HIS 129           H        HIS 129   2.460  18.964  20.675
  981    HA   HIS 129           HA       HIS 129   0.292  17.182  21.119
  982   1HB   HIS 129          1HB       HIS 129   2.715  16.528  20.907
  983   2HB   HIS 129          2HB       HIS 129   2.959  17.155  22.534
  984    HD1  HIS 129           HD1      HIS 129   1.381  14.309  20.656
  985    HD2  HIS 129           HD2      HIS 129   1.966  15.556  24.591
  986    HE1  HIS 129           HE1      HIS 129   0.785  12.335  22.101
  987    HE2  HIS 129           HE2      HIS 129   0.885  13.212  24.464
  988    H    HIS 130           H        HIS 130   2.300  18.781  23.625
  989    HA   HIS 130           HA       HIS 130  -0.140  19.280  25.155
  990   1HB   HIS 130          1HB       HIS 130   0.711  16.988  25.755
  991   2HB   HIS 130          2HB       HIS 130   2.177  17.751  26.356
  992    HD1  HIS 130           HD1      HIS 130   1.888  17.174  28.795
  993    HD2  HIS 130           HD2      HIS 130  -1.429  19.094  27.184
  994    HE1  HIS 130           HE1      HIS 130   0.393  17.700  30.750
  995    HE2  HIS 130           HE2      HIS 130  -1.694  18.675  29.724
  996    H    HIS 131           H        HIS 131   3.316  19.701  24.753
  997    HA   HIS 131           HA       HIS 131   3.584  21.772  26.701
  998   1HB   HIS 131          1HB       HIS 131   5.494  20.399  25.932
  999   2HB   HIS 131          2HB       HIS 131   5.340  21.097  24.326
 1000    HD1  HIS 131           HD1      HIS 131   6.524  21.874  27.789
 1001    HD2  HIS 131           HD2      HIS 131   6.389  23.678  24.043
 1002    HE1  HIS 131           HE1      HIS 131   8.017  23.894  27.951
 1003    HE2  HIS 131           HE2      HIS 131   7.711  25.094  25.754
 1004    H    HIS 132           H        HIS 132   3.548  23.982  26.439
 1005    HA   HIS 132           HA       HIS 132   2.630  24.963  23.811
 1006   1HB   HIS 132          1HB       HIS 132   0.915  25.156  25.616
 1007   2HB   HIS 132          2HB       HIS 132   2.028  26.170  26.525
 1008    HD1  HIS 132           HD1      HIS 132   2.333  28.619  25.728
 1009    HD2  HIS 132           HD2      HIS 132  -0.313  26.393  23.411
 1010    HE1  HIS 132           HE1      HIS 132   1.117  30.286  24.297
 1011    HE2  HIS 132           HE2      HIS 132  -0.577  28.939  23.002
  Start of MODEL    2
    1   1H    MET   1          1HT       MET   1  19.450  21.787 -21.681
    2   2H    MET   1          2HT       MET   1  19.417  20.662 -20.418
    3   3H    MET   1          3HT       MET   1  20.678  20.622 -21.547
    4    HA   MET   1           HA       MET   1  21.545  21.602 -19.600
    5   1HB   MET   1          1HB       MET   1  20.846  23.707 -21.660
    6   2HB   MET   1          2HB       MET   1  22.040  23.925 -20.388
    7   1HG   MET   1          1HG       MET   1  22.174  21.800 -22.515
    8   2HG   MET   1          2HG       MET   1  23.011  23.350 -22.584
    9   1HE   MET   1          1HE       MET   1  23.943  23.830 -19.627
   10   2HE   MET   1          2HE       MET   1  25.017  24.035 -21.011
   11   3HE   MET   1          3HE       MET   1  25.538  23.079 -19.624
   12    HA   PRO   2           HA       PRO   2  18.570  23.151 -16.756
   13   1HB   PRO   2          1HB       PRO   2  20.267  24.251 -14.924
   14   2HB   PRO   2          2HB       PRO   2  19.970  22.516 -15.072
   15   1HG   PRO   2          1HG       PRO   2  22.247  24.145 -16.120
   16   2HG   PRO   2          2HG       PRO   2  22.268  22.540 -15.365
   17   1HD   PRO   2          1HD       PRO   2  22.444  22.889 -18.039
   18   2HD   PRO   2          2HD       PRO   2  21.649  21.479 -17.313
   19    H    LEU   3           H        LEU   3  20.746  25.231 -18.423
   20    HA   LEU   3           HA       LEU   3  19.710  27.685 -17.316
   21   1HB   LEU   3          1HB       LEU   3  21.536  27.107 -19.647
   22   2HB   LEU   3          2HB       LEU   3  21.024  28.727 -19.222
   23    HG   LEU   3           HG       LEU   3  23.165  28.494 -18.296
   24   1HD1  LEU   3          1HD1      LEU   3  22.817  28.593 -15.886
   25   2HD1  LEU   3          2HD1      LEU   3  21.579  29.498 -16.757
   26   3HD1  LEU   3          3HD1      LEU   3  21.204  27.910 -16.087
   27   1HD2  LEU   3          1HD2      LEU   3  23.862  26.615 -16.895
   28   2HD2  LEU   3          2HD2      LEU   3  22.305  25.835 -17.168
   29   3HD2  LEU   3          3HD2      LEU   3  23.413  26.089 -18.517
   30    H    ASN   4           H        ASN   4  17.629  26.223 -18.102
   31    HA   ASN   4           HA       ASN   4  16.083  27.810 -19.770
   32   1HB   ASN   4          1HB       ASN   4  17.545  26.983 -21.602
   33   2HB   ASN   4          2HB       ASN   4  17.129  25.327 -21.173
   34   1HD2  ASN   4          2HD2      ASN   4  16.056  28.265 -22.644
   35   2HD2  ASN   4          1HD2      ASN   4  14.636  27.616 -23.388
   36    H    GLN   5           H        GLN   5  16.683  24.351 -19.376
   37    HA   GLN   5           HA       GLN   5  14.513  24.036 -17.517
   38   1HB   GLN   5          1HB       GLN   5  13.374  23.934 -19.750
   39   2HB   GLN   5          2HB       GLN   5  14.399  22.566 -20.162
   40   1HG   GLN   5          1HG       GLN   5  13.455  21.324 -18.258
   41   2HG   GLN   5          2HG       GLN   5  12.377  22.683 -17.939
   42   1HE2  GLN   5          2HE2      GLN   5  10.515  21.551 -18.296
   43   2HE2  GLN   5          1HE2      GLN   5  10.036  20.964 -19.857
   44    H    GLU   6           H        GLU   6  15.543  22.845 -16.014
   45    HA   GLU   6           HA       GLU   6  18.002  21.648 -16.439
   46   1HB   GLU   6          1HB       GLU   6  17.640  20.526 -14.223
   47   2HB   GLU   6          2HB       GLU   6  17.436  22.270 -14.228
   48   1HG   GLU   6          1HG       GLU   6  15.087  22.092 -14.079
   49   2HG   GLU   6          2HG       GLU   6  15.125  20.366 -14.441
   50    H    HIS   7           H        HIS   7  15.038  19.790 -15.682
   51    HA   HIS   7           HA       HIS   7  15.413  17.913 -17.756
   52   1HB   HIS   7          1HB       HIS   7  17.378  17.324 -16.312
   53   2HB   HIS   7          2HB       HIS   7  16.257  16.954 -15.008
   54    HD1  HIS   7           HD1      HIS   7  15.469  14.592 -14.887
   55    HD2  HIS   7           HD2      HIS   7  16.960  15.573 -18.649
   56    HE1  HIS   7           HE1      HIS   7  15.491  12.446 -16.193
   57    HE2  HIS   7           HE2      HIS   7  16.190  13.105 -18.521
   58    HA   PRO   8           HA       PRO   8  11.115  17.436 -16.472
   59   1HB   PRO   8          1HB       PRO   8  11.443  15.100 -18.299
   60   2HB   PRO   8          2HB       PRO   8  10.169  16.326 -18.259
   61   1HG   PRO   8          1HG       PRO   8  12.052  16.401 -20.134
   62   2HG   PRO   8          2HG       PRO   8  11.466  17.896 -19.379
   63   1HD   PRO   8          1HD       PRO   8  14.017  16.411 -18.918
   64   2HD   PRO   8          2HD       PRO   8  13.715  18.161 -18.936
   65    H    ASP   9           H        ASP   9  10.547  16.464 -14.646
   66    HA   ASP   9           HA       ASP   9  12.174  14.333 -13.579
   67   1HB   ASP   9          1HB       ASP   9  11.389  16.259 -12.196
   68   2HB   ASP   9          2HB       ASP   9   9.742  15.663 -12.368
   69    H    TYR  10           H        TYR  10  11.530  12.240 -13.155
   70    HA   TYR  10           HA       TYR  10   9.107  11.430 -14.620
   71   1HB   TYR  10          1HB       TYR  10  11.629   9.860 -14.060
   72   2HB   TYR  10          2HB       TYR  10  10.218   9.236 -14.907
   73    HD1  TYR  10           HD1      TYR  10  13.365  10.759 -15.295
   74    HD2  TYR  10           HD2      TYR  10   9.473  10.639 -17.011
   75    HE1  TYR  10           HE1      TYR  10  14.280  11.598 -17.415
   76    HE2  TYR  10           HE2      TYR  10  10.380  11.476 -19.139
   77    HH   TYR  10           HH       TYR  10  12.381  12.821 -19.890
   78    H    THR  11           H        THR  11   9.651  12.123 -11.621
   79    HA   THR  11           HA       THR  11   8.395   9.663 -10.583
   80    HB   THR  11           HB       THR  11   9.243  10.200  -8.372
   81    HG1  THR  11           HG1      THR  11  10.068  12.587  -9.652
   82   1HG2  THR  11          1HG2      THR  11  10.695   8.872  -9.809
   83   2HG2  THR  11          2HG2      THR  11  11.423  10.341 -10.457
   84   3HG2  THR  11          3HG2      THR  11  11.654   9.916  -8.760
   85    H    TYR  12           H        TYR  12   7.266  10.457  -8.311
   86    HA   TYR  12           HA       TYR  12   5.447  12.624  -9.116
   87   1HB   TYR  12          1HB       TYR  12   4.945  10.203  -7.372
   88   2HB   TYR  12          2HB       TYR  12   3.799  11.528  -7.565
   89    HD1  TYR  12           HD1      TYR  12   2.880  12.007  -9.866
   90    HD2  TYR  12           HD2      TYR  12   5.077   8.471  -8.984
   91    HE1  TYR  12           HE1      TYR  12   1.991  10.956 -11.901
   92    HE2  TYR  12           HE2      TYR  12   4.191   7.409 -11.018
   93    HH   TYR  12           HH       TYR  12   2.245   7.632 -12.526
   94    H    ALA  13           H        ALA  13   8.017  12.861  -7.812
   95    HA   ALA  13           HA       ALA  13   9.010  14.177  -6.272
   96   1HB   ALA  13          1HB       ALA  13   7.265  15.779  -6.883
   97   2HB   ALA  13          2HB       ALA  13   6.225  15.120  -5.621
   98   3HB   ALA  13          3HB       ALA  13   7.734  15.924  -5.189
   99    H    LEU  14           H        LEU  14   7.315  11.564  -5.490
  100    HA   LEU  14           HA       LEU  14   7.274  11.786  -2.634
  101   1HB   LEU  14          1HB       LEU  14   5.777  10.234  -3.817
  102   2HB   LEU  14          2HB       LEU  14   7.165   9.332  -4.395
  103    HG   LEU  14           HG       LEU  14   7.734   8.819  -2.004
  104   1HD1  LEU  14          1HD1      LEU  14   6.533  10.660  -0.954
  105   2HD1  LEU  14          2HD1      LEU  14   4.998   9.973  -1.486
  106   3HD1  LEU  14          3HD1      LEU  14   5.997   9.105  -0.319
  107   1HD2  LEU  14          1HD2      LEU  14   5.042   7.899  -2.996
  108   2HD2  LEU  14          2HD2      LEU  14   6.603   7.196  -3.417
  109   3HD2  LEU  14          3HD2      LEU  14   6.011   7.100  -1.759
  110    H    ARG  15           H        ARG  15   9.446  12.643  -2.484
  111    HA   ARG  15           HA       ARG  15  11.425  10.473  -2.317
  112   1HB   ARG  15          1HB       ARG  15  11.941  13.328  -3.180
  113   2HB   ARG  15          2HB       ARG  15  13.181  12.108  -2.924
  114   1HG   ARG  15          1HG       ARG  15  12.162  10.749  -4.717
  115   2HG   ARG  15          2HG       ARG  15  11.007  12.049  -5.007
  116   1HD   ARG  15          1HD       ARG  15  14.002  12.332  -5.204
  117   2HD   ARG  15          2HD       ARG  15  12.933  12.049  -6.574
  118    HE   ARG  15           HE       ARG  15  12.856  14.479  -4.884
  119   1HH1  ARG  15          1HH1      ARG  15  12.469  12.843  -7.955
  120   2HH1  ARG  15          2HH1      ARG  15  12.197  14.298  -8.865
  121   1HH2  ARG  15          1HH2      ARG  15  12.493  16.421  -6.069
  122   2HH2  ARG  15          2HH2      ARG  15  12.220  16.342  -7.787
  123    H    ALA  16           H        ALA  16   9.531  12.341  -0.572
  124    HA   ALA  16           HA       ALA  16  11.551  12.844   1.507
  125   1HB   ALA  16          1HB       ALA  16   8.867  14.180   1.148
  126   2HB   ALA  16          2HB       ALA  16  10.035  14.524   2.424
  127   3HB   ALA  16          3HB       ALA  16  10.433  14.885   0.744
  128    H    ALA  17           H        ALA  17  11.554  10.997   2.648
  129    HA   ALA  17           HA       ALA  17   8.959   9.986   3.617
  130   1HB   ALA  17          1HB       ALA  17   9.984   7.785   3.794
  131   2HB   ALA  17          2HB       ALA  17  10.120   8.401   2.147
  132   3HB   ALA  17          3HB       ALA  17  11.519   8.439   3.221
  133    H    ASP  18           H        ASP  18   8.636  10.601   5.633
  134    HA   ASP  18           HA       ASP  18  10.938  10.809   7.451
  135   1HB   ASP  18          1HB       ASP  18   9.835  12.883   7.411
  136   2HB   ASP  18          2HB       ASP  18   8.241  12.137   7.393
  137    H    GLY  19           H        GLY  19   7.741   9.398   7.079
  138   1HA   GLY  19          1HA       GLY  19   7.420   7.182   8.136
  139   2HA   GLY  19          2HA       GLY  19   8.206   7.858   9.560
  140    H    ARG  20           H        ARG  20   7.097  10.148  10.066
  141    HA   ARG  20           HA       ARG  20   4.226   9.570  10.379
  142   1HB   ARG  20          1HB       ARG  20   5.627  10.056  12.411
  143   2HB   ARG  20          2HB       ARG  20   5.917  11.666  11.772
  144   1HG   ARG  20          1HG       ARG  20   3.532  12.155  11.887
  145   2HG   ARG  20          2HG       ARG  20   3.226  10.530  12.506
  146   1HD   ARG  20          1HD       ARG  20   4.910  12.647  13.838
  147   2HD   ARG  20          2HD       ARG  20   3.277  12.176  14.310
  148    HE   ARG  20           HE       ARG  20   4.873   9.877  14.319
  149   1HH1  ARG  20          1HH1      ARG  20   4.660  12.919  16.062
  150   2HH1  ARG  20          2HH1      ARG  20   5.241  12.231  17.549
  151   1HH2  ARG  20          1HH2      ARG  20   5.659   9.001  16.223
  152   2HH2  ARG  20          2HH2      ARG  20   5.854  10.006  17.637
  153    H    HIS  21           H        HIS  21   6.285  11.108   8.374
  154    HA   HIS  21           HA       HIS  21   4.208  12.951   7.435
  155   1HB   HIS  21          1HB       HIS  21   7.144  13.686   7.613
  156   2HB   HIS  21          2HB       HIS  21   5.848  14.704   7.001
  157    HD1  HIS  21           HD1      HIS  21   7.273  13.333  10.200
  158    HD2  HIS  21           HD2      HIS  21   4.393  16.069   8.949
  159    HE1  HIS  21           HE1      HIS  21   6.616  14.623  12.259
  160    HE2  HIS  21           HE2      HIS  21   4.786  16.184  11.510
  161    H    ALA  22           H        ALA  22   3.999  12.974   5.245
  162    HA   ALA  22           HA       ALA  22   6.120  11.851   3.576
  163   1HB   ALA  22          1HB       ALA  22   3.267  10.863   3.500
  164   2HB   ALA  22          2HB       ALA  22   4.556  10.394   2.390
  165   3HB   ALA  22          3HB       ALA  22   4.658   9.956   4.096
  166    H    LYS  23           H        LYS  23   6.055  12.615   1.418
  167    HA   LYS  23           HA       LYS  23   4.040  14.702   0.931
  168   1HB   LYS  23          1HB       LYS  23   6.379  15.535   1.640
  169   2HB   LYS  23          2HB       LYS  23   6.894  15.014   0.043
  170   1HG   LYS  23          1HG       LYS  23   5.180  16.483  -0.956
  171   2HG   LYS  23          2HG       LYS  23   4.774  17.058   0.662
  172   1HD   LYS  23          1HD       LYS  23   7.167  17.768   0.909
  173   2HD   LYS  23          2HD       LYS  23   7.389  17.381  -0.800
  174   1HE   LYS  23          1HE       LYS  23   5.528  18.958  -1.322
  175   2HE   LYS  23          2HE       LYS  23   5.515  19.426   0.378
  176   1HZ   LYS  23          1HZ       LYS  23   7.925  20.009   0.066
  177   2HZ   LYS  23          2HZ       LYS  23   7.677  19.830  -1.603
  178   3HZ   LYS  23          3HZ       LYS  23   6.818  21.009  -0.737
  179    H    VAL  24           H        VAL  24   2.910  14.228  -0.807
  180    HA   VAL  24           HA       VAL  24   4.258  12.903  -3.074
  181    HB   VAL  24           HB       VAL  24   1.300  12.924  -2.424
  182   1HG1  VAL  24          1HG1      VAL  24   1.726  12.843  -4.825
  183   2HG1  VAL  24          2HG1      VAL  24   2.815  11.475  -4.596
  184   3HG1  VAL  24          3HG1      VAL  24   1.095  11.301  -4.246
  185   1HG2  VAL  24          1HG2      VAL  24   3.323  10.697  -2.208
  186   2HG2  VAL  24          2HG2      VAL  24   2.550  11.536  -0.863
  187   3HG2  VAL  24          3HG2      VAL  24   1.586  10.537  -1.950
  188    H    ASN  25           H        ASN  25   4.506  14.079  -4.852
  189    HA   ASN  25           HA       ASN  25   4.592  15.877  -6.214
  190   1HB   ASN  25          1HB       ASN  25   1.686  15.923  -5.454
  191   2HB   ASN  25          2HB       ASN  25   2.364  17.188  -6.472
  192   1HD2  ASN  25          2HD2      ASN  25   1.205  16.648  -8.266
  193   2HD2  ASN  25          1HD2      ASN  25   1.468  15.192  -9.160
  194    H    GLU  26           H        GLU  26   2.261  17.377  -4.040
  195    HA   GLU  26           HA       GLU  26   4.374  19.010  -2.859
  196   1HB   GLU  26          1HB       GLU  26   3.379  20.084  -4.979
  197   2HB   GLU  26          2HB       GLU  26   1.925  20.320  -4.020
  198   1HG   GLU  26          1HG       GLU  26   3.240  21.617  -2.395
  199   2HG   GLU  26          2HG       GLU  26   4.658  21.425  -3.426
  200    H    GLN  27           H        GLN  27   1.989  16.987  -2.307
  201    HA   GLN  27           HA       GLN  27   0.679  18.552  -0.190
  202   1HB   GLN  27          1HB       GLN  27  -0.119  15.887  -1.376
  203   2HB   GLN  27          2HB       GLN  27  -1.029  16.795  -0.180
  204   1HG   GLN  27          1HG       GLN  27  -0.416  17.857  -2.923
  205   2HG   GLN  27          2HG       GLN  27  -1.854  16.911  -2.558
  206   1HE2  GLN  27          2HE2      GLN  27  -0.413  19.295  -0.399
  207   2HE2  GLN  27          1HE2      GLN  27  -1.721  20.420  -0.481
  208    H    ILE  28           H        ILE  28   1.144  18.144   1.882
  209    HA   ILE  28           HA       ILE  28   2.824  15.845   2.523
  210    HB   ILE  28           HB       ILE  28   1.978  18.163   4.280
  211   1HG1  ILE  28          1HG1      ILE  28   4.607  17.613   2.876
  212   2HG1  ILE  28          2HG1      ILE  28   3.437  18.842   2.408
  213   1HG2  ILE  28          1HG2      ILE  28   3.734  17.363   5.800
  214   2HG2  ILE  28          2HG2      ILE  28   2.470  16.155   5.568
  215   3HG2  ILE  28          3HG2      ILE  28   4.016  15.984   4.738
  216   1HD1  ILE  28          1HD1      ILE  28   3.793  19.984   4.533
  217   2HD1  ILE  28          2HD1      ILE  28   4.969  18.754   4.995
  218   3HD1  ILE  28          3HD1      ILE  28   5.295  19.813   3.623
  219    H    LEU  29           H        LEU  29   1.691  14.042   2.820
  220    HA   LEU  29           HA       LEU  29  -0.960  14.232   4.049
  221   1HB   LEU  29          1HB       LEU  29   0.328  11.985   2.506
  222   2HB   LEU  29          2HB       LEU  29  -1.279  11.926   3.205
  223    HG   LEU  29           HG       LEU  29  -1.313  14.228   1.655
  224   1HD1  LEU  29          1HD1      LEU  29  -0.554  13.491  -0.549
  225   2HD1  LEU  29          2HD1      LEU  29   0.781  13.598   0.598
  226   3HD1  LEU  29          3HD1      LEU  29   0.110  12.024   0.170
  227   1HD2  LEU  29          1HD2      LEU  29  -2.840  12.947   0.246
  228   2HD2  LEU  29          2HD2      LEU  29  -2.268  11.450   0.982
  229   3HD2  LEU  29          3HD2      LEU  29  -3.128  12.639   1.959
  230    H    GLN  30           H        GLN  30  -1.239  13.677   6.068
  231    HA   GLN  30           HA       GLN  30   0.681  11.835   7.330
  232   1HB   GLN  30          1HB       GLN  30   0.115  12.959   9.471
  233   2HB   GLN  30          2HB       GLN  30   0.856  14.047   8.307
  234   1HG   GLN  30          1HG       GLN  30  -1.405  14.880   7.723
  235   2HG   GLN  30          2HG       GLN  30  -2.065  13.870   9.009
  236   1HE2  GLN  30          2HE2      GLN  30  -1.659  14.414  11.156
  237   2HE2  GLN  30          1HE2      GLN  30  -1.092  15.983  11.615
  238    H    GLN  31           H        GLN  31  -1.728  11.235   5.816
  239    HA   GLN  31           HA       GLN  31  -3.297   9.872   7.899
  240   1HB   GLN  31          1HB       GLN  31  -4.343  11.074   5.321
  241   2HB   GLN  31          2HB       GLN  31  -5.298  10.166   6.483
  242   1HG   GLN  31          1HG       GLN  31  -4.864  11.889   8.172
  243   2HG   GLN  31          2HG       GLN  31  -3.948  12.809   6.979
  244   1HE2  GLN  31          2HE2      GLN  31  -5.331  14.568   7.120
  245   2HE2  GLN  31          1HE2      GLN  31  -6.926  14.550   6.458
  246    H    SER  32           H        SER  32  -4.917   8.523   5.870
  247    HA   SER  32           HA       SER  32  -2.909   6.608   4.908
  248   1HB   SER  32          1HB       SER  32  -5.887   6.168   5.232
  249   2HB   SER  32          2HB       SER  32  -4.648   4.943   4.968
  250    HG   SER  32           HG       SER  32  -5.479   5.345   7.210
  251    H    PHE  33           H        PHE  33  -2.580   6.422   2.757
  252    HA   PHE  33           HA       PHE  33  -4.768   6.933   0.916
  253   1HB   PHE  33          1HB       PHE  33  -3.511   8.516  -0.459
  254   2HB   PHE  33          2HB       PHE  33  -3.735   9.151   1.166
  255    HD1  PHE  33           HD1      PHE  33  -1.818   9.140   2.757
  256    HD2  PHE  33           HD2      PHE  33  -1.365   8.163  -1.359
  257    HE1  PHE  33           HE1      PHE  33   0.604   9.534   2.935
  258    HE2  PHE  33           HE2      PHE  33   1.056   8.553  -1.189
  259    HZ   PHE  33           HZ       PHE  33   2.044   9.239   0.959
  260    H    ILE  34           H        ILE  34  -4.440   6.065  -1.173
  261    HA   ILE  34           HA       ILE  34  -2.290   4.056  -1.279
  262    HB   ILE  34           HB       ILE  34  -4.863   4.133  -2.869
  263   1HG1  ILE  34          1HG1      ILE  34  -4.135   2.376  -0.513
  264   2HG1  ILE  34          2HG1      ILE  34  -5.214   3.764  -0.428
  265   1HG2  ILE  34          1HG2      ILE  34  -4.285   1.815  -3.457
  266   2HG2  ILE  34          2HG2      ILE  34  -3.076   2.967  -4.025
  267   3HG2  ILE  34          3HG2      ILE  34  -2.758   1.989  -2.593
  268   1HD1  ILE  34          1HD1      ILE  34  -6.461   1.689  -0.535
  269   2HD1  ILE  34          2HD1      ILE  34  -6.746   2.662  -1.978
  270   3HD1  ILE  34          3HD1      ILE  34  -5.664   1.272  -2.053
  271    H    LEU  35           H        LEU  35  -0.610   4.743  -2.432
  272    HA   LEU  35           HA       LEU  35  -1.111   6.432  -4.786
  273   1HB   LEU  35          1HB       LEU  35   0.383   7.424  -3.152
  274   2HB   LEU  35          2HB       LEU  35   1.398   5.995  -3.165
  275    HG   LEU  35           HG       LEU  35   1.998   6.465  -5.519
  276   1HD1  LEU  35          1HD1      LEU  35  -0.013   7.674  -6.180
  277   2HD1  LEU  35          2HD1      LEU  35   0.421   9.001  -5.102
  278   3HD1  LEU  35          3HD1      LEU  35   1.434   8.631  -6.498
  279   1HD2  LEU  35          1HD2      LEU  35   3.397   7.268  -3.677
  280   2HD2  LEU  35          2HD2      LEU  35   3.442   8.362  -5.061
  281   3HD2  LEU  35          3HD2      LEU  35   2.478   8.773  -3.643
  282    H    MET  36           H        MET  36  -0.832   5.616  -6.744
  283    HA   MET  36           HA       MET  36   0.886   3.245  -7.047
  284   1HB   MET  36          1HB       MET  36  -1.697   3.849  -8.510
  285   2HB   MET  36          2HB       MET  36  -0.614   2.520  -8.896
  286   1HG   MET  36          1HG       MET  36  -0.991   1.602  -6.638
  287   2HG   MET  36          2HG       MET  36  -2.145   2.898  -6.333
  288   1HE   MET  36          1HE       MET  36  -1.365  -0.345  -8.396
  289   2HE   MET  36          2HE       MET  36  -1.528   0.876  -9.657
  290   3HE   MET  36          3HE       MET  36  -2.734  -0.402  -9.508
  291    HA   PRO  37           HA       PRO  37   3.149   5.493 -10.095
  292   1HB   PRO  37          1HB       PRO  37   3.019   3.161 -11.909
  293   2HB   PRO  37          2HB       PRO  37   4.426   3.954 -11.194
  294   1HG   PRO  37          1HG       PRO  37   3.611   1.555 -10.343
  295   2HG   PRO  37          2HG       PRO  37   4.259   2.762  -9.217
  296   1HD   PRO  37          1HD       PRO  37   1.412   1.993  -9.739
  297   2HD   PRO  37          2HD       PRO  37   2.219   2.344  -8.197
  298    H    ASP  38           H        ASP  38   0.029   4.432 -10.700
  299    HA   ASP  38           HA       ASP  38  -0.080   5.918 -13.236
  300   1HB   ASP  38          1HB       ASP  38  -1.610   3.509 -12.311
  301   2HB   ASP  38          2HB       ASP  38  -2.310   4.594 -13.506
  302    H    GLU  39           H        GLU  39  -2.197   5.006 -10.509
  303    HA   GLU  39           HA       GLU  39  -3.414   7.672 -10.718
  304   1HB   GLU  39          1HB       GLU  39  -4.837   5.070 -10.127
  305   2HB   GLU  39          2HB       GLU  39  -5.585   6.662 -10.173
  306   1HG   GLU  39          1HG       GLU  39  -4.991   6.853 -12.548
  307   2HG   GLU  39          2HG       GLU  39  -4.298   5.233 -12.490
  308    H    LEU  40           H        LEU  40  -4.398   8.482  -8.774
  309    HA   LEU  40           HA       LEU  40  -3.151   7.408  -6.328
  310   1HB   LEU  40          1HB       LEU  40  -2.231   9.566  -6.874
  311   2HB   LEU  40          2HB       LEU  40  -3.831  10.244  -7.106
  312    HG   LEU  40           HG       LEU  40  -4.276   9.944  -4.684
  313   1HD1  LEU  40          1HD1      LEU  40  -1.372   9.143  -4.576
  314   2HD1  LEU  40          2HD1      LEU  40  -2.394   9.488  -3.181
  315   3HD1  LEU  40          3HD1      LEU  40  -2.757   8.111  -4.221
  316   1HD2  LEU  40          1HD2      LEU  40  -1.821  11.561  -5.356
  317   2HD2  LEU  40          2HD2      LEU  40  -3.496  12.081  -5.545
  318   3HD2  LEU  40          3HD2      LEU  40  -2.843  11.777  -3.935
  319    H    VAL  41           H        VAL  41  -4.487   6.714  -4.784
  320    HA   VAL  41           HA       VAL  41  -7.273   7.679  -4.818
  321    HB   VAL  41           HB       VAL  41  -6.373   4.901  -4.026
  322   1HG1  VAL  41          1HG1      VAL  41  -8.322   5.636  -2.781
  323   2HG1  VAL  41          2HG1      VAL  41  -9.130   6.101  -4.279
  324   3HG1  VAL  41          3HG1      VAL  41  -8.781   4.403  -3.955
  325   1HG2  VAL  41          1HG2      VAL  41  -6.188   5.222  -6.438
  326   2HG2  VAL  41          2HG2      VAL  41  -7.521   4.133  -6.049
  327   3HG2  VAL  41          3HG2      VAL  41  -7.851   5.807  -6.497
  328    H    GLU  42           H        GLU  42  -7.028   9.217  -3.219
  329    HA   GLU  42           HA       GLU  42  -6.049   8.241  -0.626
  330   1HB   GLU  42          1HB       GLU  42  -5.398  10.395  -0.064
  331   2HB   GLU  42          2HB       GLU  42  -5.063  10.341  -1.783
  332   1HG   GLU  42          1HG       GLU  42  -7.324  11.728  -0.379
  333   2HG   GLU  42          2HG       GLU  42  -6.012  12.446  -1.305
  334    H    HIS  43           H        HIS  43  -8.805   8.291  -2.171
  335    HA   HIS  43           HA       HIS  43 -10.531   9.354  -0.087
  336   1HB   HIS  43          1HB       HIS  43 -11.138   7.887  -2.667
  337   2HB   HIS  43          2HB       HIS  43 -12.375   8.411  -1.535
  338    HD1  HIS  43           HD1      HIS  43 -12.598  11.067  -1.229
  339    HD2  HIS  43           HD2      HIS  43 -10.335   9.764  -4.462
  340    HE1  HIS  43           HE1      HIS  43 -12.386  13.058  -2.755
  341    HE2  HIS  43           HE2      HIS  43 -10.794  12.301  -4.562
  342    H    TRP  44           H        TRP  44  -8.884   7.493   0.980
  343    HA   TRP  44           HA       TRP  44 -10.454   5.003   1.110
  344   1HB   TRP  44          1HB       TRP  44  -8.092   4.935   0.155
  345   2HB   TRP  44          2HB       TRP  44  -7.523   5.308   1.776
  346    HD1  TRP  44           HD1      TRP  44 -10.234   2.726   0.735
  347    HE1  TRP  44           HE1      TRP  44  -9.504   0.416   1.620
  348    HE3  TRP  44           HE3      TRP  44  -5.695   4.018   2.711
  349    HZ2  TRP  44           HZ2      TRP  44  -7.291  -0.700   2.971
  350    HZ3  TRP  44           HZ3      TRP  44  -4.333   2.265   3.779
  351    HH2  TRP  44           HH2      TRP  44  -5.117  -0.042   3.905
  352    HA   PRO  45           HA       PRO  45 -11.041   6.837   5.193
  353   1HB   PRO  45          1HB       PRO  45 -13.394   5.172   5.425
  354   2HB   PRO  45          2HB       PRO  45 -13.294   6.922   5.226
  355   1HG   PRO  45          1HG       PRO  45 -14.262   5.236   3.307
  356   2HG   PRO  45          2HG       PRO  45 -13.516   6.804   2.952
  357   1HD   PRO  45          1HD       PRO  45 -12.325   4.057   2.797
  358   2HD   PRO  45          2HD       PRO  45 -12.148   5.428   1.678
  359    H    VAL  46           H        VAL  46  -9.079   5.283   5.549
  360    HA   VAL  46           HA       VAL  46  -9.972   3.368   7.602
  361    HB   VAL  46           HB       VAL  46  -7.531   3.058   5.840
  362   1HG1  VAL  46          1HG1      VAL  46  -7.258   0.888   6.962
  363   2HG1  VAL  46          2HG1      VAL  46  -7.126   2.234   8.096
  364   3HG1  VAL  46          3HG1      VAL  46  -8.607   1.279   8.028
  365   1HG2  VAL  46          1HG2      VAL  46  -8.669   1.084   4.953
  366   2HG2  VAL  46          2HG2      VAL  46 -10.079   1.447   5.949
  367   3HG2  VAL  46          3HG2      VAL  46  -9.605   2.550   4.658
  368    HA   PRO  47           HA       PRO  47  -7.506   6.499   9.779
  369   1HB   PRO  47          1HB       PRO  47  -8.995   5.660  12.131
  370   2HB   PRO  47          2HB       PRO  47  -9.002   7.226  11.317
  371   1HG   PRO  47          1HG       PRO  47 -11.134   5.535  11.302
  372   2HG   PRO  47          2HG       PRO  47 -10.788   6.674   9.989
  373   1HD   PRO  47          1HD       PRO  47 -10.239   3.733  10.145
  374   2HD   PRO  47          2HD       PRO  47 -10.834   4.699   8.776
  375    H    SER  48           H        SER  48  -5.550   5.467   9.798
  376    HA   SER  48           HA       SER  48  -3.759   4.379  10.650
  377   1HB   SER  48          1HB       SER  48  -5.493   3.834  13.073
  378   2HB   SER  48          2HB       SER  48  -3.735   3.713  12.993
  379    HG   SER  48           HG       SER  48  -5.365   6.008  12.930
  380    H    LEU  49           H        LEU  49  -2.949   2.175  11.184
  381    HA   LEU  49           HA       LEU  49  -4.525   0.238   9.731
  382   1HB   LEU  49          1HB       LEU  49  -2.075   0.481   9.381
  383   2HB   LEU  49          2HB       LEU  49  -1.813  -0.094  11.017
  384    HG   LEU  49           HG       LEU  49  -2.845  -2.252  10.417
  385   1HD1  LEU  49          1HD1      LEU  49  -4.331  -1.483   8.654
  386   2HD1  LEU  49          2HD1      LEU  49  -2.945  -1.091   7.638
  387   3HD1  LEU  49          3HD1      LEU  49  -3.278  -2.769   8.065
  388   1HD2  LEU  49          1HD2      LEU  49  -0.583  -1.391   8.621
  389   2HD2  LEU  49          2HD2      LEU  49  -0.437  -1.999  10.270
  390   3HD2  LEU  49          3HD2      LEU  49  -1.026  -3.059   8.989
  391    H    GLY  50           H        GLY  50  -6.051   0.688  11.742
  392   1HA   GLY  50          1HA       GLY  50  -5.768  -1.748  13.374
  393   2HA   GLY  50          2HA       GLY  50  -6.164  -0.222  14.152
  394    H    GLN  51           H        GLN  51  -7.586  -0.080  11.211
  395    HA   GLN  51           HA       GLN  51 -10.071  -1.352  12.129
  396   1HB   GLN  51          1HB       GLN  51 -10.071   1.115  12.553
  397   2HB   GLN  51          2HB       GLN  51  -9.862   1.376  10.829
  398   1HG   GLN  51          1HG       GLN  51 -12.015   0.425  10.367
  399   2HG   GLN  51          2HG       GLN  51 -12.214  -0.050  12.053
  400   1HE2  GLN  51          2HE2      GLN  51 -11.118   2.386  13.131
  401   2HE2  GLN  51          1HE2      GLN  51 -12.303   3.618  12.871
  402    H    LEU  52           H        LEU  52  -7.884  -1.991  10.155
  403    HA   LEU  52           HA       LEU  52  -9.155  -1.697   7.583
  404   1HB   LEU  52          1HB       LEU  52  -6.713  -1.561   7.764
  405   2HB   LEU  52          2HB       LEU  52  -6.661  -3.211   8.355
  406    HG   LEU  52           HG       LEU  52  -7.524  -4.019   6.200
  407   1HD1  LEU  52          1HD1      LEU  52  -7.680  -2.497   4.293
  408   2HD1  LEU  52          2HD1      LEU  52  -8.835  -2.077   5.558
  409   3HD1  LEU  52          3HD1      LEU  52  -7.360  -1.129   5.360
  410   1HD2  LEU  52          1HD2      LEU  52  -5.120  -3.896   6.534
  411   2HD2  LEU  52          2HD2      LEU  52  -5.535  -3.543   4.855
  412   3HD2  LEU  52          3HD2      LEU  52  -5.111  -2.230   5.954
  413    H    GLN  53           H        GLN  53 -11.079  -2.810   7.894
  414    HA   GLN  53           HA       GLN  53 -10.977  -5.692   8.242
  415   1HB   GLN  53          1HB       GLN  53 -13.281  -3.805   7.700
  416   2HB   GLN  53          2HB       GLN  53 -13.453  -5.540   7.923
  417   1HG   GLN  53          1HG       GLN  53 -12.506  -5.309  10.187
  418   2HG   GLN  53          2HG       GLN  53 -12.451  -3.562   9.956
  419   1HE2  GLN  53          2HE2      GLN  53 -14.381  -2.392   9.928
  420   2HE2  GLN  53          1HE2      GLN  53 -15.863  -3.066  10.508
  421    HA   PRO  54           HA       PRO  54 -10.747  -6.925   4.024
  422   1HB   PRO  54          1HB       PRO  54 -13.324  -8.379   4.346
  423   2HB   PRO  54          2HB       PRO  54 -11.757  -8.975   3.786
  424   1HG   PRO  54          1HG       PRO  54 -12.627  -9.574   6.223
  425   2HG   PRO  54          2HG       PRO  54 -10.919  -9.184   5.943
  426   1HD   PRO  54          1HD       PRO  54 -13.081  -7.491   7.129
  427   2HD   PRO  54          2HD       PRO  54 -11.372  -7.627   7.594
  428    H    ALA  55           H        ALA  55 -13.933  -5.832   5.099
  429    HA   ALA  55           HA       ALA  55 -15.045  -5.235   2.601
  430   1HB   ALA  55          1HB       ALA  55 -16.345  -5.292   4.668
  431   2HB   ALA  55          2HB       ALA  55 -15.522  -3.837   5.229
  432   3HB   ALA  55          3HB       ALA  55 -16.568  -3.766   3.813
  433    H    HIS  56           H        HIS  56 -12.739  -3.457   4.557
  434    HA   HIS  56           HA       HIS  56 -12.976  -1.068   2.910
  435   1HB   HIS  56          1HB       HIS  56 -11.478  -1.776   5.400
  436   2HB   HIS  56          2HB       HIS  56 -10.912  -0.427   4.426
  437    HD1  HIS  56           HD1      HIS  56 -14.537  -0.555   4.258
  438    HD2  HIS  56           HD2      HIS  56 -11.705   0.942   6.918
  439    HE1  HIS  56           HE1      HIS  56 -15.755   1.117   5.684
  440    HE2  HIS  56           HE2      HIS  56 -14.043   1.971   7.324
  441    H    MET  57           H        MET  57 -11.049  -3.910   3.116
  442    HA   MET  57           HA       MET  57  -8.839  -2.798   1.588
  443   1HB   MET  57          1HB       MET  57  -8.496  -4.457   3.426
  444   2HB   MET  57          2HB       MET  57  -9.336  -5.655   2.453
  445   1HG   MET  57          1HG       MET  57  -6.969  -5.986   2.271
  446   2HG   MET  57          2HG       MET  57  -7.600  -5.426   0.723
  447   1HE   MET  57          1HE       MET  57  -4.492  -5.427   1.555
  448   2HE   MET  57          2HE       MET  57  -3.993  -3.873   0.887
  449   3HE   MET  57          3HE       MET  57  -5.090  -4.913  -0.023
  450    H    ASP  58           H        ASP  58 -11.823  -4.223   0.994
  451    HA   ASP  58           HA       ASP  58 -11.376  -5.850  -1.226
  452   1HB   ASP  58          1HB       ASP  58 -13.487  -5.781   0.047
  453   2HB   ASP  58          2HB       ASP  58 -13.817  -4.178  -0.601
  454    H    ALA  59           H        ALA  59 -11.814  -2.366  -1.002
  455    HA   ALA  59           HA       ALA  59 -12.161  -1.776  -3.709
  456   1HB   ALA  59          1HB       ALA  59 -11.418   0.472  -3.157
  457   2HB   ALA  59          2HB       ALA  59 -12.494  -0.150  -1.905
  458   3HB   ALA  59          3HB       ALA  59 -10.753  -0.107  -1.630
  459    H    VAL  60           H        VAL  60  -9.221  -2.288  -1.834
  460    HA   VAL  60           HA       VAL  60  -7.405  -1.525  -3.879
  461    HB   VAL  60           HB       VAL  60  -6.861  -3.474  -1.634
  462   1HG1  VAL  60          1HG1      VAL  60  -4.562  -2.659  -1.826
  463   2HG1  VAL  60          2HG1      VAL  60  -5.127  -3.364  -3.341
  464   3HG1  VAL  60          3HG1      VAL  60  -5.044  -1.611  -3.159
  465   1HG2  VAL  60          1HG2      VAL  60  -6.672  -0.462  -1.569
  466   2HG2  VAL  60          2HG2      VAL  60  -7.879  -1.437  -0.730
  467   3HG2  VAL  60          3HG2      VAL  60  -6.177  -1.562  -0.283
  468    H    LEU  61           H        LEU  61  -8.850  -4.578  -2.872
  469    HA   LEU  61           HA       LEU  61  -7.424  -6.217  -4.703
  470   1HB   LEU  61          1HB       LEU  61 -10.076  -6.673  -3.335
  471   2HB   LEU  61          2HB       LEU  61  -9.165  -7.900  -4.194
  472    HG   LEU  61           HG       LEU  61  -8.252  -6.463  -1.698
  473   1HD1  LEU  61          1HD1      LEU  61  -9.205  -9.291  -2.125
  474   2HD1  LEU  61          2HD1      LEU  61  -8.540  -8.646  -0.624
  475   3HD1  LEU  61          3HD1      LEU  61 -10.064  -8.020  -1.255
  476   1HD2  LEU  61          1HD2      LEU  61  -6.384  -7.061  -3.155
  477   2HD2  LEU  61          2HD2      LEU  61  -6.407  -8.068  -1.708
  478   3HD2  LEU  61          3HD2      LEU  61  -6.977  -8.720  -3.245
  479    H    ALA  62           H        ALA  62 -10.266  -4.239  -4.948
  480    HA   ALA  62           HA       ALA  62 -11.247  -5.364  -7.384
  481   1HB   ALA  62          1HB       ALA  62 -12.716  -3.434  -7.470
  482   2HB   ALA  62          2HB       ALA  62 -12.685  -4.101  -5.838
  483   3HB   ALA  62          3HB       ALA  62 -11.776  -2.636  -6.209
  484    H    LEU  63           H        LEU  63  -8.939  -2.867  -6.561
  485    HA   LEU  63           HA       LEU  63  -8.693  -1.783  -9.186
  486   1HB   LEU  63          1HB       LEU  63  -6.740  -1.756  -6.882
  487   2HB   LEU  63          2HB       LEU  63  -6.601  -0.785  -8.335
  488    HG   LEU  63           HG       LEU  63  -8.820  -0.572  -6.297
  489   1HD1  LEU  63          1HD1      LEU  63  -6.679   0.240  -5.449
  490   2HD1  LEU  63          2HD1      LEU  63  -6.499   1.264  -6.873
  491   3HD1  LEU  63          3HD1      LEU  63  -7.805   1.569  -5.727
  492   1HD2  LEU  63          1HD2      LEU  63  -8.224   1.084  -8.748
  493   2HD2  LEU  63          2HD2      LEU  63  -9.584  -0.019  -8.542
  494   3HD2  LEU  63          3HD2      LEU  63  -9.469   1.433  -7.548
  495    H    ASN  64           H        ASN  64  -7.175  -4.369  -7.414
  496    HA   ASN  64           HA       ASN  64  -5.846  -6.101  -7.978
  497   1HB   ASN  64          1HB       ASN  64  -6.757  -5.435 -10.779
  498   2HB   ASN  64          2HB       ASN  64  -5.794  -6.850 -10.368
  499   1HD2  ASN  64          2HD2      ASN  64  -8.909  -5.414 -10.343
  500   2HD2  ASN  64          1HD2      ASN  64  -9.775  -6.788  -9.749
  501    HA   PRO  65           HA       PRO  65  -2.199  -3.653  -9.180
  502   1HB   PRO  65          1HB       PRO  65  -0.965  -3.591  -6.813
  503   2HB   PRO  65          2HB       PRO  65  -2.283  -2.473  -7.181
  504   1HG   PRO  65          1HG       PRO  65  -2.283  -4.909  -5.475
  505   2HG   PRO  65          2HG       PRO  65  -3.203  -3.407  -5.291
  506   1HD   PRO  65          1HD       PRO  65  -4.131  -5.830  -6.403
  507   2HD   PRO  65          2HD       PRO  65  -4.948  -4.257  -6.462
  508    H    ALA  66           H        ALA  66   0.128  -4.358  -8.988
  509    HA   ALA  66           HA       ALA  66   0.333  -7.202  -9.347
  510   1HB   ALA  66          1HB       ALA  66   1.660  -5.641 -10.705
  511   2HB   ALA  66          2HB       ALA  66   2.515  -5.118  -9.253
  512   3HB   ALA  66          3HB       ALA  66   2.681  -6.778  -9.825
  513    H    VAL  67           H        VAL  67   1.597  -4.835  -7.039
  514    HA   VAL  67           HA       VAL  67   1.577  -6.884  -4.965
  515    HB   VAL  67           HB       VAL  67   3.852  -7.030  -5.856
  516   1HG1  VAL  67          1HG1      VAL  67   5.397  -5.138  -5.725
  517   2HG1  VAL  67          2HG1      VAL  67   4.050  -4.812  -6.815
  518   3HG1  VAL  67          3HG1      VAL  67   4.072  -4.097  -5.203
  519   1HG2  VAL  67          1HG2      VAL  67   3.562  -7.399  -3.477
  520   2HG2  VAL  67          2HG2      VAL  67   5.108  -6.609  -3.787
  521   3HG2  VAL  67          3HG2      VAL  67   3.749  -5.673  -3.165
  522    H    ILE  68           H        ILE  68   1.385  -6.010  -2.863
  523    HA   ILE  68           HA       ILE  68   0.701  -3.139  -2.855
  524    HB   ILE  68           HB       ILE  68  -0.357  -5.290  -1.011
  525   1HG1  ILE  68          1HG1      ILE  68  -1.748  -3.872  -3.295
  526   2HG1  ILE  68          2HG1      ILE  68  -1.143  -5.525  -3.361
  527   1HG2  ILE  68          1HG2      ILE  68  -1.960  -3.561  -0.315
  528   2HG2  ILE  68          2HG2      ILE  68  -0.294  -3.093   0.027
  529   3HG2  ILE  68          3HG2      ILE  68  -1.139  -2.395  -1.354
  530   1HD1  ILE  68          1HD1      ILE  68  -3.307  -4.493  -1.542
  531   2HD1  ILE  68          2HD1      ILE  68  -3.528  -5.496  -2.975
  532   3HD1  ILE  68          3HD1      ILE  68  -2.690  -6.145  -1.566
  533    H    LEU  69           H        LEU  69   2.008  -1.879  -1.729
  534    HA   LEU  69           HA       LEU  69   3.572  -3.047   0.471
  535   1HB   LEU  69          1HB       LEU  69   4.011  -0.555  -1.171
  536   2HB   LEU  69          2HB       LEU  69   4.929  -0.930   0.274
  537    HG   LEU  69           HG       LEU  69   4.872  -2.610  -2.232
  538   1HD1  LEU  69          1HD1      LEU  69   7.156  -1.821  -2.553
  539   2HD1  LEU  69          2HD1      LEU  69   6.016  -0.474  -2.551
  540   3HD1  LEU  69          3HD1      LEU  69   7.009  -0.792  -1.128
  541   1HD2  LEU  69          1HD2      LEU  69   6.697  -3.838  -1.178
  542   2HD2  LEU  69          2HD2      LEU  69   6.531  -2.849   0.273
  543   3HD2  LEU  69          3HD2      LEU  69   5.225  -3.931  -0.212
  544    H    LEU  70           H        LEU  70   2.490  -2.833   2.296
  545    HA   LEU  70           HA       LEU  70   0.794  -0.511   2.745
  546   1HB   LEU  70          1HB       LEU  70  -0.030  -2.771   3.267
  547   2HB   LEU  70          2HB       LEU  70   1.277  -2.980   4.414
  548    HG   LEU  70           HG       LEU  70   0.345  -1.157   5.793
  549   1HD1  LEU  70          1HD1      LEU  70  -1.903  -0.320   5.320
  550   2HD1  LEU  70          2HD1      LEU  70  -0.772   0.110   4.036
  551   3HD1  LEU  70          3HD1      LEU  70  -1.916  -1.211   3.798
  552   1HD2  LEU  70          1HD2      LEU  70  -0.241  -3.486   6.238
  553   2HD2  LEU  70          2HD2      LEU  70  -1.580  -2.403   6.619
  554   3HD2  LEU  70          3HD2      LEU  70  -1.611  -3.355   5.135
  555    H    GLY  71           H        GLY  71   1.533   1.226   3.737
  556   1HA   GLY  71          1HA       GLY  71   3.967   1.029   5.371
  557   2HA   GLY  71          2HA       GLY  71   3.272   2.511   4.723
  558    H    THR  72           H        THR  72   3.905   1.137   7.513
  559    HA   THR  72           HA       THR  72   1.317   1.493   8.802
  560    HB   THR  72           HB       THR  72   2.575   0.660  10.826
  561    HG1  THR  72           HG1      THR  72   4.679   0.363  10.681
  562   1HG2  THR  72          1HG2      THR  72   2.656  -1.072   8.352
  563   2HG2  THR  72          2HG2      THR  72   2.737  -1.653  10.014
  564   3HG2  THR  72          3HG2      THR  72   1.274  -0.863   9.426
  565    H    GLY  73           H        GLY  73   3.157   3.802   7.821
  566   1HA   GLY  73          1HA       GLY  73   4.166   5.723   8.584
  567   2HA   GLY  73          2HA       GLY  73   3.065   5.592   9.952
  568    H    GLU  74           H        GLU  74   3.733   4.496  11.815
  569    HA   GLU  74           HA       GLU  74   6.613   3.932  12.010
  570   1HB   GLU  74          1HB       GLU  74   4.840   5.235  14.090
  571   2HB   GLU  74          2HB       GLU  74   6.494   4.713  14.373
  572   1HG   GLU  74          1HG       GLU  74   7.256   6.301  12.649
  573   2HG   GLU  74          2HG       GLU  74   5.593   6.855  12.460
  574    H    ARG  75           H        ARG  75   7.056   2.465  13.927
  575    HA   ARG  75           HA       ARG  75   6.831   0.483  14.968
  576   1HB   ARG  75          1HB       ARG  75   3.852   0.923  14.814
  577   2HB   ARG  75          2HB       ARG  75   4.721  -0.128  15.914
  578   1HG   ARG  75          1HG       ARG  75   5.772   1.859  16.936
  579   2HG   ARG  75          2HG       ARG  75   4.781   2.876  15.885
  580   1HD   ARG  75          1HD       ARG  75   3.741   2.683  18.064
  581   2HD   ARG  75          2HD       ARG  75   2.757   1.859  16.853
  582    HE   ARG  75           HE       ARG  75   4.592   0.440  18.686
  583   1HH1  ARG  75          1HH1      ARG  75   1.497   0.713  17.047
  584   2HH1  ARG  75          2HH1      ARG  75   0.917  -0.816  17.629
  585   1HH2  ARG  75          1HH2      ARG  75   3.841  -1.547  19.437
  586   2HH2  ARG  75          2HH2      ARG  75   2.264  -2.118  18.977
  587    H    GLN  76           H        GLN  76   5.873  -1.772  14.725
  588    HA   GLN  76           HA       GLN  76   5.277  -2.255  11.886
  589   1HB   GLN  76          1HB       GLN  76   6.591  -4.023  13.937
  590   2HB   GLN  76          2HB       GLN  76   5.978  -4.641  12.407
  591   1HG   GLN  76          1HG       GLN  76   7.430  -2.829  11.329
  592   2HG   GLN  76          2HG       GLN  76   8.231  -2.737  12.897
  593   1HE2  GLN  76          2HE2      GLN  76   9.378  -4.555  13.654
  594   2HE2  GLN  76          1HE2      GLN  76   9.927  -5.780  12.562
  595    H    GLN  77           H        GLN  77   3.264  -2.568  11.493
  596    HA   GLN  77           HA       GLN  77   1.675  -4.228  13.318
  597   1HB   GLN  77          1HB       GLN  77   0.730  -1.692  11.956
  598   2HB   GLN  77          2HB       GLN  77  -0.296  -2.793  12.866
  599   1HG   GLN  77          1HG       GLN  77   1.037  -2.334  14.882
  600   2HG   GLN  77          2HG       GLN  77   2.004  -1.186  13.959
  601   1HE2  GLN  77          2HE2      GLN  77  -1.441  -1.567  13.515
  602   2HE2  GLN  77          1HE2      GLN  77  -1.888  -0.043  14.188
  603    H    PHE  78           H        PHE  78  -0.158  -5.276  12.233
  604    HA   PHE  78           HA       PHE  78   0.172  -5.494   9.336
  605   1HB   PHE  78          1HB       PHE  78   0.061  -7.973   9.495
  606   2HB   PHE  78          2HB       PHE  78   1.515  -7.308  10.228
  607    HD1  PHE  78           HD1      PHE  78   1.778  -7.301  12.671
  608    HD2  PHE  78           HD2      PHE  78  -1.580  -9.126  10.796
  609    HE1  PHE  78           HE1      PHE  78   1.277  -8.514  14.752
  610    HE2  PHE  78           HE2      PHE  78  -2.086 -10.337  12.876
  611    HZ   PHE  78           HZ       PHE  78  -0.658 -10.032  14.856
  612    HA   PRO  79           HA       PRO  79  -4.274  -5.618   9.362
  613   1HB   PRO  79          1HB       PRO  79  -4.730  -7.101   7.124
  614   2HB   PRO  79          2HB       PRO  79  -4.241  -5.405   7.072
  615   1HG   PRO  79          1HG       PRO  79  -2.579  -7.869   6.718
  616   2HG   PRO  79          2HG       PRO  79  -2.534  -6.346   5.810
  617   1HD   PRO  79          1HD       PRO  79  -0.743  -6.933   7.751
  618   2HD   PRO  79          2HD       PRO  79  -1.283  -5.273   7.422
  619    H    SER  80           H        SER  80  -6.030  -7.096   9.693
  620    HA   SER  80           HA       SER  80  -5.420  -9.247  11.355
  621   1HB   SER  80          1HB       SER  80  -7.998  -8.866   9.826
  622   2HB   SER  80          2HB       SER  80  -7.778  -9.713  11.358
  623    HG   SER  80           HG       SER  80  -8.608  -7.476  11.435
  624    H    THR  81           H        THR  81  -5.738 -11.511  11.073
  625    HA   THR  81           HA       THR  81  -4.427 -12.556   8.838
  626    HB   THR  81           HB       THR  81  -6.279 -14.180  10.576
  627    HG1  THR  81           HG1      THR  81  -5.109 -13.042  12.065
  628   1HG2  THR  81          1HG2      THR  81  -3.604 -14.785   9.301
  629   2HG2  THR  81          2HG2      THR  81  -4.563 -15.902  10.273
  630   3HG2  THR  81          3HG2      THR  81  -5.174 -15.340   8.718
  631    H    ASP  82           H        ASP  82  -7.856 -12.211   9.553
  632    HA   ASP  82           HA       ASP  82  -8.762 -13.785   7.349
  633   1HB   ASP  82          1HB       ASP  82 -10.986 -12.911   7.890
  634   2HB   ASP  82          2HB       ASP  82 -10.156 -13.451   9.344
  635    H    VAL  83           H        VAL  83  -7.581 -10.609   7.663
  636    HA   VAL  83           HA       VAL  83  -8.854  -9.628   5.237
  637    HB   VAL  83           HB       VAL  83  -6.663  -8.323   6.864
  638   1HG1  VAL  83          1HG1      VAL  83  -8.621  -7.171   4.880
  639   2HG1  VAL  83          2HG1      VAL  83  -7.435  -6.257   5.811
  640   3HG1  VAL  83          3HG1      VAL  83  -6.897  -7.430   4.609
  641   1HG2  VAL  83          1HG2      VAL  83  -9.649  -7.981   7.087
  642   2HG2  VAL  83          2HG2      VAL  83  -8.591  -8.728   8.285
  643   3HG2  VAL  83          3HG2      VAL  83  -8.440  -7.007   7.923
  644    H    LEU  84           H        LEU  84  -5.621 -10.477   6.414
  645    HA   LEU  84           HA       LEU  84  -4.208  -9.983   4.040
  646   1HB   LEU  84          1HB       LEU  84  -3.275 -10.352   6.362
  647   2HB   LEU  84          2HB       LEU  84  -3.546 -12.065   6.127
  648    HG   LEU  84           HG       LEU  84  -1.813 -10.520   4.219
  649   1HD1  LEU  84          1HD1      LEU  84  -0.976 -11.760   6.837
  650   2HD1  LEU  84          2HD1      LEU  84   0.122 -11.179   5.584
  651   3HD1  LEU  84          3HD1      LEU  84  -0.932 -10.044   6.427
  652   1HD2  LEU  84          1HD2      LEU  84  -2.478 -12.778   3.569
  653   2HD2  LEU  84          2HD2      LEU  84  -0.751 -12.705   3.922
  654   3HD2  LEU  84          3HD2      LEU  84  -1.862 -13.406   5.098
  655    H    ALA  85           H        ALA  85  -5.850 -12.865   5.244
  656    HA   ALA  85           HA       ALA  85  -5.022 -14.713   3.338
  657   1HB   ALA  85          1HB       ALA  85  -6.997 -15.994   3.931
  658   2HB   ALA  85          2HB       ALA  85  -6.258 -15.299   5.373
  659   3HB   ALA  85          3HB       ALA  85  -7.714 -14.573   4.691
  660    H    ALA  86           H        ALA  86  -7.586 -12.295   3.171
  661    HA   ALA  86           HA       ALA  86  -8.842 -13.259   0.837
  662   1HB   ALA  86          1HB       ALA  86  -9.909 -11.664   2.355
  663   2HB   ALA  86          2HB       ALA  86  -8.736 -10.432   1.887
  664   3HB   ALA  86          3HB       ALA  86  -9.880 -11.056   0.700
  665    H    CYS  87           H        CYS  87  -6.158 -11.038   1.346
  666    HA   CYS  87           HA       CYS  87  -5.922 -10.309  -1.414
  667   1HB   CYS  87          1HB       CYS  87  -5.134  -8.848   0.416
  668   2HB   CYS  87          2HB       CYS  87  -3.921 -10.048   0.846
  669    HG   CYS  87           HG       CYS  87  -2.435  -9.773  -1.474
  670    H    LEU  88           H        LEU  88  -4.391 -12.633   0.736
  671    HA   LEU  88           HA       LEU  88  -2.347 -13.471  -1.020
  672   1HB   LEU  88          1HB       LEU  88  -2.517 -13.825   1.493
  673   2HB   LEU  88          2HB       LEU  88  -3.632 -15.129   1.149
  674    HG   LEU  88           HG       LEU  88  -0.856 -15.127  -0.011
  675   1HD1  LEU  88          1HD1      LEU  88  -0.596 -14.849   2.391
  676   2HD1  LEU  88          2HD1      LEU  88  -1.701 -16.193   2.679
  677   3HD1  LEU  88          3HD1      LEU  88  -0.146 -16.482   1.902
  678   1HD2  LEU  88          1HD2      LEU  88  -1.197 -17.552  -0.013
  679   2HD2  LEU  88          2HD2      LEU  88  -2.801 -17.328   0.686
  680   3HD2  LEU  88          3HD2      LEU  88  -2.453 -16.726  -0.935
  681    H    THR  89           H        THR  89  -5.607 -14.734  -0.384
  682    HA   THR  89           HA       THR  89  -5.359 -16.989  -2.073
  683    HB   THR  89           HB       THR  89  -7.919 -16.951  -2.011
  684    HG1  THR  89           HG1      THR  89  -7.583 -15.080   0.086
  685   1HG2  THR  89          1HG2      THR  89  -7.977 -17.693   0.326
  686   2HG2  THR  89          2HG2      THR  89  -6.568 -18.338  -0.515
  687   3HG2  THR  89          3HG2      THR  89  -6.387 -16.978   0.593
  688    H    ARG  90           H        ARG  90  -6.447 -13.683  -2.658
  689    HA   ARG  90           HA       ARG  90  -7.443 -14.128  -5.270
  690   1HB   ARG  90          1HB       ARG  90  -7.867 -12.089  -3.830
  691   2HB   ARG  90          2HB       ARG  90  -6.238 -11.558  -4.211
  692   1HG   ARG  90          1HG       ARG  90  -8.258 -12.121  -6.362
  693   2HG   ARG  90          2HG       ARG  90  -8.162 -10.556  -5.555
  694   1HD   ARG  90          1HD       ARG  90  -5.896 -10.256  -6.291
  695   2HD   ARG  90          2HD       ARG  90  -5.845 -11.891  -6.941
  696    HE   ARG  90           HE       ARG  90  -7.489  -9.705  -8.059
  697   1HH1  ARG  90          1HH1      ARG  90  -5.671 -12.685  -8.413
  698   2HH1  ARG  90          2HH1      ARG  90  -5.732 -12.657 -10.152
  699   1HH2  ARG  90          1HH2      ARG  90  -7.561  -9.678 -10.350
  700   2HH2  ARG  90          2HH2      ARG  90  -6.799 -10.962 -11.243
  701    H    GLY  91           H        GLY  91  -4.237 -13.533  -3.974
  702   1HA   GLY  91          1HA       GLY  91  -2.383 -14.560  -5.154
  703   2HA   GLY  91          2HA       GLY  91  -3.168 -14.117  -6.662
  704    H    ILE  92           H        ILE  92  -3.262 -11.730  -4.210
  705    HA   ILE  92           HA       ILE  92  -1.272 -10.183  -5.712
  706    HB   ILE  92           HB       ILE  92  -3.213  -9.170  -3.624
  707   1HG1  ILE  92          1HG1      ILE  92  -4.460 -10.030  -5.528
  708   2HG1  ILE  92          2HG1      ILE  92  -4.506  -8.271  -5.533
  709   1HG2  ILE  92          1HG2      ILE  92  -1.247  -7.765  -3.905
  710   2HG2  ILE  92          2HG2      ILE  92  -1.513  -7.716  -5.648
  711   3HG2  ILE  92          3HG2      ILE  92  -2.677  -6.966  -4.556
  712   1HD1  ILE  92          1HD1      ILE  92  -2.740  -9.997  -7.253
  713   2HD1  ILE  92          2HD1      ILE  92  -4.199  -9.152  -7.771
  714   3HD1  ILE  92          3HD1      ILE  92  -2.782  -8.234  -7.261
  715    H    GLY  93           H        GLY  93   0.680  -9.821  -4.875
  716   1HA   GLY  93          1HA       GLY  93   1.465 -10.920  -2.383
  717   2HA   GLY  93          2HA       GLY  93   2.442  -9.875  -3.405
  718    H    LEU  94           H        LEU  94   1.208 -10.123  -0.422
  719    HA   LEU  94           HA       LEU  94   0.784  -7.227  -0.142
  720   1HB   LEU  94          1HB       LEU  94  -1.153  -8.573   0.509
  721   2HB   LEU  94          2HB       LEU  94  -0.160  -9.489   1.625
  722    HG   LEU  94           HG       LEU  94   0.206  -7.441   2.959
  723   1HD1  LEU  94          1HD1      LEU  94  -1.162  -5.461   2.527
  724   2HD1  LEU  94          2HD1      LEU  94  -0.053  -5.786   1.194
  725   3HD1  LEU  94          3HD1      LEU  94  -1.761  -6.199   1.040
  726   1HD2  LEU  94          1HD2      LEU  94  -2.688  -8.123   2.459
  727   2HD2  LEU  94          2HD2      LEU  94  -1.592  -8.971   3.550
  728   3HD2  LEU  94          3HD2      LEU  94  -2.053  -7.303   3.886
  729    H    GLU  95           H        GLU  95   2.321  -6.123   0.837
  730    HA   GLU  95           HA       GLU  95   4.015  -7.490   2.817
  731   1HB   GLU  95          1HB       GLU  95   5.265  -7.176   0.720
  732   2HB   GLU  95          2HB       GLU  95   4.897  -5.458   0.751
  733   1HG   GLU  95          1HG       GLU  95   7.167  -5.898   1.490
  734   2HG   GLU  95          2HG       GLU  95   6.197  -5.195   2.782
  735    H    ALA  96           H        ALA  96   4.624  -6.238   4.607
  736    HA   ALA  96           HA       ALA  96   3.310  -3.611   4.833
  737   1HB   ALA  96          1HB       ALA  96   1.892  -5.268   5.936
  738   2HB   ALA  96          2HB       ALA  96   3.255  -5.783   6.928
  739   3HB   ALA  96          3HB       ALA  96   2.598  -4.156   7.108
  740    H    MET  97           H        MET  97   4.747  -2.117   5.307
  741    HA   MET  97           HA       MET  97   6.956  -2.730   7.130
  742   1HB   MET  97          1HB       MET  97   7.291  -1.537   4.367
  743   2HB   MET  97          2HB       MET  97   8.537  -1.508   5.606
  744   1HG   MET  97          1HG       MET  97   8.659  -3.918   5.595
  745   2HG   MET  97          2HG       MET  97   7.328  -4.007   4.442
  746   1HE   MET  97          1HE       MET  97   7.990  -1.591   2.493
  747   2HE   MET  97          2HE       MET  97   7.494  -3.185   1.925
  748   3HE   MET  97          3HE       MET  97   8.923  -2.410   1.241
  749    H    THR  98           H        THR  98   8.224  -0.512   7.444
  750    HA   THR  98           HA       THR  98   6.284   1.368   8.369
  751    HB   THR  98           HB       THR  98   8.565   2.730   8.688
  752    HG1  THR  98           HG1      THR  98   9.851   0.468   9.264
  753   1HG2  THR  98          1HG2      THR  98   7.727   0.359  10.362
  754   2HG2  THR  98          2HG2      THR  98   8.767   1.679  10.896
  755   3HG2  THR  98          3HG2      THR  98   7.082   1.996  10.485
  756    H    ASN  99           H        ASN  99   6.729   3.778   7.878
  757    HA   ASN  99           HA       ASN  99   5.671   4.222   5.366
  758   1HB   ASN  99          1HB       ASN  99   5.490   5.758   7.291
  759   2HB   ASN  99          2HB       ASN  99   7.178   6.206   7.075
  760   1HD2  ASN  99          2HD2      ASN  99   3.948   6.545   5.895
  761   2HD2  ASN  99          1HD2      ASN  99   4.273   7.817   4.773
  762    H    ALA 100           H        ALA 100   9.061   4.746   6.372
  763    HA   ALA 100           HA       ALA 100   9.798   5.800   3.815
  764   1HB   ALA 100          1HB       ALA 100  12.069   5.823   4.687
  765   2HB   ALA 100          2HB       ALA 100  10.938   6.501   5.858
  766   3HB   ALA 100          3HB       ALA 100  11.556   4.864   6.076
  767    H    ALA 101           H        ALA 101  10.162   2.680   5.430
  768    HA   ALA 101           HA       ALA 101  11.807   1.440   3.523
  769   1HB   ALA 101          1HB       ALA 101   9.722   0.173   5.296
  770   2HB   ALA 101          2HB       ALA 101  11.034  -0.672   4.474
  771   3HB   ALA 101          3HB       ALA 101  11.397   0.501   5.740
  772    H    ALA 102           H        ALA 102   8.301   1.759   3.719
  773    HA   ALA 102           HA       ALA 102   7.677   0.128   1.496
  774   1HB   ALA 102          1HB       ALA 102   6.019   0.776   3.180
  775   2HB   ALA 102          2HB       ALA 102   6.121   2.450   2.635
  776   3HB   ALA 102          3HB       ALA 102   5.492   1.208   1.554
  777    H    ALA 103           H        ALA 103   8.182   3.628   1.821
  778    HA   ALA 103           HA       ALA 103   7.709   4.296  -0.873
  779   1HB   ALA 103          1HB       ALA 103   9.480   5.719   1.112
  780   2HB   ALA 103          2HB       ALA 103   8.809   6.401  -0.369
  781   3HB   ALA 103          3HB       ALA 103   7.737   5.939   0.954
  782    H    ARG 104           H        ARG 104  10.639   3.341   0.842
  783    HA   ARG 104           HA       ARG 104  12.509   3.776  -1.190
  784   1HB   ARG 104          1HB       ARG 104  13.062   3.199   1.161
  785   2HB   ARG 104          2HB       ARG 104  12.499   1.560   0.869
  786   1HG   ARG 104          1HG       ARG 104  14.248   1.401  -0.935
  787   2HG   ARG 104          2HG       ARG 104  14.888   2.931  -0.330
  788   1HD   ARG 104          1HD       ARG 104  16.142   1.195   0.697
  789   2HD   ARG 104          2HD       ARG 104  15.065   1.855   1.926
  790    HE   ARG 104           HE       ARG 104  14.363  -0.606   0.455
  791   1HH1  ARG 104          1HH1      ARG 104  14.860   1.127   3.466
  792   2HH1  ARG 104          2HH1      ARG 104  14.462  -0.243   4.463
  793   1HH2  ARG 104          1HH2      ARG 104  13.793  -2.381   1.761
  794   2HH2  ARG 104          2HH2      ARG 104  13.817  -2.229   3.496
  795    H    THR 105           H        THR 105  10.580   0.904  -0.427
  796    HA   THR 105           HA       THR 105  11.641  -0.716  -2.484
  797    HB   THR 105           HB       THR 105   8.927  -0.996  -1.180
  798    HG1  THR 105           HG1      THR 105  10.578  -0.875   0.411
  799   1HG2  THR 105          1HG2      THR 105   9.268  -2.437  -3.127
  800   2HG2  THR 105          2HG2      THR 105  10.779  -3.027  -2.434
  801   3HG2  THR 105          3HG2      THR 105   9.246  -3.385  -1.639
  802    H    TYR 106           H        TYR 106   8.959   1.545  -2.336
  803    HA   TYR 106           HA       TYR 106   7.602   0.913  -4.676
  804   1HB   TYR 106          1HB       TYR 106   6.672   2.524  -3.159
  805   2HB   TYR 106          2HB       TYR 106   8.067   3.581  -3.331
  806    HD1  TYR 106           HD1      TYR 106   5.043   2.309  -5.036
  807    HD2  TYR 106           HD2      TYR 106   8.223   5.135  -5.137
  808    HE1  TYR 106           HE1      TYR 106   3.901   3.523  -6.846
  809    HE2  TYR 106           HE2      TYR 106   7.090   6.356  -6.945
  810    HH   TYR 106           HH       TYR 106   5.427   5.881  -8.722
  811    H    ASN 107           H        ASN 107  10.387   3.077  -4.230
  812    HA   ASN 107           HA       ASN 107  10.566   3.943  -6.896
  813   1HB   ASN 107          1HB       ASN 107  11.718   5.076  -5.046
  814   2HB   ASN 107          2HB       ASN 107  12.770   3.681  -4.836
  815   1HD2  ASN 107          2HD2      ASN 107  14.474   3.375  -6.227
  816   2HD2  ASN 107          1HD2      ASN 107  14.954   4.546  -7.401
  817    H    VAL 108           H        VAL 108  11.971   1.161  -5.249
  818    HA   VAL 108           HA       VAL 108  13.664   0.328  -7.358
  819    HB   VAL 108           HB       VAL 108  12.408  -1.403  -5.218
  820   1HG1  VAL 108          1HG1      VAL 108  14.916  -1.782  -6.850
  821   2HG1  VAL 108          2HG1      VAL 108  14.357  -2.840  -5.554
  822   3HG1  VAL 108          3HG1      VAL 108  13.410  -2.682  -7.032
  823   1HG2  VAL 108          1HG2      VAL 108  14.438  -0.992  -3.919
  824   2HG2  VAL 108          2HG2      VAL 108  15.005   0.131  -5.156
  825   3HG2  VAL 108          3HG2      VAL 108  13.556   0.505  -4.223
  826    H    LEU 109           H        LEU 109  10.323  -0.434  -6.504
  827    HA   LEU 109           HA       LEU 109   9.999  -2.401  -8.558
  828   1HB   LEU 109          1HB       LEU 109   7.965  -0.899  -6.909
  829   2HB   LEU 109          2HB       LEU 109   7.588  -2.238  -7.978
  830    HG   LEU 109           HG       LEU 109   9.416  -2.434  -5.584
  831   1HD1  LEU 109          1HD1      LEU 109   6.546  -3.297  -5.903
  832   2HD1  LEU 109          2HD1      LEU 109   7.578  -3.633  -4.513
  833   3HD1  LEU 109          3HD1      LEU 109   7.125  -1.972  -4.893
  834   1HD2  LEU 109          1HD2      LEU 109   9.197  -4.840  -5.927
  835   2HD2  LEU 109          2HD2      LEU 109   8.207  -4.551  -7.358
  836   3HD2  LEU 109          3HD2      LEU 109   9.899  -4.057  -7.343
  837    H    ALA 110           H        ALA 110   9.404   1.043  -8.273
  838    HA   ALA 110           HA       ALA 110   7.814   1.406 -10.558
  839   1HB   ALA 110          1HB       ALA 110   8.095   3.111  -8.819
  840   2HB   ALA 110          2HB       ALA 110   9.768   3.346  -9.328
  841   3HB   ALA 110          3HB       ALA 110   8.447   3.750 -10.425
  842    H    SER 111           H        SER 111  11.289   1.147 -10.155
  843    HA   SER 111           HA       SER 111  12.097   2.040 -12.687
  844   1HB   SER 111          1HB       SER 111  13.645   1.650 -10.794
  845   2HB   SER 111          2HB       SER 111  13.385  -0.086 -10.950
  846    HG   SER 111           HG       SER 111  14.405  -0.069 -12.917
  847    H    GLU 112           H        GLU 112  10.943  -1.087 -11.573
  848    HA   GLU 112           HA       GLU 112  11.478  -2.412 -14.064
  849   1HB   GLU 112          1HB       GLU 112  10.133  -3.173 -11.492
  850   2HB   GLU 112          2HB       GLU 112  10.059  -4.218 -12.898
  851   1HG   GLU 112          1HG       GLU 112  12.631  -3.234 -11.710
  852   2HG   GLU 112          2HG       GLU 112  11.860  -4.752 -11.251
  853    H    GLY 113           H        GLY 113   8.904  -0.578 -12.714
  854   1HA   GLY 113          1HA       GLY 113   7.033   0.205 -13.890
  855   2HA   GLY 113          2HA       GLY 113   7.318  -1.024 -15.116
  856    H    ARG 114           H        ARG 114   7.461  -2.216 -11.955
  857    HA   ARG 114           HA       ARG 114   5.087  -3.779 -12.320
  858   1HB   ARG 114          1HB       ARG 114   7.120  -3.538 -10.119
  859   2HB   ARG 114          2HB       ARG 114   5.632  -4.437  -9.864
  860   1HG   ARG 114          1HG       ARG 114   6.182  -5.937 -11.678
  861   2HG   ARG 114          2HG       ARG 114   7.630  -4.998 -12.047
  862   1HD   ARG 114          1HD       ARG 114   8.645  -5.602  -9.980
  863   2HD   ARG 114          2HD       ARG 114   7.144  -6.303  -9.379
  864    HE   ARG 114           HE       ARG 114   7.489  -8.184 -10.732
  865   1HH1  ARG 114          1HH1      ARG 114  10.065  -5.839 -11.132
  866   2HH1  ARG 114          2HH1      ARG 114  11.153  -6.968 -11.872
  867   1HH2  ARG 114          1HH2      ARG 114   8.930  -9.670 -11.682
  868   2HH2  ARG 114          2HH2      ARG 114  10.512  -9.144 -12.175
  869    H    ARG 115           H        ARG 115   3.088  -3.356 -11.651
  870    HA   ARG 115           HA       ARG 115   2.514  -0.788 -10.539
  871   1HB   ARG 115          1HB       ARG 115   0.900  -3.086 -11.511
  872   2HB   ARG 115          2HB       ARG 115   0.124  -1.963 -10.401
  873   1HG   ARG 115          1HG       ARG 115  -0.345  -1.322 -12.673
  874   2HG   ARG 115          2HG       ARG 115   0.682  -0.108 -11.913
  875   1HD   ARG 115          1HD       ARG 115   1.511  -0.473 -14.112
  876   2HD   ARG 115          2HD       ARG 115   2.647  -1.218 -12.989
  877    HE   ARG 115           HE       ARG 115   1.622  -3.375 -13.577
  878   1HH1  ARG 115          1HH1      ARG 115   1.219  -0.643 -15.725
  879   2HH1  ARG 115          2HH1      ARG 115   0.892  -1.624 -17.127
  880   1HH2  ARG 115          1HH2      ARG 115   1.199  -4.681 -15.413
  881   2HH2  ARG 115          2HH2      ARG 115   0.868  -3.923 -16.948
  882    H    VAL 116           H        VAL 116   3.449  -0.698  -8.546
  883    HA   VAL 116           HA       VAL 116   2.475  -2.521  -6.499
  884    HB   VAL 116           HB       VAL 116   4.827  -2.121  -6.373
  885   1HG1  VAL 116          1HG1      VAL 116   4.194   0.824  -6.293
  886   2HG1  VAL 116          2HG1      VAL 116   5.792   0.113  -6.067
  887   3HG1  VAL 116          3HG1      VAL 116   4.967  -0.047  -7.617
  888   1HG2  VAL 116          1HG2      VAL 116   5.066  -1.180  -4.123
  889   2HG2  VAL 116          2HG2      VAL 116   3.428  -0.533  -4.225
  890   3HG2  VAL 116          3HG2      VAL 116   3.690  -2.278  -4.231
  891    H    ALA 117           H        ALA 117   0.862  -2.039  -5.200
  892    HA   ALA 117           HA       ALA 117  -0.280   0.636  -5.222
  893   1HB   ALA 117          1HB       ALA 117  -1.792  -1.283  -5.357
  894   2HB   ALA 117          2HB       ALA 117  -1.194  -1.871  -3.805
  895   3HB   ALA 117          3HB       ALA 117  -2.084  -0.350  -3.890
  896    H    LEU 118           H        LEU 118   0.962   1.987  -4.057
  897    HA   LEU 118           HA       LEU 118   2.144   1.088  -1.567
  898   1HB   LEU 118          1HB       LEU 118   3.430   2.452  -3.177
  899   2HB   LEU 118          2HB       LEU 118   2.294   3.767  -2.954
  900    HG   LEU 118           HG       LEU 118   2.975   3.961  -0.602
  901   1HD1  LEU 118          1HD1      LEU 118   3.594   1.648  -0.189
  902   2HD1  LEU 118          2HD1      LEU 118   4.956   1.798  -1.299
  903   3HD1  LEU 118          3HD1      LEU 118   4.933   2.727   0.200
  904   1HD2  LEU 118          1HD2      LEU 118   5.269   4.007  -2.557
  905   2HD2  LEU 118          2HD2      LEU 118   4.102   5.303  -2.292
  906   3HD2  LEU 118          3HD2      LEU 118   5.219   4.846  -1.006
  907    H    ALA 119           H        ALA 119   0.448   0.825  -0.181
  908    HA   ALA 119           HA       ALA 119  -1.397   3.020   0.282
  909   1HB   ALA 119          1HB       ALA 119  -1.183   0.333   1.644
  910   2HB   ALA 119          2HB       ALA 119  -2.475   1.511   1.878
  911   3HB   ALA 119          3HB       ALA 119  -2.264   0.734   0.308
  912    H    MET 120           H        MET 120  -0.169   4.643   1.138
  913    HA   MET 120           HA       MET 120   1.602   4.063   3.368
  914   1HB   MET 120          1HB       MET 120   1.065   6.629   1.866
  915   2HB   MET 120          2HB       MET 120   2.221   6.470   3.183
  916   1HG   MET 120          1HG       MET 120   3.501   4.875   1.902
  917   2HG   MET 120          2HG       MET 120   2.322   4.943   0.595
  918   1HE   MET 120          1HE       MET 120   4.019   7.729   2.845
  919   2HE   MET 120          2HE       MET 120   5.273   8.294   1.741
  920   3HE   MET 120          3HE       MET 120   5.327   6.646   2.368
  921    H    ILE 121           H        ILE 121   0.399   3.656   5.120
  922    HA   ILE 121           HA       ILE 121  -1.553   5.638   5.997
  923    HB   ILE 121           HB       ILE 121  -0.679   3.039   7.284
  924   1HG1  ILE 121          1HG1      ILE 121  -3.211   3.733   5.775
  925   2HG1  ILE 121          2HG1      ILE 121  -1.904   2.721   5.170
  926   1HG2  ILE 121          1HG2      ILE 121  -1.450   4.643   8.945
  927   2HG2  ILE 121          2HG2      ILE 121  -2.933   4.900   8.026
  928   3HG2  ILE 121          3HG2      ILE 121  -2.612   3.329   8.759
  929   1HD1  ILE 121          1HD1      ILE 121  -3.661   2.109   7.536
  930   2HD1  ILE 121          2HD1      ILE 121  -3.776   1.383   5.932
  931   3HD1  ILE 121          3HD1      ILE 121  -2.352   1.093   6.932
  932    H    VAL 122           H        VAL 122  -1.115   7.102   7.560
  933    HA   VAL 122           HA       VAL 122   1.543   6.966   8.820
  934    HB   VAL 122           HB       VAL 122  -0.131   9.404   8.189
  935   1HG1  VAL 122          1HG1      VAL 122   2.602   9.208   9.447
  936   2HG1  VAL 122          2HG1      VAL 122   1.788  10.700   8.974
  937   3HG1  VAL 122          3HG1      VAL 122   1.117   9.699  10.261
  938   1HG2  VAL 122          1HG2      VAL 122   1.680   9.952   6.620
  939   2HG2  VAL 122          2HG2      VAL 122   2.471   8.424   7.006
  940   3HG2  VAL 122          3HG2      VAL 122   0.899   8.424   6.206
  941    H    GLY 123           H        GLY 123   1.710   7.213  11.032
  942   1HA   GLY 123          1HA       GLY 123  -0.833   6.749  12.436
  943   2HA   GLY 123          2HA       GLY 123   0.754   6.271  13.002
  944    H    GLY 124           H        GLY 124  -0.258   9.412  11.802
  945   1HA   GLY 124          1HA       GLY 124   0.983  10.745  14.011
  946   2HA   GLY 124          2HA       GLY 124   0.051  11.505  12.730
  947    H    LEU 125           H        LEU 125  -2.150   9.474  13.494
  948    HA   LEU 125           HA       LEU 125  -3.511  11.349  15.212
  949   1HB   LEU 125          1HB       LEU 125  -4.411   8.792  13.891
  950   2HB   LEU 125          2HB       LEU 125  -5.447   9.758  14.920
  951    HG   LEU 125           HG       LEU 125  -5.023  11.680  13.289
  952   1HD1  LEU 125          1HD1      LEU 125  -4.418  11.040  11.009
  953   2HD1  LEU 125          2HD1      LEU 125  -3.094  10.745  12.137
  954   3HD1  LEU 125          3HD1      LEU 125  -4.077   9.399  11.560
  955   1HD2  LEU 125          1HD2      LEU 125  -7.138  10.497  13.426
  956   2HD2  LEU 125          2HD2      LEU 125  -6.749  10.867  11.746
  957   3HD2  LEU 125          3HD2      LEU 125  -6.520   9.232  12.365
  958    H    GLU 126           H        GLU 126  -1.460   8.858  15.856
  959    HA   GLU 126           HA       GLU 126  -2.942   7.482  17.879
  960   1HB   GLU 126          1HB       GLU 126  -1.064   6.474  16.553
  961   2HB   GLU 126          2HB       GLU 126   0.051   7.472  17.475
  962   1HG   GLU 126          1HG       GLU 126  -0.019   5.236  18.381
  963   2HG   GLU 126          2HG       GLU 126  -0.685   6.384  19.540
  964    H    HIS 127           H        HIS 127  -1.362  10.477  17.829
  965    HA   HIS 127           HA       HIS 127  -0.669  10.557  20.614
  966   1HB   HIS 127          1HB       HIS 127   0.394  12.081  18.984
  967   2HB   HIS 127          2HB       HIS 127  -1.162  12.852  18.696
  968    HD1  HIS 127           HD1      HIS 127   1.173  12.226  21.644
  969    HD2  HIS 127           HD2      HIS 127  -1.577  15.026  20.259
  970    HE1  HIS 127           HE1      HIS 127   1.213  14.105  23.318
  971    HE2  HIS 127           HE2      HIS 127  -0.608  15.683  22.566
  972    H    HIS 128           H        HIS 128  -3.526  10.704  18.837
  973    HA   HIS 128           HA       HIS 128  -5.700  10.804  19.417
  974   1HB   HIS 128          1HB       HIS 128  -4.792  11.071  22.290
  975   2HB   HIS 128          2HB       HIS 128  -6.397  10.613  21.731
  976    HD1  HIS 128           HD1      HIS 128  -4.296   8.914  23.538
  977    HD2  HIS 128           HD2      HIS 128  -5.295   8.314  19.547
  978    HE1  HIS 128           HE1      HIS 128  -3.686   6.523  23.036
  979    HE2  HIS 128           HE2      HIS 128  -4.062   6.275  20.552
  980    H    HIS 129           H        HIS 129  -4.658  12.875  22.091
  981    HA   HIS 129           HA       HIS 129  -5.096  15.033  22.613
  982   1HB   HIS 129          1HB       HIS 129  -3.731  15.759  20.829
  983   2HB   HIS 129          2HB       HIS 129  -4.899  15.260  19.614
  984    HD1  HIS 129           HD1      HIS 129  -4.611  17.903  22.366
  985    HD2  HIS 129           HD2      HIS 129  -6.402  17.298  18.657
  986    HE1  HIS 129           HE1      HIS 129  -5.720  20.081  21.778
  987    HE2  HIS 129           HE2      HIS 129  -6.693  19.735  19.480
  988    H    HIS 130           H        HIS 130  -7.034  14.795  19.656
  989    HA   HIS 130           HA       HIS 130  -9.587  14.595  20.679
  990   1HB   HIS 130          1HB       HIS 130  -8.571  16.906  21.694
  991   2HB   HIS 130          2HB       HIS 130  -9.207  17.504  20.168
  992    HD1  HIS 130           HD1      HIS 130 -10.713  18.859  22.031
  993    HD2  HIS 130           HD2      HIS 130 -11.534  14.824  21.456
  994    HE1  HIS 130           HE1      HIS 130 -13.010  18.491  22.992
  995    HE2  HIS 130           HE2      HIS 130 -13.405  16.007  22.801
  996    H    HIS 131           H        HIS 131 -10.382  13.837  18.777
  997    HA   HIS 131           HA       HIS 131  -9.018  14.492  16.361
  998   1HB   HIS 131          1HB       HIS 131 -10.740  12.938  15.294
  999   2HB   HIS 131          2HB       HIS 131  -9.628  12.251  16.466
 1000    HD1  HIS 131           HD1      HIS 131 -10.622  11.077  18.447
 1001    HD2  HIS 131           HD2      HIS 131 -13.442  13.246  16.285
 1002    HE1  HIS 131           HE1      HIS 131 -12.862  10.417  19.390
 1003    HE2  HIS 131           HE2      HIS 131 -14.531  11.885  18.198
 1004    H    HIS 132           H        HIS 132  -9.444  16.751  16.316
 1005    HA   HIS 132           HA       HIS 132 -11.169  17.295  14.175
 1006   1HB   HIS 132          1HB       HIS 132 -12.685  18.941  15.171
 1007   2HB   HIS 132          2HB       HIS 132 -12.946  17.357  15.878
 1008    HD1  HIS 132           HD1      HIS 132 -10.955  20.485  16.758
 1009    HD2  HIS 132           HD2      HIS 132 -13.205  17.495  18.556
 1010    HE1  HIS 132           HE1      HIS 132 -11.095  21.116  19.186
 1011    HE2  HIS 132           HE2      HIS 132 -12.719  19.462  20.167
  Start of MODEL    3
    1   1H    MET   1          1HT       MET   1  10.347  17.640 -22.560
    2   2H    MET   1          2HT       MET   1  10.402  18.018 -24.215
    3   3H    MET   1          3HT       MET   1  11.816  17.552 -23.404
    4    HA   MET   1           HA       MET   1   9.448  15.824 -23.805
    5   1HB   MET   1          1HB       MET   1  10.647  16.352 -25.912
    6   2HB   MET   1          2HB       MET   1  12.142  15.777 -25.187
    7   1HG   MET   1          1HG       MET   1  11.189  13.542 -24.981
    8   2HG   MET   1          2HG       MET   1   9.683  14.117 -25.696
    9   1HE   MET   1          1HE       MET   1  10.920  15.141 -29.295
   10   2HE   MET   1          2HE       MET   1  10.946  16.174 -27.864
   11   3HE   MET   1          3HE       MET   1   9.557  15.131 -28.176
   12    HA   PRO   2           HA       PRO   2  11.115  13.421 -20.430
   13   1HB   PRO   2          1HB       PRO   2  10.077  11.158 -22.070
   14   2HB   PRO   2          2HB       PRO   2   9.797  11.535 -20.365
   15   1HG   PRO   2          1HG       PRO   2   7.905  11.995 -22.176
   16   2HG   PRO   2          2HG       PRO   2   8.187  13.136 -20.847
   17   1HD   PRO   2          1HD       PRO   2   8.968  13.341 -23.724
   18   2HD   PRO   2          2HD       PRO   2   8.417  14.609 -22.610
   19    H    LEU   3           H        LEU   3  13.097  12.613 -20.114
   20    HA   LEU   3           HA       LEU   3  14.859  12.460 -22.364
   21   1HB   LEU   3          1HB       LEU   3  15.446  13.422 -20.137
   22   2HB   LEU   3          2HB       LEU   3  15.428  11.799 -19.476
   23    HG   LEU   3           HG       LEU   3  17.280  11.179 -20.997
   24   1HD1  LEU   3          1HD1      LEU   3  17.254  14.107 -21.714
   25   2HD1  LEU   3          2HD1      LEU   3  18.492  12.942 -22.184
   26   3HD1  LEU   3          3HD1      LEU   3  16.844  12.769 -22.786
   27   1HD2  LEU   3          1HD2      LEU   3  17.739  11.927 -18.717
   28   2HD2  LEU   3          2HD2      LEU   3  19.018  12.427 -19.825
   29   3HD2  LEU   3          3HD2      LEU   3  17.818  13.597 -19.279
   30    H    ASN   4           H        ASN   4  12.954  10.165 -20.765
   31    HA   ASN   4           HA       ASN   4  14.442   8.004 -22.107
   32   1HB   ASN   4          1HB       ASN   4  14.566   8.056 -19.523
   33   2HB   ASN   4          2HB       ASN   4  12.870   7.584 -19.564
   34   1HD2  ASN   4          2HD2      ASN   4  12.335   5.499 -20.067
   35   2HD2  ASN   4          1HD2      ASN   4  13.500   4.246 -20.304
   36    H    GLN   5           H        GLN   5  12.218   9.749 -22.902
   37    HA   GLN   5           HA       GLN   5  10.150   9.733 -23.828
   38   1HB   GLN   5          1HB       GLN   5  10.673   6.762 -24.087
   39   2HB   GLN   5          2HB       GLN   5   9.425   7.659 -24.943
   40   1HG   GLN   5          1HG       GLN   5  11.217   9.021 -25.997
   41   2HG   GLN   5          2HG       GLN   5  12.404   7.960 -25.239
   42   1HE2  GLN   5          2HE2      GLN   5  11.938   8.443 -28.050
   43   2HE2  GLN   5          1HE2      GLN   5  11.568   6.902 -28.754
   44    H    GLU   6           H        GLU   6   8.135   7.693 -23.726
   45    HA   GLU   6           HA       GLU   6   6.475   6.855 -22.436
   46   1HB   GLU   6          1HB       GLU   6   8.330   5.747 -21.183
   47   2HB   GLU   6          2HB       GLU   6   8.397   7.136 -20.111
   48   1HG   GLU   6          1HG       GLU   6   7.180   5.187 -19.188
   49   2HG   GLU   6          2HG       GLU   6   6.225   6.668 -19.249
   50    H    HIS   7           H        HIS   7   5.004   7.501 -20.568
   51    HA   HIS   7           HA       HIS   7   4.438  10.284 -20.802
   52   1HB   HIS   7          1HB       HIS   7   3.213   7.964 -19.394
   53   2HB   HIS   7          2HB       HIS   7   2.785   9.578 -18.839
   54    HD1  HIS   7           HD1      HIS   7   0.794  10.490 -19.914
   55    HD2  HIS   7           HD2      HIS   7   2.785   7.800 -22.391
   56    HE1  HIS   7           HE1      HIS   7  -0.611  10.317 -22.004
   57    HE2  HIS   7           HE2      HIS   7   0.565   8.609 -23.447
   58    HA   PRO   8           HA       PRO   8   6.630  11.728 -17.184
   59   1HB   PRO   8          1HB       PRO   8   5.087  14.169 -17.303
   60   2HB   PRO   8          2HB       PRO   8   6.772  13.913 -17.760
   61   1HG   PRO   8          1HG       PRO   8   4.776  14.484 -19.546
   62   2HG   PRO   8          2HG       PRO   8   6.257  13.604 -19.964
   63   1HD   PRO   8          1HD       PRO   8   3.516  12.541 -19.388
   64   2HD   PRO   8          2HD       PRO   8   4.691  12.026 -20.618
   65    H    ASP   9           H        ASP   9   3.625  10.631 -17.313
   66    HA   ASP   9           HA       ASP   9   2.365  11.820 -15.037
   67   1HB   ASP   9          1HB       ASP   9   1.777   9.256 -16.534
   68   2HB   ASP   9          2HB       ASP   9   0.748   9.936 -15.281
   69    H    TYR  10           H        TYR  10   4.723   9.399 -15.473
   70    HA   TYR  10           HA       TYR  10   4.021   7.830 -13.155
   71   1HB   TYR  10          1HB       TYR  10   6.465   7.725 -14.936
   72   2HB   TYR  10          2HB       TYR  10   6.070   6.551 -13.688
   73    HD1  TYR  10           HD1      TYR  10   4.583   4.757 -14.135
   74    HD2  TYR  10           HD2      TYR  10   4.953   7.939 -16.931
   75    HE1  TYR  10           HE1      TYR  10   3.303   3.455 -15.784
   76    HE2  TYR  10           HE2      TYR  10   3.675   6.649 -18.581
   77    HH   TYR  10           HH       TYR  10   3.146   4.316 -19.069
   78    H    THR  11           H        THR  11   6.049  10.538 -13.844
   79    HA   THR  11           HA       THR  11   7.737  10.110 -11.531
   80    HB   THR  11           HB       THR  11   8.624  12.435 -12.261
   81    HG1  THR  11           HG1      THR  11   7.217  13.180 -13.725
   82   1HG2  THR  11          1HG2      THR  11   9.852  10.348 -12.593
   83   2HG2  THR  11          2HG2      THR  11   8.924  10.021 -14.057
   84   3HG2  THR  11          3HG2      THR  11  10.023  11.400 -13.999
   85    H    TYR  12           H        TYR  12   7.245  10.770  -9.580
   86    HA   TYR  12           HA       TYR  12   5.651  13.202  -9.217
   87   1HB   TYR  12          1HB       TYR  12   4.410  10.856  -8.973
   88   2HB   TYR  12          2HB       TYR  12   5.161  10.892  -7.383
   89    HD1  TYR  12           HD1      TYR  12   2.817  12.652  -9.625
   90    HD2  TYR  12           HD2      TYR  12   4.308  12.308  -5.655
   91    HE1  TYR  12           HE1      TYR  12   0.982  14.073  -8.819
   92    HE2  TYR  12           HE2      TYR  12   2.476  13.731  -4.841
   93    HH   TYR  12           HH       TYR  12  -0.232  14.511  -6.754
   94    H    ALA  13           H        ALA  13   5.804  13.918  -6.834
   95    HA   ALA  13           HA       ALA  13   8.572  14.104  -6.208
   96   1HB   ALA  13          1HB       ALA  13   6.216  15.026  -4.573
   97   2HB   ALA  13          2HB       ALA  13   7.894  15.526  -4.365
   98   3HB   ALA  13          3HB       ALA  13   7.020  15.959  -5.835
   99    H    LEU  14           H        LEU  14   6.439  13.633  -3.497
  100    HA   LEU  14           HA       LEU  14   6.505  12.251  -1.696
  101   1HB   LEU  14          1HB       LEU  14   5.763  10.644  -3.478
  102   2HB   LEU  14          2HB       LEU  14   7.436  10.156  -3.665
  103    HG   LEU  14           HG       LEU  14   7.414   9.466  -1.245
  104   1HD1  LEU  14          1HD1      LEU  14   4.448   9.892  -1.551
  105   2HD1  LEU  14          2HD1      LEU  14   5.240   9.092  -0.194
  106   3HD1  LEU  14          3HD1      LEU  14   5.531  10.804  -0.500
  107   1HD2  LEU  14          1HD2      LEU  14   5.470   8.094  -3.096
  108   2HD2  LEU  14          2HD2      LEU  14   7.213   7.839  -3.039
  109   3HD2  LEU  14          3HD2      LEU  14   6.210   7.376  -1.664
  110    H    ARG  15           H        ARG  15   8.913  13.755  -2.436
  111    HA   ARG  15           HA       ARG  15  11.162  12.024  -1.976
  112   1HB   ARG  15          1HB       ARG  15  12.483  14.141  -2.099
  113   2HB   ARG  15          2HB       ARG  15  11.500  13.803  -3.514
  114   1HG   ARG  15          1HG       ARG  15   9.862  15.431  -2.819
  115   2HG   ARG  15          2HG       ARG  15  10.736  15.707  -1.310
  116   1HD   ARG  15          1HD       ARG  15  11.795  16.243  -4.085
  117   2HD   ARG  15          2HD       ARG  15  11.196  17.462  -2.960
  118    HE   ARG  15           HE       ARG  15  13.054  16.761  -1.460
  119   1HH1  ARG  15          1HH1      ARG  15  13.280  16.209  -4.923
  120   2HH1  ARG  15          2HH1      ARG  15  15.025  16.185  -4.926
  121   1HH2  ARG  15          1HH2      ARG  15  15.326  16.713  -1.467
  122   2HH2  ARG  15          2HH2      ARG  15  16.187  16.481  -2.956
  123    H    ALA  16           H        ALA  16   8.976  13.147   0.128
  124    HA   ALA  16           HA       ALA  16  10.919  13.052   2.308
  125   1HB   ALA  16          1HB       ALA  16   8.801  15.188   2.086
  126   2HB   ALA  16          2HB       ALA  16   9.880  14.937   3.459
  127   3HB   ALA  16          3HB       ALA  16  10.538  15.427   1.899
  128    H    ALA  17           H        ALA  17  10.308  11.208   3.214
  129    HA   ALA  17           HA       ALA  17   7.573  11.064   4.267
  130   1HB   ALA  17          1HB       ALA  17   7.633   9.633   2.278
  131   2HB   ALA  17          2HB       ALA  17   9.016   8.764   2.943
  132   3HB   ALA  17          3HB       ALA  17   7.449   8.674   3.747
  133    H    ASP  18           H        ASP  18   7.787  11.040   6.424
  134    HA   ASP  18           HA       ASP  18   9.956   9.475   7.601
  135   1HB   ASP  18          1HB       ASP  18  10.870  11.730   7.334
  136   2HB   ASP  18          2HB       ASP  18   9.501  12.403   8.210
  137    H    GLY  19           H        GLY  19   7.781   8.320   7.871
  138   1HA   GLY  19          1HA       GLY  19   6.658   7.245   9.563
  139   2HA   GLY  19          2HA       GLY  19   7.403   8.351  10.702
  140    H    ARG  20           H        ARG  20   6.448  10.589  10.723
  141    HA   ARG  20           HA       ARG  20   3.562  10.185  10.985
  142   1HB   ARG  20          1HB       ARG  20   5.304  12.343  12.182
  143   2HB   ARG  20          2HB       ARG  20   3.619  12.023  12.573
  144   1HG   ARG  20          1HG       ARG  20   4.249   9.811  13.426
  145   2HG   ARG  20          2HG       ARG  20   5.940  10.175  13.078
  146   1HD   ARG  20          1HD       ARG  20   5.816  12.091  14.623
  147   2HD   ARG  20          2HD       ARG  20   4.147  11.657  14.997
  148    HE   ARG  20           HE       ARG  20   6.563  10.217  15.815
  149   1HH1  ARG  20          1HH1      ARG  20   3.072  10.423  15.758
  150   2HH1  ARG  20          2HH1      ARG  20   2.855   9.287  17.048
  151   1HH2  ARG  20          1HH2      ARG  20   6.284   8.719  17.513
  152   2HH2  ARG  20          2HH2      ARG  20   4.680   8.314  18.061
  153    H    HIS  21           H        HIS  21   5.688  11.631   8.873
  154    HA   HIS  21           HA       HIS  21   3.510  13.269   7.790
  155   1HB   HIS  21          1HB       HIS  21   6.228  14.191   8.514
  156   2HB   HIS  21          2HB       HIS  21   5.580  14.776   6.997
  157    HD1  HIS  21           HD1      HIS  21   3.319  14.307   9.978
  158    HD2  HIS  21           HD2      HIS  21   5.279  17.363   7.939
  159    HE1  HIS  21           HE1      HIS  21   2.337  16.452  10.853
  160    HE2  HIS  21           HE2      HIS  21   3.447  18.280   9.516
  161    H    ALA  22           H        ALA  22   3.548  13.557   5.587
  162    HA   ALA  22           HA       ALA  22   5.495  12.095   3.990
  163   1HB   ALA  22          1HB       ALA  22   2.529  11.542   3.820
  164   2HB   ALA  22          2HB       ALA  22   3.771  10.873   2.760
  165   3HB   ALA  22          3HB       ALA  22   3.746  10.441   4.470
  166    H    LYS  23           H        LYS  23   6.099  13.430   2.420
  167    HA   LYS  23           HA       LYS  23   4.422  15.740   1.820
  168   1HB   LYS  23          1HB       LYS  23   6.849  15.994   2.366
  169   2HB   LYS  23          2HB       LYS  23   7.228  15.123   0.888
  170   1HG   LYS  23          1HG       LYS  23   5.947  16.932  -0.343
  171   2HG   LYS  23          2HG       LYS  23   5.970  17.836   1.174
  172   1HD   LYS  23          1HD       LYS  23   8.455  17.612   1.185
  173   2HD   LYS  23          2HD       LYS  23   8.350  16.882  -0.417
  174   1HE   LYS  23          1HE       LYS  23   8.851  19.146  -0.801
  175   2HE   LYS  23          2HE       LYS  23   7.125  18.995  -1.130
  176   1HZ   LYS  23          1HZ       LYS  23   6.644  19.918   1.035
  177   2HZ   LYS  23          2HZ       LYS  23   8.293  19.978   1.422
  178   3HZ   LYS  23          3HZ       LYS  23   7.676  20.966   0.195
  179    H    VAL  24           H        VAL  24   2.830  14.906   0.504
  180    HA   VAL  24           HA       VAL  24   3.589  13.628  -2.001
  181    HB   VAL  24           HB       VAL  24   0.864  14.424  -0.939
  182   1HG1  VAL  24          1HG1      VAL  24  -0.044  13.060  -2.762
  183   2HG1  VAL  24          2HG1      VAL  24   0.893  14.422  -3.377
  184   3HG1  VAL  24          3HG1      VAL  24   1.588  12.802  -3.378
  185   1HG2  VAL  24          1HG2      VAL  24   2.178  11.717  -1.157
  186   2HG2  VAL  24          2HG2      VAL  24   1.922  12.622   0.334
  187   3HG2  VAL  24          3HG2      VAL  24   0.539  12.028  -0.586
  188    H    ASN  25           H        ASN  25   4.438  14.951  -3.434
  189    HA   ASN  25           HA       ASN  25   4.880  16.734  -4.753
  190   1HB   ASN  25          1HB       ASN  25   2.508  16.551  -5.434
  191   2HB   ASN  25          2HB       ASN  25   2.052  17.601  -4.098
  192   1HD2  ASN  25          2HD2      ASN  25   3.634  17.419  -7.195
  193   2HD2  ASN  25          1HD2      ASN  25   3.616  19.122  -7.522
  194    H    GLU  26           H        GLU  26   2.699  18.545  -2.650
  195    HA   GLU  26           HA       GLU  26   4.963  19.497  -1.066
  196   1HB   GLU  26          1HB       GLU  26   4.591  21.081  -2.985
  197   2HB   GLU  26          2HB       GLU  26   2.986  21.397  -2.341
  198   1HG   GLU  26          1HG       GLU  26   4.020  22.202  -0.252
  199   2HG   GLU  26          2HG       GLU  26   5.608  21.963  -0.979
  200    H    GLN  27           H        GLN  27   2.167  18.000  -1.025
  201    HA   GLN  27           HA       GLN  27   1.027  19.494   1.239
  202   1HB   GLN  27          1HB       GLN  27  -0.302  17.616  -0.724
  203   2HB   GLN  27          2HB       GLN  27  -1.103  18.330   0.670
  204   1HG   GLN  27          1HG       GLN  27  -0.856  20.529  -0.223
  205   2HG   GLN  27          2HG       GLN  27   0.169  19.940  -1.528
  206   1HE2  GLN  27          2HE2      GLN  27  -1.193  20.824  -3.079
  207   2HE2  GLN  27          1HE2      GLN  27  -2.724  20.105  -3.469
  208    H    ILE  28           H        ILE  28   0.781  18.499   3.159
  209    HA   ILE  28           HA       ILE  28   2.131  15.946   3.456
  210    HB   ILE  28           HB       ILE  28   1.025  17.819   5.553
  211   1HG1  ILE  28          1HG1      ILE  28   2.895  18.794   4.297
  212   2HG1  ILE  28          2HG1      ILE  28   3.374  18.422   5.950
  213   1HG2  ILE  28          1HG2      ILE  28   2.369  16.499   7.139
  214   2HG2  ILE  28          2HG2      ILE  28   1.095  15.545   6.379
  215   3HG2  ILE  28          3HG2      ILE  28   2.766  15.374   5.839
  216   1HD1  ILE  28          1HD1      ILE  28   4.505  16.410   5.176
  217   2HD1  ILE  28          2HD1      ILE  28   4.006  16.760   3.521
  218   3HD1  ILE  28          3HD1      ILE  28   5.117  17.846   4.354
  219    H    LEU  29           H        LEU  29   1.019  14.149   3.262
  220    HA   LEU  29           HA       LEU  29  -1.797  14.035   4.010
  221   1HB   LEU  29          1HB       LEU  29   0.087  12.185   2.587
  222   2HB   LEU  29          2HB       LEU  29  -1.389  11.549   3.284
  223    HG   LEU  29           HG       LEU  29  -1.596  12.030   0.872
  224   1HD1  LEU  29          1HD1      LEU  29  -3.569  12.071   2.298
  225   2HD1  LEU  29          2HD1      LEU  29  -3.312  13.788   2.615
  226   3HD1  LEU  29          3HD1      LEU  29  -3.700  13.240   0.982
  227   1HD2  LEU  29          1HD2      LEU  29  -1.708  14.349   0.094
  228   2HD2  LEU  29          2HD2      LEU  29  -1.206  14.906   1.691
  229   3HD2  LEU  29          3HD2      LEU  29  -0.104  13.943   0.706
  230    H    GLN  30           H        GLN  30  -2.357  13.557   6.034
  231    HA   GLN  30           HA       GLN  30  -0.338  12.281   7.746
  232   1HB   GLN  30          1HB       GLN  30  -2.717  13.999   8.446
  233   2HB   GLN  30          2HB       GLN  30  -1.675  13.224   9.631
  234   1HG   GLN  30          1HG       GLN  30   0.233  14.498   8.775
  235   2HG   GLN  30          2HG       GLN  30  -0.832  15.291   7.614
  236   1HE2  GLN  30          2HE2      GLN  30  -2.323  16.799   8.337
  237   2HE2  GLN  30          1HE2      GLN  30  -2.245  17.504   9.916
  238    H    GLN  31           H        GLN  31  -2.979  11.293   6.050
  239    HA   GLN  31           HA       GLN  31  -3.649   9.345   8.146
  240   1HB   GLN  31          1HB       GLN  31  -5.526  10.471   6.069
  241   2HB   GLN  31          2HB       GLN  31  -5.916   9.143   7.153
  242   1HG   GLN  31          1HG       GLN  31  -5.244  10.856   9.009
  243   2HG   GLN  31          2HG       GLN  31  -5.576  12.040   7.746
  244   1HE2  GLN  31          2HE2      GLN  31  -6.961  11.579  10.249
  245   2HE2  GLN  31          1HE2      GLN  31  -8.612  11.221   9.838
  246    H    SER  32           H        SER  32  -4.677   9.317   4.750
  247    HA   SER  32           HA       SER  32  -2.969   7.015   4.245
  248   1HB   SER  32          1HB       SER  32  -5.965   6.756   3.949
  249   2HB   SER  32          2HB       SER  32  -4.752   5.485   3.811
  250    HG   SER  32           HG       SER  32  -4.289   6.155   6.132
  251    H    PHE  33           H        PHE  33  -2.706   6.534   2.071
  252    HA   PHE  33           HA       PHE  33  -4.465   7.564   0.068
  253   1HB   PHE  33          1HB       PHE  33  -2.858   8.957  -1.140
  254   2HB   PHE  33          2HB       PHE  33  -3.141   9.602   0.469
  255    HD1  PHE  33           HD1      PHE  33  -1.395   9.413   2.201
  256    HD2  PHE  33           HD2      PHE  33  -0.709   8.189  -1.817
  257    HE1  PHE  33           HE1      PHE  33   1.031   9.464   2.604
  258    HE2  PHE  33           HE2      PHE  33   1.719   8.233  -1.419
  259    HZ   PHE  33           HZ       PHE  33   2.591   8.872   0.793
  260    H    ILE  34           H        ILE  34  -4.201   6.523  -1.900
  261    HA   ILE  34           HA       ILE  34  -2.289   4.287  -1.852
  262    HB   ILE  34           HB       ILE  34  -4.657   4.659  -3.694
  263   1HG1  ILE  34          1HG1      ILE  34  -4.418   2.904  -1.239
  264   2HG1  ILE  34          2HG1      ILE  34  -5.343   4.400  -1.324
  265   1HG2  ILE  34          1HG2      ILE  34  -4.324   2.274  -4.188
  266   2HG2  ILE  34          2HG2      ILE  34  -2.919   3.244  -4.627
  267   3HG2  ILE  34          3HG2      ILE  34  -2.895   2.271  -3.156
  268   1HD1  ILE  34          1HD1      ILE  34  -6.783   2.462  -1.538
  269   2HD1  ILE  34          2HD1      ILE  34  -6.785   3.412  -3.024
  270   3HD1  ILE  34          3HD1      ILE  34  -5.859   1.913  -2.937
  271    H    LEU  35           H        LEU  35  -0.455   4.685  -2.881
  272    HA   LEU  35           HA       LEU  35  -0.520   6.415  -5.258
  273   1HB   LEU  35          1HB       LEU  35   0.971   7.143  -3.450
  274   2HB   LEU  35          2HB       LEU  35   1.806   5.602  -3.511
  275    HG   LEU  35           HG       LEU  35   2.594   6.109  -5.782
  276   1HD1  LEU  35          1HD1      LEU  35   1.238   8.771  -5.367
  277   2HD1  LEU  35          2HD1      LEU  35   2.297   8.349  -6.714
  278   3HD1  LEU  35          3HD1      LEU  35   0.750   7.525  -6.516
  279   1HD2  LEU  35          1HD2      LEU  35   3.971   6.712  -3.865
  280   2HD2  LEU  35          2HD2      LEU  35   4.166   7.879  -5.174
  281   3HD2  LEU  35          3HD2      LEU  35   3.173   8.282  -3.773
  282    H    MET  36           H        MET  36  -0.351   5.498  -7.165
  283    HA   MET  36           HA       MET  36   1.200   3.020  -7.450
  284   1HB   MET  36          1HB       MET  36  -1.541   3.549  -8.627
  285   2HB   MET  36          2HB       MET  36  -0.506   2.206  -9.089
  286   1HG   MET  36          1HG       MET  36  -0.596   1.371  -6.780
  287   2HG   MET  36          2HG       MET  36  -1.683   2.693  -6.362
  288   1HE   MET  36          1HE       MET  36  -2.744  -0.679  -9.331
  289   2HE   MET  36          2HE       MET  36  -1.217  -0.591  -8.452
  290   3HE   MET  36          3HE       MET  36  -1.586   0.599  -9.699
  291    HA   PRO  37           HA       PRO  37   2.932   5.073 -10.994
  292   1HB   PRO  37          1HB       PRO  37   3.256   3.060 -12.783
  293   2HB   PRO  37          2HB       PRO  37   4.258   3.231 -11.337
  294   1HG   PRO  37          1HG       PRO  37   1.890   1.456 -11.803
  295   2HG   PRO  37          2HG       PRO  37   3.435   1.076 -11.019
  296   1HD   PRO  37          1HD       PRO  37   1.188   1.624  -9.616
  297   2HD   PRO  37          2HD       PRO  37   2.807   2.052  -9.027
  298    H    ASP  38           H        ASP  38  -0.053   4.894 -10.828
  299    HA   ASP  38           HA       ASP  38  -0.620   5.738 -13.540
  300   1HB   ASP  38          1HB       ASP  38  -1.933   3.335 -12.292
  301   2HB   ASP  38          2HB       ASP  38  -2.811   4.331 -13.444
  302    H    GLU  39           H        GLU  39  -2.162   4.910 -10.438
  303    HA   GLU  39           HA       GLU  39  -3.680   7.427 -10.621
  304   1HB   GLU  39          1HB       GLU  39  -4.501   4.802  -9.368
  305   2HB   GLU  39          2HB       GLU  39  -5.432   6.290  -9.275
  306   1HG   GLU  39          1HG       GLU  39  -4.754   4.805 -11.803
  307   2HG   GLU  39          2HG       GLU  39  -6.301   4.753 -10.960
  308    H    LEU  40           H        LEU  40  -4.103   8.556  -8.715
  309    HA   LEU  40           HA       LEU  40  -2.695   7.648  -6.291
  310   1HB   LEU  40          1HB       LEU  40  -1.521   9.594  -7.145
  311   2HB   LEU  40          2HB       LEU  40  -3.027  10.479  -7.302
  312    HG   LEU  40           HG       LEU  40  -3.286  10.395  -4.826
  313   1HD1  LEU  40          1HD1      LEU  40  -1.361   9.799  -3.452
  314   2HD1  LEU  40          2HD1      LEU  40  -1.942   8.417  -4.381
  315   3HD1  LEU  40          3HD1      LEU  40  -0.490   9.276  -4.893
  316   1HD2  LEU  40          1HD2      LEU  40  -0.737  11.657  -5.825
  317   2HD2  LEU  40          2HD2      LEU  40  -2.350  12.366  -5.903
  318   3HD2  LEU  40          3HD2      LEU  40  -1.588  12.083  -4.338
  319    H    VAL  41           H        VAL  41  -4.287   6.892  -5.039
  320    HA   VAL  41           HA       VAL  41  -6.934   8.092  -5.207
  321    HB   VAL  41           HB       VAL  41  -6.084   5.737  -3.518
  322   1HG1  VAL  41          1HG1      VAL  41  -8.803   6.654  -4.448
  323   2HG1  VAL  41          2HG1      VAL  41  -8.471   5.200  -3.507
  324   3HG1  VAL  41          3HG1      VAL  41  -8.166   6.792  -2.810
  325   1HG2  VAL  41          1HG2      VAL  41  -7.012   4.327  -5.304
  326   2HG2  VAL  41          2HG2      VAL  41  -7.263   5.763  -6.297
  327   3HG2  VAL  41          3HG2      VAL  41  -5.627   5.265  -5.863
  328    H    GLU  42           H        GLU  42  -6.939   9.978  -4.160
  329    HA   GLU  42           HA       GLU  42  -5.799  10.285  -1.511
  330   1HB   GLU  42          1HB       GLU  42  -7.597  12.196  -3.017
  331   2HB   GLU  42          2HB       GLU  42  -6.534  12.577  -1.671
  332   1HG   GLU  42          1HG       GLU  42  -4.603  12.354  -3.001
  333   2HG   GLU  42          2HG       GLU  42  -5.500  11.571  -4.304
  334    H    HIS  43           H        HIS  43  -8.773   9.458  -2.995
  335    HA   HIS  43           HA       HIS  43 -10.424  10.185  -0.720
  336   1HB   HIS  43          1HB       HIS  43 -11.103  10.411  -3.177
  337   2HB   HIS  43          2HB       HIS  43 -11.264   8.660  -3.192
  338    HD1  HIS  43           HD1      HIS  43 -13.432   7.702  -2.329
  339    HD2  HIS  43           HD2      HIS  43 -12.989  11.741  -1.452
  340    HE1  HIS  43           HE1      HIS  43 -15.657   8.449  -1.435
  341    HE2  HIS  43           HE2      HIS  43 -15.296  10.838  -0.718
  342    H    TRP  44           H        TRP  44  -8.561   8.415   0.123
  343    HA   TRP  44           HA       TRP  44 -10.202   6.091   0.782
  344   1HB   TRP  44          1HB       TRP  44  -8.686   5.539  -1.190
  345   2HB   TRP  44          2HB       TRP  44  -7.331   5.738  -0.085
  346    HD1  TRP  44           HD1      TRP  44 -10.536   3.571  -0.366
  347    HE1  TRP  44           HE1      TRP  44 -10.016   1.247   0.617
  348    HE3  TRP  44           HE3      TRP  44  -5.761   4.429   1.257
  349    HZ2  TRP  44           HZ2      TRP  44  -7.865  -0.044   1.908
  350    HZ3  TRP  44           HZ3      TRP  44  -4.542   2.595   2.352
  351    HH2  TRP  44           HH2      TRP  44  -5.575   0.406   2.673
  352    HA   PRO  45           HA       PRO  45  -7.952   7.553   4.466
  353   1HB   PRO  45          1HB       PRO  45 -10.093   8.059   6.011
  354   2HB   PRO  45          2HB       PRO  45  -9.532   9.201   4.786
  355   1HG   PRO  45          1HG       PRO  45 -11.905   7.444   4.775
  356   2HG   PRO  45          2HG       PRO  45 -11.627   8.967   3.917
  357   1HD   PRO  45          1HD       PRO  45 -11.403   6.306   2.890
  358   2HD   PRO  45          2HD       PRO  45 -11.062   7.829   2.048
  359    H    VAL  46           H        VAL  46  -7.164   6.122   5.884
  360    HA   VAL  46           HA       VAL  46  -8.974   4.092   7.001
  361    HB   VAL  46           HB       VAL  46  -6.118   3.536   6.165
  362   1HG1  VAL  46          1HG1      VAL  46  -8.256   1.719   7.272
  363   2HG1  VAL  46          2HG1      VAL  46  -6.667   1.206   6.706
  364   3HG1  VAL  46          3HG1      VAL  46  -6.804   2.257   8.116
  365   1HG2  VAL  46          1HG2      VAL  46  -7.080   2.069   4.458
  366   2HG2  VAL  46          2HG2      VAL  46  -8.697   2.608   4.912
  367   3HG2  VAL  46          3HG2      VAL  46  -7.552   3.751   4.213
  368    HA   PRO  47           HA       PRO  47  -7.076   6.187  10.555
  369   1HB   PRO  47          1HB       PRO  47  -8.969   5.378  12.332
  370   2HB   PRO  47          2HB       PRO  47  -9.183   6.770  11.263
  371   1HG   PRO  47          1HG       PRO  47 -10.222   3.981  10.972
  372   2HG   PRO  47          2HG       PRO  47 -11.037   5.522  10.648
  373   1HD   PRO  47          1HD       PRO  47  -9.972   3.975   8.687
  374   2HD   PRO  47          2HD       PRO  47 -10.066   5.744   8.575
  375    H    SER  48           H        SER  48  -5.271   4.845  10.632
  376    HA   SER  48           HA       SER  48  -3.877   3.247  11.452
  377   1HB   SER  48          1HB       SER  48  -6.103   2.676  13.431
  378   2HB   SER  48          2HB       SER  48  -4.399   2.259  13.614
  379    HG   SER  48           HG       SER  48  -4.355   4.798  13.185
  380    H    LEU  49           H        LEU  49  -4.357   0.645  12.429
  381    HA   LEU  49           HA       LEU  49  -5.470  -0.595  10.037
  382   1HB   LEU  49          1HB       LEU  49  -3.925  -1.669  12.383
  383   2HB   LEU  49          2HB       LEU  49  -4.715  -2.739  11.241
  384    HG   LEU  49           HG       LEU  49  -3.368  -1.483   9.436
  385   1HD1  LEU  49          1HD1      LEU  49  -2.626   0.370  10.829
  386   2HD1  LEU  49          2HD1      LEU  49  -1.753  -0.752  11.873
  387   3HD1  LEU  49          3HD1      LEU  49  -1.253  -0.538  10.194
  388   1HD2  LEU  49          1HD2      LEU  49  -2.977  -3.795  10.060
  389   2HD2  LEU  49          2HD2      LEU  49  -1.451  -2.959   9.771
  390   3HD2  LEU  49          3HD2      LEU  49  -1.985  -3.275  11.423
  391    H    GLY  50           H        GLY  50  -7.200   0.794  11.889
  392   1HA   GLY  50          1HA       GLY  50  -8.697  -1.212  13.325
  393   2HA   GLY  50          2HA       GLY  50  -9.126   0.483  13.141
  394    H    GLN  51           H        GLN  51  -9.423   0.921  10.566
  395    HA   GLN  51           HA       GLN  51 -11.570  -0.913   9.801
  396   1HB   GLN  51          1HB       GLN  51 -10.940   1.924   9.043
  397   2HB   GLN  51          2HB       GLN  51 -12.038   0.950   8.075
  398   1HG   GLN  51          1HG       GLN  51 -13.330   0.543  10.219
  399   2HG   GLN  51          2HG       GLN  51 -12.352   1.832  10.924
  400   1HE2  GLN  51          2HE2      GLN  51 -12.678   3.945  10.263
  401   2HE2  GLN  51          1HE2      GLN  51 -14.044   4.425   9.314
  402    H    LEU  52           H        LEU  52  -8.571  -1.260   9.408
  403    HA   LEU  52           HA       LEU  52  -8.349  -1.353   6.528
  404   1HB   LEU  52          1HB       LEU  52  -6.383  -0.913   8.011
  405   2HB   LEU  52          2HB       LEU  52  -6.509  -2.563   8.594
  406    HG   LEU  52           HG       LEU  52  -6.074  -3.403   6.325
  407   1HD1  LEU  52          1HD1      LEU  52  -5.716  -0.495   5.617
  408   2HD1  LEU  52          2HD1      LEU  52  -5.359  -1.865   4.567
  409   3HD1  LEU  52          3HD1      LEU  52  -7.021  -1.545   5.064
  410   1HD2  LEU  52          1HD2      LEU  52  -4.207  -3.072   7.863
  411   2HD2  LEU  52          2HD2      LEU  52  -3.722  -2.760   6.196
  412   3HD2  LEU  52          3HD2      LEU  52  -4.025  -1.413   7.294
  413    H    GLN  53           H        GLN  53 -10.173  -2.620   6.120
  414    HA   GLN  53           HA       GLN  53  -9.890  -5.472   6.779
  415   1HB   GLN  53          1HB       GLN  53 -12.350  -5.581   6.914
  416   2HB   GLN  53          2HB       GLN  53 -11.686  -4.465   8.101
  417   1HG   GLN  53          1HG       GLN  53 -12.196  -2.614   6.469
  418   2HG   GLN  53          2HG       GLN  53 -13.096  -3.806   5.532
  419   1HE2  GLN  53          2HE2      GLN  53 -14.992  -4.685   6.402
  420   2HE2  GLN  53          1HE2      GLN  53 -15.836  -3.912   7.701
  421    HA   PRO  54           HA       PRO  54 -10.227  -6.607   2.519
  422   1HB   PRO  54          1HB       PRO  54 -12.728  -8.084   3.210
  423   2HB   PRO  54          2HB       PRO  54 -11.295  -8.642   2.338
  424   1HG   PRO  54          1HG       PRO  54 -11.687  -9.359   4.863
  425   2HG   PRO  54          2HG       PRO  54 -10.064  -8.938   4.285
  426   1HD   PRO  54          1HD       PRO  54 -11.947  -7.353   5.972
  427   2HD   PRO  54          2HD       PRO  54 -10.175  -7.447   6.039
  428    H    ALA  55           H        ALA  55 -13.271  -5.608   4.045
  429    HA   ALA  55           HA       ALA  55 -14.558  -4.958   1.575
  430   1HB   ALA  55          1HB       ALA  55 -15.293  -4.098   4.368
  431   2HB   ALA  55          2HB       ALA  55 -16.329  -4.033   2.941
  432   3HB   ALA  55          3HB       ALA  55 -15.813  -5.591   3.587
  433    H    HIS  56           H        HIS  56 -12.287  -3.319   3.530
  434    HA   HIS  56           HA       HIS  56 -13.052  -0.696   2.462
  435   1HB   HIS  56          1HB       HIS  56 -12.330  -1.200   4.941
  436   2HB   HIS  56          2HB       HIS  56 -10.704  -1.133   4.278
  437    HD1  HIS  56           HD1      HIS  56 -13.521   0.981   5.360
  438    HD2  HIS  56           HD2      HIS  56  -9.951   1.456   3.269
  439    HE1  HIS  56           HE1      HIS  56 -13.088   3.459   5.302
  440    HE2  HIS  56           HE2      HIS  56 -10.816   3.694   4.245
  441    H    MET  57           H        MET  57 -10.717  -3.223   2.175
  442    HA   MET  57           HA       MET  57  -9.019  -1.640   0.392
  443   1HB   MET  57          1HB       MET  57  -8.009  -3.102   2.153
  444   2HB   MET  57          2HB       MET  57  -8.697  -4.498   1.339
  445   1HG   MET  57          1HG       MET  57  -7.363  -3.944  -0.663
  446   2HG   MET  57          2HG       MET  57  -6.629  -2.613   0.229
  447   1HE   MET  57          1HE       MET  57  -5.056  -2.946   2.353
  448   2HE   MET  57          2HE       MET  57  -4.689  -4.523   3.053
  449   3HE   MET  57          3HE       MET  57  -6.329  -3.881   3.136
  450    H    ASP  58           H        ASP  58 -11.832  -3.055   0.078
  451    HA   ASP  58           HA       ASP  58 -11.653  -5.089  -1.804
  452   1HB   ASP  58          1HB       ASP  58 -13.700  -4.608  -0.575
  453   2HB   ASP  58          2HB       ASP  58 -13.861  -3.062  -1.401
  454    H    ALA  59           H        ALA  59 -11.906  -1.589  -2.294
  455    HA   ALA  59           HA       ALA  59 -12.129  -1.565  -5.076
  456   1HB   ALA  59          1HB       ALA  59 -12.430   0.422  -3.673
  457   2HB   ALA  59          2HB       ALA  59 -10.700   0.437  -3.329
  458   3HB   ALA  59          3HB       ALA  59 -11.274   0.714  -4.973
  459    H    VAL  60           H        VAL  60  -9.294  -1.809  -3.009
  460    HA   VAL  60           HA       VAL  60  -7.370  -1.611  -5.100
  461    HB   VAL  60           HB       VAL  60  -7.027  -2.914  -2.391
  462   1HG1  VAL  60          1HG1      VAL  60  -5.013  -1.705  -4.282
  463   2HG1  VAL  60          2HG1      VAL  60  -4.663  -2.354  -2.680
  464   3HG1  VAL  60          3HG1      VAL  60  -5.237  -3.424  -3.959
  465   1HG2  VAL  60          1HG2      VAL  60  -6.192  -0.737  -1.626
  466   2HG2  VAL  60          2HG2      VAL  60  -6.628  -0.030  -3.182
  467   3HG2  VAL  60          3HG2      VAL  60  -7.885  -0.657  -2.115
  468    H    LEU  61           H        LEU  61  -9.026  -4.258  -3.474
  469    HA   LEU  61           HA       LEU  61  -7.594  -6.369  -4.708
  470   1HB   LEU  61          1HB       LEU  61 -10.395  -6.352  -3.578
  471   2HB   LEU  61          2HB       LEU  61  -9.468  -7.787  -3.971
  472    HG   LEU  61           HG       LEU  61  -8.729  -5.766  -1.851
  473   1HD1  LEU  61          1HD1      LEU  61 -10.706  -7.054  -1.243
  474   2HD1  LEU  61          2HD1      LEU  61  -9.849  -8.554  -1.597
  475   3HD1  LEU  61          3HD1      LEU  61  -9.316  -7.527  -0.265
  476   1HD2  LEU  61          1HD2      LEU  61  -7.040  -7.416  -1.198
  477   2HD2  LEU  61          2HD2      LEU  61  -7.488  -8.418  -2.579
  478   3HD2  LEU  61          3HD2      LEU  61  -6.773  -6.827  -2.838
  479    H    ALA  62           H        ALA  62 -10.347  -4.444  -5.645
  480    HA   ALA  62           HA       ALA  62 -11.185  -6.035  -7.844
  481   1HB   ALA  62          1HB       ALA  62 -12.444  -4.062  -8.538
  482   2HB   ALA  62          2HB       ALA  62 -12.635  -4.358  -6.810
  483   3HB   ALA  62          3HB       ALA  62 -11.559  -3.079  -7.371
  484    H    LEU  63           H        LEU  63  -8.870  -3.410  -7.466
  485    HA   LEU  63           HA       LEU  63  -8.272  -3.234 -10.272
  486   1HB   LEU  63          1HB       LEU  63  -6.776  -2.188  -7.865
  487   2HB   LEU  63          2HB       LEU  63  -6.394  -1.797  -9.531
  488    HG   LEU  63           HG       LEU  63  -8.964  -1.091  -8.111
  489   1HD1  LEU  63          1HD1      LEU  63  -8.143   1.210  -8.247
  490   2HD1  LEU  63          2HD1      LEU  63  -7.071   0.193  -7.284
  491   3HD1  LEU  63          3HD1      LEU  63  -6.627   0.627  -8.935
  492   1HD2  LEU  63          1HD2      LEU  63  -9.325  -1.463 -10.484
  493   2HD2  LEU  63          2HD2      LEU  63  -9.425   0.258 -10.111
  494   3HD2  LEU  63          3HD2      LEU  63  -7.976  -0.397 -10.876
  495    H    ASN  64           H        ASN  64  -7.630  -5.457  -7.962
  496    HA   ASN  64           HA       ASN  64  -5.967  -6.948  -7.491
  497   1HB   ASN  64          1HB       ASN  64  -5.782  -8.600  -9.408
  498   2HB   ASN  64          2HB       ASN  64  -7.380  -8.261  -8.774
  499   1HD2  ASN  64          2HD2      ASN  64  -5.457  -6.384 -11.105
  500   2HD2  ASN  64          1HD2      ASN  64  -6.593  -6.539 -12.406
  501    HA   PRO  65           HA       PRO  65  -2.086  -5.264  -9.092
  502   1HB   PRO  65          1HB       PRO  65  -1.199  -4.895  -6.417
  503   2HB   PRO  65          2HB       PRO  65  -1.687  -3.645  -7.561
  504   1HG   PRO  65          1HG       PRO  65  -3.038  -4.314  -5.219
  505   2HG   PRO  65          2HG       PRO  65  -3.713  -3.392  -6.572
  506   1HD   PRO  65          1HD       PRO  65  -4.037  -6.280  -5.891
  507   2HD   PRO  65          2HD       PRO  65  -5.209  -5.147  -6.600
  508    H    ALA  66           H        ALA  66   0.190  -5.976  -8.302
  509    HA   ALA  66           HA       ALA  66   0.110  -8.860  -7.924
  510   1HB   ALA  66          1HB       ALA  66   1.558  -7.953  -9.670
  511   2HB   ALA  66          2HB       ALA  66   2.440  -7.017  -8.464
  512   3HB   ALA  66          3HB       ALA  66   2.507  -8.779  -8.433
  513    H    VAL  67           H        VAL  67   1.351  -5.960  -6.359
  514    HA   VAL  67           HA       VAL  67   1.460  -7.441  -3.846
  515    HB   VAL  67           HB       VAL  67   3.758  -7.465  -4.611
  516   1HG1  VAL  67          1HG1      VAL  67   3.546  -4.464  -4.824
  517   2HG1  VAL  67          2HG1      VAL  67   5.022  -5.410  -5.022
  518   3HG1  VAL  67          3HG1      VAL  67   3.694  -5.597  -6.167
  519   1HG2  VAL  67          1HG2      VAL  67   3.395  -7.168  -2.226
  520   2HG2  VAL  67          2HG2      VAL  67   4.847  -6.310  -2.744
  521   3HG2  VAL  67          3HG2      VAL  67   3.358  -5.416  -2.434
  522    H    ILE  68           H        ILE  68   0.493  -6.385  -2.262
  523    HA   ILE  68           HA       ILE  68  -0.088  -3.524  -2.610
  524    HB   ILE  68           HB       ILE  68  -1.304  -5.456  -0.621
  525   1HG1  ILE  68          1HG1      ILE  68  -2.460  -4.421  -3.221
  526   2HG1  ILE  68          2HG1      ILE  68  -1.840  -6.048  -2.973
  527   1HG2  ILE  68          1HG2      ILE  68  -3.000  -3.707  -0.332
  528   2HG2  ILE  68          2HG2      ILE  68  -1.388  -3.128   0.090
  529   3HG2  ILE  68          3HG2      ILE  68  -2.113  -2.671  -1.452
  530   1HD1  ILE  68          1HD1      ILE  68  -3.574  -6.436  -1.285
  531   2HD1  ILE  68          2HD1      ILE  68  -4.204  -4.814  -1.578
  532   3HD1  ILE  68          3HD1      ILE  68  -4.252  -6.025  -2.860
  533    H    LEU  69           H        LEU  69   1.122  -2.136  -1.508
  534    HA   LEU  69           HA       LEU  69   2.838  -3.211   0.620
  535   1HB   LEU  69          1HB       LEU  69   3.627  -1.987  -1.610
  536   2HB   LEU  69          2HB       LEU  69   3.335  -0.557  -0.641
  537    HG   LEU  69           HG       LEU  69   5.229  -2.797   0.088
  538   1HD1  LEU  69          1HD1      LEU  69   5.768  -0.019  -0.947
  539   2HD1  LEU  69          2HD1      LEU  69   6.988  -1.165  -0.392
  540   3HD1  LEU  69          3HD1      LEU  69   6.024  -1.529  -1.822
  541   1HD2  LEU  69          1HD2      LEU  69   4.292  -1.687   2.054
  542   2HD2  LEU  69          2HD2      LEU  69   6.001  -1.297   1.850
  543   3HD2  LEU  69          3HD2      LEU  69   4.767  -0.120   1.398
  544    H    LEU  70           H        LEU  70   2.197  -2.776   2.590
  545    HA   LEU  70           HA       LEU  70   0.648  -0.358   3.126
  546   1HB   LEU  70          1HB       LEU  70   0.929  -3.011   4.474
  547   2HB   LEU  70          2HB       LEU  70   0.466  -1.622   5.423
  548    HG   LEU  70           HG       LEU  70  -1.508  -2.844   4.791
  549   1HD1  LEU  70          1HD1      LEU  70  -1.717  -0.428   4.882
  550   2HD1  LEU  70          2HD1      LEU  70  -1.263  -0.311   3.181
  551   3HD1  LEU  70          3HD1      LEU  70  -2.771  -1.101   3.639
  552   1HD2  LEU  70          1HD2      LEU  70  -2.150  -3.161   2.456
  553   2HD2  LEU  70          2HD2      LEU  70  -0.615  -2.465   1.938
  554   3HD2  LEU  70          3HD2      LEU  70  -0.637  -3.988   2.828
  555    H    GLY  71           H        GLY  71   2.034   1.276   3.498
  556   1HA   GLY  71          1HA       GLY  71   4.318   0.873   5.274
  557   2HA   GLY  71          2HA       GLY  71   3.903   2.366   4.433
  558    H    THR  72           H        THR  72   3.588   0.558   7.336
  559    HA   THR  72           HA       THR  72   1.259   2.056   8.228
  560    HB   THR  72           HB       THR  72   1.488   0.587  10.284
  561    HG1  THR  72           HG1      THR  72   3.641  -0.032  10.117
  562   1HG2  THR  72          1HG2      THR  72   1.197  -0.782   7.607
  563   2HG2  THR  72          2HG2      THR  72   0.593  -1.386   9.151
  564   3HG2  THR  72          3HG2      THR  72  -0.077   0.092   8.458
  565    H    GLY  73           H        GLY  73   2.939   3.959   7.986
  566   1HA   GLY  73          1HA       GLY  73   3.899   5.720   9.092
  567   2HA   GLY  73          2HA       GLY  73   3.249   5.028  10.568
  568    H    GLU  74           H        GLU  74   4.702   4.610  12.051
  569    HA   GLU  74           HA       GLU  74   7.468   4.896  11.515
  570   1HB   GLU  74          1HB       GLU  74   6.449   5.559  13.647
  571   2HB   GLU  74          2HB       GLU  74   6.095   3.874  14.005
  572   1HG   GLU  74          1HG       GLU  74   8.073   4.708  15.191
  573   2HG   GLU  74          2HG       GLU  74   8.440   3.354  14.123
  574    H    ARG  75           H        ARG  75   5.858   2.052  12.982
  575    HA   ARG  75           HA       ARG  75   7.890   0.387  11.639
  576   1HB   ARG  75          1HB       ARG  75   7.002   0.474  14.386
  577   2HB   ARG  75          2HB       ARG  75   6.718  -1.118  13.699
  578   1HG   ARG  75          1HG       ARG  75   8.818  -1.507  14.356
  579   2HG   ARG  75          2HG       ARG  75   9.244  -0.670  12.863
  580   1HD   ARG  75          1HD       ARG  75   8.815   0.899  15.363
  581   2HD   ARG  75          2HD       ARG  75  10.324   0.019  15.146
  582    HE   ARG  75           HE       ARG  75   9.400   2.024  13.185
  583   1HH1  ARG  75          1HH1      ARG  75  11.854   0.617  15.236
  584   2HH1  ARG  75          2HH1      ARG  75  13.065   1.798  14.837
  585   1HH2  ARG  75          1HH2      ARG  75  10.988   3.607  12.648
  586   2HH2  ARG  75          2HH2      ARG  75  12.580   3.493  13.360
  587    H    GLN  76           H        GLN  76   7.159  -1.815  11.055
  588    HA   GLN  76           HA       GLN  76   4.671  -1.663   9.675
  589   1HB   GLN  76          1HB       GLN  76   5.151  -3.984   8.962
  590   2HB   GLN  76          2HB       GLN  76   6.473  -2.873   8.643
  591   1HG   GLN  76          1HG       GLN  76   7.695  -3.721  10.541
  592   2HG   GLN  76          2HG       GLN  76   6.341  -4.763  10.977
  593   1HE2  GLN  76          2HE2      GLN  76   8.920  -4.211   8.686
  594   2HE2  GLN  76          1HE2      GLN  76   8.899  -5.797   7.992
  595    H    GLN  77           H        GLN  77   2.797  -2.709  10.013
  596    HA   GLN  77           HA       GLN  77   2.459  -4.168  12.540
  597   1HB   GLN  77          1HB       GLN  77   1.646  -1.886  12.861
  598   2HB   GLN  77          2HB       GLN  77   0.653  -2.011  11.417
  599   1HG   GLN  77          1HG       GLN  77  -0.672  -2.222  13.442
  600   2HG   GLN  77          2HG       GLN  77  -0.725  -3.697  12.480
  601   1HE2  GLN  77          2HE2      GLN  77  -1.352  -4.913  14.250
  602   2HE2  GLN  77          1HE2      GLN  77  -0.246  -5.331  15.524
  603    H    PHE  78           H        PHE  78   1.313  -6.010  12.356
  604    HA   PHE  78           HA       PHE  78   0.672  -6.861   9.670
  605   1HB   PHE  78          1HB       PHE  78   0.572  -8.393  12.279
  606   2HB   PHE  78          2HB       PHE  78   0.420  -9.090  10.668
  607    HD1  PHE  78           HD1      PHE  78   2.680  -7.955  13.223
  608    HD2  PHE  78           HD2      PHE  78   2.374  -8.997   9.111
  609    HE1  PHE  78           HE1      PHE  78   5.125  -8.206  13.110
  610    HE2  PHE  78           HE2      PHE  78   4.817  -9.253   8.990
  611    HZ   PHE  78           HZ       PHE  78   6.196  -8.857  10.990
  612    HA   PRO  79           HA       PRO  79  -3.652  -5.920  10.127
  613   1HB   PRO  79          1HB       PRO  79  -4.034  -7.615   7.763
  614   2HB   PRO  79          2HB       PRO  79  -4.324  -5.885   7.959
  615   1HG   PRO  79          1HG       PRO  79  -2.295  -6.838   6.464
  616   2HG   PRO  79          2HG       PRO  79  -2.168  -5.323   7.378
  617   1HD   PRO  79          1HD       PRO  79  -1.096  -8.037   8.048
  618   2HD   PRO  79          2HD       PRO  79  -0.334  -6.444   8.240
  619    H    SER  80           H        SER  80  -5.765  -7.197   9.922
  620    HA   SER  80           HA       SER  80  -5.677  -9.345  11.766
  621   1HB   SER  80          1HB       SER  80  -8.020  -8.573  10.024
  622   2HB   SER  80          2HB       SER  80  -8.056  -9.321  11.623
  623    HG   SER  80           HG       SER  80  -7.095  -7.358  12.422
  624    H    THR  81           H        THR  81  -6.585 -11.489  11.407
  625    HA   THR  81           HA       THR  81  -5.273 -12.963   9.505
  626    HB   THR  81           HB       THR  81  -7.095 -14.694  10.049
  627    HG1  THR  81           HG1      THR  81  -8.728 -14.027  11.200
  628   1HG2  THR  81          1HG2      THR  81  -6.196 -15.068  12.296
  629   2HG2  THR  81          2HG2      THR  81  -4.918 -14.657  11.152
  630   3HG2  THR  81          3HG2      THR  81  -5.510 -13.443  12.286
  631    H    ASP  82           H        ASP  82  -8.572 -11.679   9.382
  632    HA   ASP  82           HA       ASP  82  -9.450 -13.012   7.093
  633   1HB   ASP  82          1HB       ASP  82 -10.240 -10.316   8.203
  634   2HB   ASP  82          2HB       ASP  82 -11.090 -11.119   6.885
  635    H    VAL  83           H        VAL  83  -7.509 -10.116   7.425
  636    HA   VAL  83           HA       VAL  83  -7.678  -9.317   4.695
  637    HB   VAL  83           HB       VAL  83  -5.479  -8.708   6.682
  638   1HG1  VAL  83          1HG1      VAL  83  -5.067  -6.741   5.279
  639   2HG1  VAL  83          2HG1      VAL  83  -4.839  -8.241   4.381
  640   3HG1  VAL  83          3HG1      VAL  83  -6.306  -7.291   4.150
  641   1HG2  VAL  83          1HG2      VAL  83  -7.657  -8.045   7.559
  642   2HG2  VAL  83          2HG2      VAL  83  -6.692  -6.632   7.135
  643   3HG2  VAL  83          3HG2      VAL  83  -7.996  -7.160   6.072
  644    H    LEU  84           H        LEU  84  -5.343 -11.193   6.585
  645    HA   LEU  84           HA       LEU  84  -3.523 -11.725   4.513
  646   1HB   LEU  84          1HB       LEU  84  -4.177 -13.092   7.099
  647   2HB   LEU  84          2HB       LEU  84  -3.076 -13.851   5.969
  648    HG   LEU  84           HG       LEU  84  -1.821 -12.676   7.659
  649   1HD1  LEU  84          1HD1      LEU  84  -0.894 -12.717   5.416
  650   2HD1  LEU  84          2HD1      LEU  84  -1.735 -11.217   5.027
  651   3HD1  LEU  84          3HD1      LEU  84  -0.462 -11.222   6.246
  652   1HD2  LEU  84          1HD2      LEU  84  -1.961 -10.254   7.937
  653   2HD2  LEU  84          2HD2      LEU  84  -3.295 -10.196   6.784
  654   3HD2  LEU  84          3HD2      LEU  84  -3.495 -11.034   8.322
  655    H    ALA  85           H        ALA  85  -6.393 -13.470   5.618
  656    HA   ALA  85           HA       ALA  85  -6.154 -15.724   3.974
  657   1HB   ALA  85          1HB       ALA  85  -7.710 -15.564   5.867
  658   2HB   ALA  85          2HB       ALA  85  -8.689 -14.416   4.953
  659   3HB   ALA  85          3HB       ALA  85  -8.520 -16.078   4.388
  660    H    ALA  86           H        ALA  86  -7.924 -12.690   3.438
  661    HA   ALA  86           HA       ALA  86  -8.912 -13.334   0.884
  662   1HB   ALA  86          1HB       ALA  86  -9.817 -11.510   2.244
  663   2HB   ALA  86          2HB       ALA  86  -8.318 -10.606   2.029
  664   3HB   ALA  86          3HB       ALA  86  -9.348 -10.949   0.639
  665    H    CYS  87           H        CYS  87  -5.931 -11.761   1.931
  666    HA   CYS  87           HA       CYS  87  -5.016 -11.016  -0.632
  667   1HB   CYS  87          1HB       CYS  87  -4.170 -10.136   1.567
  668   2HB   CYS  87          2HB       CYS  87  -3.331 -11.666   1.795
  669    HG   CYS  87           HG       CYS  87  -1.898 -11.231  -0.731
  670    H    LEU  88           H        LEU  88  -4.510 -13.896   1.349
  671    HA   LEU  88           HA       LEU  88  -2.608 -15.122  -0.354
  672   1HB   LEU  88          1HB       LEU  88  -2.984 -15.653   2.065
  673   2HB   LEU  88          2HB       LEU  88  -4.477 -16.447   1.617
  674    HG   LEU  88           HG       LEU  88  -1.866 -17.363   0.440
  675   1HD1  LEU  88          1HD1      LEU  88  -3.035 -18.216   3.087
  676   2HD1  LEU  88          2HD1      LEU  88  -1.663 -18.967   2.273
  677   3HD1  LEU  88          3HD1      LEU  88  -1.539 -17.308   2.860
  678   1HD2  LEU  88          1HD2      LEU  88  -3.948 -18.242  -0.514
  679   2HD2  LEU  88          2HD2      LEU  88  -3.035 -19.504   0.313
  680   3HD2  LEU  88          3HD2      LEU  88  -4.450 -18.789   1.086
  681    H    THR  89           H        THR  89  -6.130 -15.503  -0.023
  682    HA   THR  89           HA       THR  89  -6.274 -17.673  -1.845
  683    HB   THR  89           HB       THR  89  -7.967 -17.190  -0.059
  684    HG1  THR  89           HG1      THR  89  -9.695 -17.350  -2.087
  685   1HG2  THR  89          1HG2      THR  89  -9.775 -15.622  -0.551
  686   2HG2  THR  89          2HG2      THR  89  -8.228 -14.783  -0.443
  687   3HG2  THR  89          3HG2      THR  89  -8.945 -15.112  -2.021
  688    H    ARG  90           H        ARG  90  -6.247 -14.229  -2.279
  689    HA   ARG  90           HA       ARG  90  -7.278 -14.427  -4.990
  690   1HB   ARG  90          1HB       ARG  90  -6.351 -12.087  -3.331
  691   2HB   ARG  90          2HB       ARG  90  -6.797 -11.935  -5.024
  692   1HG   ARG  90          1HG       ARG  90  -8.656 -13.079  -2.962
  693   2HG   ARG  90          2HG       ARG  90  -8.570 -11.355  -3.315
  694   1HD   ARG  90          1HD       ARG  90 -10.388 -12.430  -4.548
  695   2HD   ARG  90          2HD       ARG  90  -9.167 -11.781  -5.637
  696    HE   ARG  90           HE       ARG  90  -8.519 -13.971  -6.194
  697   1HH1  ARG  90          1HH1      ARG  90 -11.181 -13.924  -3.904
  698   2HH1  ARG  90          2HH1      ARG  90 -11.609 -15.581  -4.195
  699   1HH2  ARG  90          1HH2      ARG  90  -9.106 -16.125  -6.577
  700   2HH2  ARG  90          2HH2      ARG  90 -10.441 -16.832  -5.709
  701    H    GLY  91           H        GLY  91  -4.359 -14.939  -3.526
  702   1HA   GLY  91          1HA       GLY  91  -2.286 -15.365  -4.420
  703   2HA   GLY  91          2HA       GLY  91  -2.997 -15.144  -6.011
  704    H    ILE  92           H        ILE  92  -2.825 -12.818  -3.359
  705    HA   ILE  92           HA       ILE  92  -1.153 -11.102  -5.080
  706    HB   ILE  92           HB       ILE  92  -3.181 -10.215  -3.010
  707   1HG1  ILE  92          1HG1      ILE  92  -3.306 -10.085  -6.033
  708   2HG1  ILE  92          2HG1      ILE  92  -4.242 -11.178  -5.020
  709   1HG2  ILE  92          1HG2      ILE  92  -1.542  -8.604  -4.967
  710   2HG2  ILE  92          2HG2      ILE  92  -2.785  -7.963  -3.890
  711   3HG2  ILE  92          3HG2      ILE  92  -1.312  -8.665  -3.218
  712   1HD1  ILE  92          1HD1      ILE  92  -4.434  -8.173  -5.026
  713   2HD1  ILE  92          2HD1      ILE  92  -5.582  -9.296  -5.757
  714   3HD1  ILE  92          3HD1      ILE  92  -5.373  -9.265  -4.007
  715    H    GLY  93           H        GLY  93   0.559  -9.989  -4.091
  716   1HA   GLY  93          1HA       GLY  93   1.507 -11.212  -1.624
  717   2HA   GLY  93          2HA       GLY  93   2.418 -10.140  -2.679
  718    H    LEU  94           H        LEU  94   1.511 -10.284   0.325
  719    HA   LEU  94           HA       LEU  94   0.615  -7.489   0.515
  720   1HB   LEU  94          1HB       LEU  94  -0.798  -9.221   1.619
  721   2HB   LEU  94          2HB       LEU  94   0.565  -9.637   2.640
  722    HG   LEU  94           HG       LEU  94   0.534  -7.339   3.572
  723   1HD1  LEU  94          1HD1      LEU  94  -1.991  -7.064   1.946
  724   2HD1  LEU  94          2HD1      LEU  94  -1.417  -5.921   3.161
  725   3HD1  LEU  94          3HD1      LEU  94  -0.482  -6.186   1.689
  726   1HD2  LEU  94          1HD2      LEU  94  -2.074  -8.840   3.790
  727   2HD2  LEU  94          2HD2      LEU  94  -0.610  -9.166   4.719
  728   3HD2  LEU  94          3HD2      LEU  94  -1.469  -7.640   4.933
  729    H    GLU  95           H        GLU  95   2.205  -6.095   0.867
  730    HA   GLU  95           HA       GLU  95   4.612  -7.045   2.274
  731   1HB   GLU  95          1HB       GLU  95   4.815  -6.242  -0.121
  732   2HB   GLU  95          2HB       GLU  95   4.389  -4.639   0.461
  733   1HG   GLU  95          1HG       GLU  95   6.783  -4.851   0.213
  734   2HG   GLU  95          2HG       GLU  95   6.354  -4.643   1.911
  735    H    ALA  96           H        ALA  96   4.669  -6.420   4.331
  736    HA   ALA  96           HA       ALA  96   3.513  -3.799   5.032
  737   1HB   ALA  96          1HB       ALA  96   4.013  -6.189   6.806
  738   2HB   ALA  96          2HB       ALA  96   3.306  -4.655   7.313
  739   3HB   ALA  96          3HB       ALA  96   2.449  -5.685   6.166
  740    H    MET  97           H        MET  97   4.937  -2.236   5.439
  741    HA   MET  97           HA       MET  97   7.440  -2.862   6.792
  742   1HB   MET  97          1HB       MET  97   7.307  -1.666   4.029
  743   2HB   MET  97          2HB       MET  97   8.695  -1.434   5.081
  744   1HG   MET  97          1HG       MET  97   8.977  -3.887   5.180
  745   2HG   MET  97          2HG       MET  97   7.650  -4.053   4.031
  746   1HE   MET  97          1HE       MET  97   9.115  -2.273   0.860
  747   2HE   MET  97          2HE       MET  97   8.134  -1.550   2.135
  748   3HE   MET  97          3HE       MET  97   7.742  -3.158   1.525
  749    H    THR  98           H        THR  98   8.750  -0.613   6.775
  750    HA   THR  98           HA       THR  98   7.110   1.212   8.266
  751    HB   THR  98           HB       THR  98   9.199   2.464   8.614
  752    HG1  THR  98           HG1      THR  98  11.070   0.967   7.608
  753   1HG2  THR  98          1HG2      THR  98   9.586  -0.519   8.899
  754   2HG2  THR  98          2HG2      THR  98  10.481   0.726   9.769
  755   3HG2  THR  98          3HG2      THR  98   8.752   0.527  10.046
  756    H    ASN  99           H        ASN  99   7.116   3.558   7.806
  757    HA   ASN  99           HA       ASN  99   6.186   4.250   5.284
  758   1HB   ASN  99          1HB       ASN  99   5.829   5.619   7.290
  759   2HB   ASN  99          2HB       ASN  99   7.542   6.016   7.337
  760   1HD2  ASN  99          2HD2      ASN  99   5.511   5.868   4.456
  761   2HD2  ASN  99          1HD2      ASN  99   5.626   7.551   4.087
  762    H    ALA 100           H        ALA 100   9.453   4.517   6.609
  763    HA   ALA 100           HA       ALA 100  10.584   5.839   4.378
  764   1HB   ALA 100          1HB       ALA 100  11.590   5.876   6.614
  765   2HB   ALA 100          2HB       ALA 100  11.965   4.160   6.467
  766   3HB   ALA 100          3HB       ALA 100  12.732   5.326   5.388
  767    H    ALA 101           H        ALA 101  10.515   2.415   5.349
  768    HA   ALA 101           HA       ALA 101  12.127   1.470   3.234
  769   1HB   ALA 101          1HB       ALA 101  10.014  -0.027   4.779
  770   2HB   ALA 101          2HB       ALA 101  11.312  -0.741   3.822
  771   3HB   ALA 101          3HB       ALA 101  11.694   0.179   5.276
  772    H    ALA 102           H        ALA 102   8.651   1.922   3.552
  773    HA   ALA 102           HA       ALA 102   7.841   0.610   1.211
  774   1HB   ALA 102          1HB       ALA 102   5.781   1.900   1.414
  775   2HB   ALA 102          2HB       ALA 102   6.295   1.283   2.984
  776   3HB   ALA 102          3HB       ALA 102   6.560   2.977   2.572
  777    H    ALA 103           H        ALA 103   8.627   4.031   1.779
  778    HA   ALA 103           HA       ALA 103   8.141   4.846  -0.894
  779   1HB   ALA 103          1HB       ALA 103   9.812   6.183   1.232
  780   2HB   ALA 103          2HB       ALA 103   9.231   6.933  -0.255
  781   3HB   ALA 103          3HB       ALA 103   8.082   6.412   0.978
  782    H    ARG 104           H        ARG 104  10.964   3.660   0.806
  783    HA   ARG 104           HA       ARG 104  12.927   4.412  -1.058
  784   1HB   ARG 104          1HB       ARG 104  13.452   3.665   1.225
  785   2HB   ARG 104          2HB       ARG 104  12.909   2.042   0.820
  786   1HG   ARG 104          1HG       ARG 104  14.686   1.983  -0.941
  787   2HG   ARG 104          2HG       ARG 104  15.291   3.505  -0.286
  788   1HD   ARG 104          1HD       ARG 104  16.559   1.683   0.644
  789   2HD   ARG 104          2HD       ARG 104  15.567   2.404   1.909
  790    HE   ARG 104           HE       ARG 104  13.988   0.487   1.442
  791   1HH1  ARG 104          1HH1      ARG 104  17.440   0.239   0.869
  792   2HH1  ARG 104          2HH1      ARG 104  17.481  -1.484   1.140
  793   1HH2  ARG 104          1HH2      ARG 104  14.045  -1.773   1.786
  794   2HH2  ARG 104          2HH2      ARG 104  15.566  -2.614   1.671
  795    H    THR 105           H        THR 105  11.247   1.281  -0.647
  796    HA   THR 105           HA       THR 105  12.566   0.175  -2.937
  797    HB   THR 105           HB       THR 105  11.802  -1.180  -0.957
  798    HG1  THR 105           HG1      THR 105  10.699  -2.785  -2.622
  799   1HG2  THR 105          1HG2      THR 105   9.471  -1.968  -0.955
  800   2HG2  THR 105          2HG2      THR 105   9.579  -0.232  -0.663
  801   3HG2  THR 105          3HG2      THR 105   9.095  -0.831  -2.250
  802    H    TYR 106           H        TYR 106   9.770   2.081  -2.468
  803    HA   TYR 106           HA       TYR 106   8.183   1.258  -4.631
  804   1HB   TYR 106          1HB       TYR 106   7.364   2.787  -2.883
  805   2HB   TYR 106          2HB       TYR 106   8.468   4.034  -3.454
  806    HD1  TYR 106           HD1      TYR 106   5.606   1.924  -4.559
  807    HD2  TYR 106           HD2      TYR 106   7.773   5.546  -5.090
  808    HE1  TYR 106           HE1      TYR 106   3.887   2.714  -6.130
  809    HE2  TYR 106           HE2      TYR 106   6.062   6.348  -6.663
  810    HH   TYR 106           HH       TYR 106   4.335   5.458  -8.119
  811    H    ASN 107           H        ASN 107  10.983   3.375  -4.437
  812    HA   ASN 107           HA       ASN 107  10.942   4.548  -6.946
  813   1HB   ASN 107          1HB       ASN 107  13.097   3.755  -5.039
  814   2HB   ASN 107          2HB       ASN 107  13.559   4.232  -6.663
  815   1HD2  ASN 107          2HD2      ASN 107  14.625   6.046  -5.944
  816   2HD2  ASN 107          1HD2      ASN 107  13.783   7.452  -5.370
  817    H    VAL 108           H        VAL 108  12.249   1.416  -5.963
  818    HA   VAL 108           HA       VAL 108  13.224   0.690  -8.530
  819    HB   VAL 108           HB       VAL 108  12.452  -1.163  -6.268
  820   1HG1  VAL 108          1HG1      VAL 108  12.827  -2.315  -8.371
  821   2HG1  VAL 108          2HG1      VAL 108  14.380  -1.503  -8.562
  822   3HG1  VAL 108          3HG1      VAL 108  14.142  -2.653  -7.246
  823   1HG2  VAL 108          1HG2      VAL 108  14.800  -1.006  -5.561
  824   2HG2  VAL 108          2HG2      VAL 108  15.071   0.243  -6.776
  825   3HG2  VAL 108          3HG2      VAL 108  13.963   0.542  -5.437
  826    H    LEU 109           H        LEU 109  10.311  -0.178  -6.701
  827    HA   LEU 109           HA       LEU 109   9.266  -1.986  -8.574
  828   1HB   LEU 109          1HB       LEU 109   7.805  -0.318  -6.527
  829   2HB   LEU 109          2HB       LEU 109   7.140  -1.709  -7.363
  830    HG   LEU 109           HG       LEU 109   9.486  -1.767  -5.462
  831   1HD1  LEU 109          1HD1      LEU 109   7.963  -2.960  -3.970
  832   2HD1  LEU 109          2HD1      LEU 109   7.382  -1.333  -4.322
  833   3HD1  LEU 109          3HD1      LEU 109   6.648  -2.722  -5.121
  834   1HD2  LEU 109          1HD2      LEU 109   9.281  -4.199  -5.636
  835   2HD2  LEU 109          2HD2      LEU 109   8.026  -4.007  -6.860
  836   3HD2  LEU 109          3HD2      LEU 109   9.674  -3.469  -7.192
  837    H    ALA 110           H        ALA 110   8.663   1.490  -8.134
  838    HA   ALA 110           HA       ALA 110   6.629   1.683 -10.087
  839   1HB   ALA 110          1HB       ALA 110   6.973   4.088  -9.960
  840   2HB   ALA 110          2HB       ALA 110   6.970   3.373  -8.348
  841   3HB   ALA 110          3HB       ALA 110   8.494   3.838  -9.103
  842    H    SER 111           H        SER 111  10.131   2.212 -10.249
  843    HA   SER 111           HA       SER 111  10.178   3.058 -12.949
  844   1HB   SER 111          1HB       SER 111  12.380   1.734 -11.344
  845   2HB   SER 111          2HB       SER 111  12.591   2.665 -12.827
  846    HG   SER 111           HG       SER 111  12.020   3.530 -10.229
  847    H    GLU 112           H        GLU 112  10.470  -0.085 -11.389
  848    HA   GLU 112           HA       GLU 112  11.125  -1.574 -13.699
  849   1HB   GLU 112          1HB       GLU 112  11.493  -2.423 -11.442
  850   2HB   GLU 112          2HB       GLU 112   9.764  -2.418 -11.135
  851   1HG   GLU 112          1HG       GLU 112   9.465  -4.113 -12.882
  852   2HG   GLU 112          2HG       GLU 112  11.210  -4.134 -13.139
  853    H    GLY 113           H        GLY 113   8.086  -0.550 -12.287
  854   1HA   GLY 113          1HA       GLY 113   6.086  -0.318 -13.551
  855   2HA   GLY 113          2HA       GLY 113   6.691  -1.528 -14.677
  856    H    ARG 114           H        ARG 114   7.044  -2.109 -11.320
  857    HA   ARG 114           HA       ARG 114   5.558  -4.527 -11.406
  858   1HB   ARG 114          1HB       ARG 114   7.492  -4.132  -9.901
  859   2HB   ARG 114          2HB       ARG 114   6.546  -2.945  -9.019
  860   1HG   ARG 114          1HG       ARG 114   6.469  -4.885  -7.718
  861   2HG   ARG 114          2HG       ARG 114   4.908  -4.825  -8.538
  862   1HD   ARG 114          1HD       ARG 114   5.837  -7.084  -8.564
  863   2HD   ARG 114          2HD       ARG 114   5.705  -6.428 -10.195
  864    HE   ARG 114           HE       ARG 114   8.173  -5.879  -9.916
  865   1HH1  ARG 114          1HH1      ARG 114   6.657  -8.588  -8.277
  866   2HH1  ARG 114          2HH1      ARG 114   8.120  -9.531  -8.223
  867   1HH2  ARG 114          1HH2      ARG 114  10.066  -7.083  -9.843
  868   2HH2  ARG 114          2HH2      ARG 114  10.071  -8.678  -9.139
  869    H    ARG 115           H        ARG 115   3.480  -4.956 -10.781
  870    HA   ARG 115           HA       ARG 115   1.633  -2.823 -10.406
  871   1HB   ARG 115          1HB       ARG 115   1.395  -5.810 -10.129
  872   2HB   ARG 115          2HB       ARG 115   0.057  -4.734  -9.761
  873   1HG   ARG 115          1HG       ARG 115   0.050  -3.918 -12.040
  874   2HG   ARG 115          2HG       ARG 115   1.447  -4.930 -12.421
  875   1HD   ARG 115          1HD       ARG 115   0.202  -6.923 -12.066
  876   2HD   ARG 115          2HD       ARG 115  -1.152  -6.028 -11.383
  877    HE   ARG 115           HE       ARG 115  -0.975  -5.019 -13.878
  878   1HH1  ARG 115          1HH1      ARG 115  -0.922  -8.310 -12.725
  879   2HH1  ARG 115          2HH1      ARG 115  -1.897  -8.931 -14.023
  880   1HH2  ARG 115          1HH2      ARG 115  -2.233  -5.808 -15.615
  881   2HH2  ARG 115          2HH2      ARG 115  -2.612  -7.509 -15.698
  882    H    VAL 116           H        VAL 116   2.820  -1.817  -8.613
  883    HA   VAL 116           HA       VAL 116   2.337  -3.127  -6.037
  884    HB   VAL 116           HB       VAL 116   4.641  -2.469  -6.329
  885   1HG1  VAL 116          1HG1      VAL 116   4.375  -0.731  -8.002
  886   2HG1  VAL 116          2HG1      VAL 116   3.613   0.324  -6.813
  887   3HG1  VAL 116          3HG1      VAL 116   5.309  -0.128  -6.634
  888   1HG2  VAL 116          1HG2      VAL 116   3.759  -2.267  -4.084
  889   2HG2  VAL 116          2HG2      VAL 116   4.933  -0.985  -4.383
  890   3HG2  VAL 116          3HG2      VAL 116   3.207  -0.626  -4.419
  891    H    ALA 117           H        ALA 117   0.706  -2.497  -4.849
  892    HA   ALA 117           HA       ALA 117  -0.489   0.138  -5.330
  893   1HB   ALA 117          1HB       ALA 117  -2.405  -0.700  -4.044
  894   2HB   ALA 117          2HB       ALA 117  -2.035  -1.756  -5.407
  895   3HB   ALA 117          3HB       ALA 117  -1.557  -2.222  -3.774
  896    H    LEU 118           H        LEU 118   0.666   1.592  -4.174
  897    HA   LEU 118           HA       LEU 118   1.689   0.850  -1.563
  898   1HB   LEU 118          1HB       LEU 118   3.110   2.096  -3.138
  899   2HB   LEU 118          2HB       LEU 118   1.964   3.422  -3.118
  900    HG   LEU 118           HG       LEU 118   2.428   3.749  -0.702
  901   1HD1  LEU 118          1HD1      LEU 118   4.570   1.680  -1.162
  902   2HD1  LEU 118          2HD1      LEU 118   4.365   2.652   0.296
  903   3HD1  LEU 118          3HD1      LEU 118   3.130   1.479  -0.163
  904   1HD2  LEU 118          1HD2      LEU 118   4.841   3.839  -2.510
  905   2HD2  LEU 118          2HD2      LEU 118   3.596   5.081  -2.373
  906   3HD2  LEU 118          3HD2      LEU 118   4.649   4.734  -1.002
  907    H    ALA 119           H        ALA 119  -0.169   0.657  -0.365
  908    HA   ALA 119           HA       ALA 119  -1.874   2.987  -0.007
  909   1HB   ALA 119          1HB       ALA 119  -1.971   0.273   1.320
  910   2HB   ALA 119          2HB       ALA 119  -3.181   1.547   1.479
  911   3HB   ALA 119          3HB       ALA 119  -2.919   0.771  -0.082
  912    H    MET 120           H        MET 120  -0.680   4.513   1.008
  913    HA   MET 120           HA       MET 120   1.095   3.751   3.170
  914   1HB   MET 120          1HB       MET 120   1.708   5.446   1.411
  915   2HB   MET 120          2HB       MET 120   0.516   6.523   2.126
  916   1HG   MET 120          1HG       MET 120   2.669   7.122   2.953
  917   2HG   MET 120          2HG       MET 120   1.754   6.388   4.268
  918   1HE   MET 120          1HE       MET 120   5.123   4.264   1.935
  919   2HE   MET 120          2HE       MET 120   4.639   5.939   1.665
  920   3HE   MET 120          3HE       MET 120   3.548   4.624   1.228
  921    H    ILE 121           H        ILE 121   0.480   3.674   5.197
  922    HA   ILE 121           HA       ILE 121  -1.814   5.301   6.060
  923    HB   ILE 121           HB       ILE 121  -0.640   2.845   7.387
  924   1HG1  ILE 121          1HG1      ILE 121  -3.234   3.195   5.860
  925   2HG1  ILE 121          2HG1      ILE 121  -1.816   2.328   5.278
  926   1HG2  ILE 121          1HG2      ILE 121  -3.092   4.471   8.062
  927   2HG2  ILE 121          2HG2      ILE 121  -2.621   2.958   8.838
  928   3HG2  ILE 121          3HG2      ILE 121  -1.601   4.388   9.001
  929   1HD1  ILE 121          1HD1      ILE 121  -3.523   0.802   6.086
  930   2HD1  ILE 121          2HD1      ILE 121  -2.067   0.706   7.079
  931   3HD1  ILE 121          3HD1      ILE 121  -3.481   1.579   7.670
  932    H    VAL 122           H        VAL 122  -1.083   7.148   6.860
  933    HA   VAL 122           HA       VAL 122   1.529   7.281   8.130
  934    HB   VAL 122           HB       VAL 122  -0.445   9.509   7.597
  935   1HG1  VAL 122          1HG1      VAL 122   2.500   9.568   8.239
  936   2HG1  VAL 122          2HG1      VAL 122   1.515  10.969   7.819
  937   3HG1  VAL 122          3HG1      VAL 122   1.187  10.073   9.303
  938   1HG2  VAL 122          1HG2      VAL 122   1.900   8.592   5.935
  939   2HG2  VAL 122          2HG2      VAL 122   0.196   8.425   5.513
  940   3HG2  VAL 122          3HG2      VAL 122   0.922  10.027   5.631
  941    H    GLY 123           H        GLY 123   1.866   7.625  10.275
  942   1HA   GLY 123          1HA       GLY 123  -0.152   6.910  12.103
  943   2HA   GLY 123          2HA       GLY 123   1.404   7.597  12.528
  944    H    GLY 124           H        GLY 124   1.256  10.034  11.327
  945   1HA   GLY 124          1HA       GLY 124   0.408  12.163  11.556
  946   2HA   GLY 124          2HA       GLY 124  -1.139  11.442  11.973
  947    H    LEU 125           H        LEU 125  -1.510  10.808  14.157
  948    HA   LEU 125           HA       LEU 125   0.275  12.085  16.114
  949   1HB   LEU 125          1HB       LEU 125  -2.738  12.250  16.017
  950   2HB   LEU 125          2HB       LEU 125  -1.782  12.717  17.408
  951    HG   LEU 125           HG       LEU 125  -1.664  14.009  14.680
  952   1HD1  LEU 125          1HD1      LEU 125  -3.720  14.520  15.885
  953   2HD1  LEU 125          2HD1      LEU 125  -2.781  15.000  17.299
  954   3HD1  LEU 125          3HD1      LEU 125  -2.664  15.931  15.806
  955   1HD2  LEU 125          1HD2      LEU 125  -0.216  15.657  15.756
  956   2HD2  LEU 125          2HD2      LEU 125  -0.251  14.720  17.249
  957   3HD2  LEU 125          3HD2      LEU 125   0.503  14.047  15.803
  958    H    GLU 126           H        GLU 126  -0.889  11.385  18.438
  959    HA   GLU 126           HA       GLU 126  -1.236   8.466  18.277
  960   1HB   GLU 126          1HB       GLU 126   0.420   9.896  20.365
  961   2HB   GLU 126          2HB       GLU 126   0.187   8.158  20.220
  962   1HG   GLU 126          1HG       GLU 126   1.275   8.279  17.981
  963   2HG   GLU 126          2HG       GLU 126   1.648   9.967  18.316
  964    H    HIS 127           H        HIS 127  -1.905   7.674  20.616
  965    HA   HIS 127           HA       HIS 127  -4.500   8.754  20.958
  966   1HB   HIS 127          1HB       HIS 127  -4.876   7.033  22.540
  967   2HB   HIS 127          2HB       HIS 127  -3.798   6.343  21.335
  968    HD1  HIS 127           HD1      HIS 127  -4.281   6.267  24.793
  969    HD2  HIS 127           HD2      HIS 127  -0.904   6.771  22.408
  970    HE1  HIS 127           HE1      HIS 127  -2.319   5.668  26.253
  971    HE2  HIS 127           HE2      HIS 127  -0.291   5.922  24.777
  972    H    HIS 128           H        HIS 128  -5.421   9.904  22.618
  973    HA   HIS 128           HA       HIS 128  -3.830  10.627  24.929
  974   1HB   HIS 128          1HB       HIS 128  -4.193  13.015  24.758
  975   2HB   HIS 128          2HB       HIS 128  -3.388  12.464  23.298
  976    HD1  HIS 128           HD1      HIS 128  -6.263  14.375  24.456
  977    HD2  HIS 128           HD2      HIS 128  -5.228  12.286  21.012
  978    HE1  HIS 128           HE1      HIS 128  -7.837  15.187  22.673
  979    HE2  HIS 128           HE2      HIS 128  -7.248  13.855  20.613
  980    H    HIS 129           H        HIS 129  -5.063  10.165  26.614
  981    HA   HIS 129           HA       HIS 129  -7.892   9.780  26.231
  982   1HB   HIS 129          1HB       HIS 129  -6.477   8.251  27.631
  983   2HB   HIS 129          2HB       HIS 129  -6.345   9.550  28.816
  984    HD1  HIS 129           HD1      HIS 129  -8.186   9.702  30.516
  985    HD2  HIS 129           HD2      HIS 129  -9.229   7.370  27.233
  986    HE1  HIS 129           HE1      HIS 129 -10.435   8.723  31.064
  987    HE2  HIS 129           HE2      HIS 129 -11.141   7.513  28.967
  988    H    HIS 130           H        HIS 130  -5.840  12.192  27.745
  989    HA   HIS 130           HA       HIS 130  -8.031  13.409  29.148
  990   1HB   HIS 130          1HB       HIS 130  -6.519  15.023  29.942
  991   2HB   HIS 130          2HB       HIS 130  -5.564  13.555  29.821
  992    HD1  HIS 130           HD1      HIS 130  -3.731  13.492  27.946
  993    HD2  HIS 130           HD2      HIS 130  -5.703  17.131  28.353
  994    HE1  HIS 130           HE1      HIS 130  -2.329  15.173  26.701
  995    HE2  HIS 130           HE2      HIS 130  -3.434  17.397  27.145
  996    H    HIS 131           H        HIS 131  -9.399  14.907  28.485
  997    HA   HIS 131           HA       HIS 131  -9.355  15.657  25.684
  998   1HB   HIS 131          1HB       HIS 131 -11.453  14.907  26.824
  999   2HB   HIS 131          2HB       HIS 131 -11.385  16.354  27.821
 1000    HD1  HIS 131           HD1      HIS 131 -12.139  18.568  26.750
 1001    HD2  HIS 131           HD2      HIS 131 -12.189  15.341  24.131
 1002    HE1  HIS 131           HE1      HIS 131 -13.367  19.369  24.715
 1003    HE2  HIS 131           HE2      HIS 131 -13.154  17.489  23.058
 1004    H    HIS 132           H        HIS 132  -9.010  17.661  24.882
 1005    HA   HIS 132           HA       HIS 132  -8.782  19.908  26.738
 1006   1HB   HIS 132          1HB       HIS 132  -6.490  19.043  26.452
 1007   2HB   HIS 132          2HB       HIS 132  -6.651  19.195  24.707
 1008    HD1  HIS 132           HD1      HIS 132  -6.408  21.321  27.830
 1009    HD2  HIS 132           HD2      HIS 132  -6.099  21.690  23.694
 1010    HE1  HIS 132           HE1      HIS 132  -5.511  23.635  27.414
 1011    HE2  HIS 132           HE2      HIS 132  -5.179  23.773  24.918
  Start of MODEL    4
    1   1H    MET   1          1HT       MET   1  -1.602  37.032 -18.345
    2   2H    MET   1          2HT       MET   1  -0.916  36.508 -16.887
    3   3H    MET   1          3HT       MET   1  -2.496  36.046 -17.293
    4    HA   MET   1           HA       MET   1  -1.629  34.829 -19.215
    5   1HB   MET   1          1HB       MET   1   0.438  36.104 -19.502
    6   2HB   MET   1          2HB       MET   1   1.021  35.549 -17.942
    7   1HG   MET   1          1HG       MET   1   2.098  34.352 -19.745
    8   2HG   MET   1          2HG       MET   1   1.107  33.263 -18.776
    9   1HE   MET   1          1HE       MET   1   2.301  32.708 -21.754
   10   2HE   MET   1          2HE       MET   1   0.935  31.844 -22.461
   11   3HE   MET   1          3HE       MET   1   1.428  31.508 -20.802
   12    HA   PRO   2           HA       PRO   2  -2.139  32.121 -15.635
   13   1HB   PRO   2          1HB       PRO   2  -3.925  30.446 -16.750
   14   2HB   PRO   2          2HB       PRO   2  -4.378  32.042 -16.140
   15   1HG   PRO   2          1HG       PRO   2  -3.937  31.138 -18.946
   16   2HG   PRO   2          2HG       PRO   2  -5.121  32.290 -18.307
   17   1HD   PRO   2          1HD       PRO   2  -2.744  32.975 -19.564
   18   2HD   PRO   2          2HD       PRO   2  -3.679  34.038 -18.497
   19    H    LEU   3           H        LEU   3   0.064  31.377 -15.899
   20    HA   LEU   3           HA       LEU   3   0.333  28.942 -17.483
   21   1HB   LEU   3          1HB       LEU   3   2.692  28.957 -16.870
   22   2HB   LEU   3          2HB       LEU   3   2.218  30.478 -17.589
   23    HG   LEU   3           HG       LEU   3   2.445  30.132 -14.605
   24   1HD1  LEU   3          1HD1      LEU   3   4.577  31.014 -16.547
   25   2HD1  LEU   3          2HD1      LEU   3   4.688  31.096 -14.788
   26   3HD1  LEU   3          3HD1      LEU   3   4.586  29.531 -15.593
   27   1HD2  LEU   3          1HD2      LEU   3   2.565  32.553 -16.403
   28   2HD2  LEU   3          2HD2      LEU   3   1.204  32.088 -15.382
   29   3HD2  LEU   3          3HD2      LEU   3   2.737  32.560 -14.648
   30    H    ASN   4           H        ASN   4  -0.683  27.313 -16.549
   31    HA   ASN   4           HA       ASN   4  -0.674  27.094 -13.625
   32   1HB   ASN   4          1HB       ASN   4  -2.557  25.467 -14.028
   33   2HB   ASN   4          2HB       ASN   4  -2.880  27.118 -14.549
   34   1HD2  ASN   4          2HD2      ASN   4  -2.345  23.845 -15.557
   35   2HD2  ASN   4          1HD2      ASN   4  -2.766  24.076 -17.220
   36    H    GLN   5           H        GLN   5   1.619  26.336 -15.186
   37    HA   GLN   5           HA       GLN   5   3.214  24.731 -15.191
   38   1HB   GLN   5          1HB       GLN   5   1.315  23.152 -13.445
   39   2HB   GLN   5          2HB       GLN   5   2.980  22.716 -13.784
   40   1HG   GLN   5          1HG       GLN   5   3.736  24.762 -12.676
   41   2HG   GLN   5          2HG       GLN   5   2.059  25.172 -12.311
   42   1HE2  GLN   5          2HE2      GLN   5   3.315  21.916 -12.256
   43   2HE2  GLN   5          1HE2      GLN   5   3.188  21.679 -10.547
   44    H    GLU   6           H        GLU   6   2.916  24.491 -17.397
   45    HA   GLU   6           HA       GLU   6   1.062  22.534 -18.410
   46   1HB   GLU   6          1HB       GLU   6   3.296  23.882 -19.931
   47   2HB   GLU   6          2HB       GLU   6   1.857  23.124 -20.596
   48   1HG   GLU   6          1HG       GLU   6   1.315  25.340 -20.760
   49   2HG   GLU   6          2HG       GLU   6   0.601  24.931 -19.201
   50    H    HIS   7           H        HIS   7   3.887  22.202 -16.823
   51    HA   HIS   7           HA       HIS   7   4.627  19.783 -18.340
   52   1HB   HIS   7          1HB       HIS   7   6.332  21.346 -16.385
   53   2HB   HIS   7          2HB       HIS   7   6.842  19.938 -17.308
   54    HD1  HIS   7           HD1      HIS   7   7.484  23.318 -17.326
   55    HD2  HIS   7           HD2      HIS   7   6.169  20.721 -20.301
   56    HE1  HIS   7           HE1      HIS   7   8.033  24.446 -19.508
   57    HE2  HIS   7           HE2      HIS   7   7.392  22.778 -21.286
   58    HA   PRO   8           HA       PRO   8   2.887  18.216 -14.446
   59   1HB   PRO   8          1HB       PRO   8   1.348  16.283 -15.640
   60   2HB   PRO   8          2HB       PRO   8   0.838  17.953 -15.399
   61   1HG   PRO   8          1HG       PRO   8   1.432  16.592 -17.873
   62   2HG   PRO   8          2HG       PRO   8   0.795  18.226 -17.637
   63   1HD   PRO   8          1HD       PRO   8   3.541  17.357 -18.208
   64   2HD   PRO   8          2HD       PRO   8   2.807  18.964 -18.384
   65    H    ASP   9           H        ASP   9   5.321  17.178 -16.175
   66    HA   ASP   9           HA       ASP   9   5.282  14.351 -15.900
   67   1HB   ASP   9          1HB       ASP   9   7.556  14.391 -16.638
   68   2HB   ASP   9          2HB       ASP   9   6.706  15.648 -17.530
   69    H    TYR  10           H        TYR  10   6.531  16.984 -13.916
   70    HA   TYR  10           HA       TYR  10   7.335  15.032 -11.884
   71   1HB   TYR  10          1HB       TYR  10   8.842  17.009 -12.614
   72   2HB   TYR  10          2HB       TYR  10   7.744  18.013 -11.676
   73    HD1  TYR  10           HD1      TYR  10  10.741  16.250 -11.563
   74    HD2  TYR  10           HD2      TYR  10   7.296  17.051  -9.200
   75    HE1  TYR  10           HE1      TYR  10  12.012  15.692  -9.533
   76    HE2  TYR  10           HE2      TYR  10   8.556  16.499  -7.164
   77    HH   TYR  10           HH       TYR  10  10.682  14.919  -6.709
   78    H    THR  11           H        THR  11   5.402  14.399 -11.047
   79    HA   THR  11           HA       THR  11   3.868  16.465  -9.620
   80    HB   THR  11           HB       THR  11   2.708  14.164 -11.215
   81    HG1  THR  11           HG1      THR  11   2.855  15.680 -12.702
   82   1HG2  THR  11          1HG2      THR  11   0.519  15.038 -10.560
   83   2HG2  THR  11          2HG2      THR  11   1.445  14.530  -9.148
   84   3HG2  THR  11          3HG2      THR  11   1.299  16.244  -9.537
   85    H    TYR  12           H        TYR  12   4.466  12.971  -9.964
   86    HA   TYR  12           HA       TYR  12   3.608  12.512  -7.226
   87   1HB   TYR  12          1HB       TYR  12   4.802  10.525  -9.173
   88   2HB   TYR  12          2HB       TYR  12   3.894  10.164  -7.707
   89    HD1  TYR  12           HD1      TYR  12   1.439  10.843  -7.622
   90    HD2  TYR  12           HD2      TYR  12   3.704  10.807 -11.226
   91    HE1  TYR  12           HE1      TYR  12  -0.645  10.822  -8.928
   92    HE2  TYR  12           HE2      TYR  12   1.626  10.785 -12.538
   93    HH   TYR  12           HH       TYR  12  -0.788  10.036 -12.152
   94    H    ALA  13           H        ALA  13   5.225  13.887  -6.313
   95    HA   ALA  13           HA       ALA  13   7.996  13.439  -6.733
   96   1HB   ALA  13          1HB       ALA  13   8.339  15.067  -4.965
   97   2HB   ALA  13          2HB       ALA  13   7.098  15.618  -6.092
   98   3HB   ALA  13          3HB       ALA  13   6.635  14.963  -4.521
   99    H    LEU  14           H        LEU  14   5.960  12.854  -3.846
  100    HA   LEU  14           HA       LEU  14   6.349  11.666  -1.936
  101   1HB   LEU  14          1HB       LEU  14   6.134   9.834  -3.649
  102   2HB   LEU  14          2HB       LEU  14   7.882   9.819  -3.776
  103    HG   LEU  14           HG       LEU  14   8.043   9.157  -1.404
  104   1HD1  LEU  14          1HD1      LEU  14   6.039   8.457  -0.199
  105   2HD1  LEU  14          2HD1      LEU  14   5.979  10.175  -0.597
  106   3HD1  LEU  14          3HD1      LEU  14   5.034   9.018  -1.535
  107   1HD2  LEU  14          1HD2      LEU  14   6.268   7.392  -3.086
  108   2HD2  LEU  14          2HD2      LEU  14   8.029   7.447  -3.134
  109   3HD2  LEU  14          3HD2      LEU  14   7.205   6.872  -1.685
  110    H    ARG  15           H        ARG  15   7.917  13.779  -2.122
  111    HA   ARG  15           HA       ARG  15  10.686  13.367  -2.405
  112   1HB   ARG  15          1HB       ARG  15   9.729  15.522  -2.837
  113   2HB   ARG  15          2HB       ARG  15   9.085  15.625  -1.208
  114   1HG   ARG  15          1HG       ARG  15  11.080  17.045  -1.646
  115   2HG   ARG  15          2HG       ARG  15  11.245  15.943  -0.282
  116   1HD   ARG  15          1HD       ARG  15  13.269  16.054  -1.690
  117   2HD   ARG  15          2HD       ARG  15  12.583  14.435  -1.597
  118    HE   ARG  15           HE       ARG  15  11.850  16.071  -3.896
  119   1HH1  ARG  15          1HH1      ARG  15  13.776  13.488  -2.548
  120   2HH1  ARG  15          2HH1      ARG  15  14.163  12.785  -4.091
  121   1HH2  ARG  15          1HH2      ARG  15  12.396  15.178  -5.956
  122   2HH2  ARG  15          2HH2      ARG  15  13.430  13.779  -6.022
  123    H    ALA  16           H        ALA  16   8.587  13.244   0.405
  124    HA   ALA  16           HA       ALA  16  10.871  12.284   1.943
  125   1HB   ALA  16          1HB       ALA  16  10.753  14.672   2.440
  126   2HB   ALA  16          2HB       ALA  16   9.073  14.485   2.944
  127   3HB   ALA  16          3HB       ALA  16  10.360  13.697   3.856
  128    H    ALA  17           H        ALA  17  10.369  10.468   2.878
  129    HA   ALA  17           HA       ALA  17   7.594   9.994   3.728
  130   1HB   ALA  17          1HB       ALA  17   8.412   8.366   2.091
  131   2HB   ALA  17          2HB       ALA  17   9.778   7.990   3.141
  132   3HB   ALA  17          3HB       ALA  17   8.137   7.603   3.657
  133    H    ASP  18           H        ASP  18   7.390  10.489   5.809
  134    HA   ASP  18           HA       ASP  18   9.730  10.337   7.558
  135   1HB   ASP  18          1HB       ASP  18   7.016  11.584   8.056
  136   2HB   ASP  18          2HB       ASP  18   8.420  11.718   9.106
  137    H    GLY  19           H        GLY  19   6.338   9.364   7.484
  138   1HA   GLY  19          1HA       GLY  19   5.815   7.123   8.432
  139   2HA   GLY  19          2HA       GLY  19   6.879   7.567   9.765
  140    H    ARG  20           H        ARG  20   6.158  10.147  10.267
  141    HA   ARG  20           HA       ARG  20   3.515   9.887  11.389
  142   1HB   ARG  20          1HB       ARG  20   5.331  11.091  12.592
  143   2HB   ARG  20          2HB       ARG  20   5.317  12.320  11.331
  144   1HG   ARG  20          1HG       ARG  20   3.120  13.003  11.901
  145   2HG   ARG  20          2HG       ARG  20   2.901  11.621  12.971
  146   1HD   ARG  20          1HD       ARG  20   4.808  12.556  14.347
  147   2HD   ARG  20          2HD       ARG  20   4.661  14.023  13.374
  148    HE   ARG  20           HE       ARG  20   2.153  13.189  14.452
  149   1HH1  ARG  20          1HH1      ARG  20   5.099  14.950  15.216
  150   2HH1  ARG  20          2HH1      ARG  20   4.360  15.845  16.512
  151   1HH2  ARG  20          1HH2      ARG  20   1.202  14.386  16.140
  152   2HH2  ARG  20          2HH2      ARG  20   2.161  15.532  17.029
  153    H    HIS  21           H        HIS  21   5.040  11.490   8.690
  154    HA   HIS  21           HA       HIS  21   2.478  11.711   7.400
  155   1HB   HIS  21          1HB       HIS  21   2.858  14.112   6.731
  156   2HB   HIS  21          2HB       HIS  21   2.407  13.864   8.409
  157    HD1  HIS  21           HD1      HIS  21   5.810  14.050   6.618
  158    HD2  HIS  21           HD2      HIS  21   3.790  15.563   9.927
  159    HE1  HIS  21           HE1      HIS  21   7.417  15.621   7.739
  160    HE2  HIS  21           HE2      HIS  21   6.140  16.615   9.670
  161    H    ALA  22           H        ALA  22   2.851  12.686   5.106
  162    HA   ALA  22           HA       ALA  22   5.502  11.940   4.094
  163   1HB   ALA  22          1HB       ALA  22   4.032  10.004   3.766
  164   2HB   ALA  22          2HB       ALA  22   2.893  11.019   2.882
  165   3HB   ALA  22          3HB       ALA  22   4.504  10.724   2.228
  166    H    LYS  23           H        LYS  23   6.199  13.147   2.354
  167    HA   LYS  23           HA       LYS  23   4.571  15.520   1.796
  168   1HB   LYS  23          1HB       LYS  23   7.497  14.977   1.283
  169   2HB   LYS  23          2HB       LYS  23   6.668  16.471   0.875
  170   1HG   LYS  23          1HG       LYS  23   6.174  16.811   3.272
  171   2HG   LYS  23          2HG       LYS  23   7.107  15.355   3.637
  172   1HD   LYS  23          1HD       LYS  23   9.080  16.375   2.594
  173   2HD   LYS  23          2HD       LYS  23   8.148  17.838   2.275
  174   1HE   LYS  23          1HE       LYS  23   7.794  18.106   4.699
  175   2HE   LYS  23          2HE       LYS  23   8.792  16.680   4.984
  176   1HZ   LYS  23          1HZ       LYS  23  10.684  17.790   4.091
  177   2HZ   LYS  23          2HZ       LYS  23   9.747  19.104   3.567
  178   3HZ   LYS  23          3HZ       LYS  23   9.974  18.835   5.224
  179    H    VAL  24           H        VAL  24   3.177  14.944   0.174
  180    HA   VAL  24           HA       VAL  24   4.264  13.785  -2.268
  181    HB   VAL  24           HB       VAL  24   1.462  14.815  -1.777
  182   1HG1  VAL  24          1HG1      VAL  24   2.034  14.614  -4.129
  183   2HG1  VAL  24          2HG1      VAL  24   2.563  12.950  -3.876
  184   3HG1  VAL  24          3HG1      VAL  24   0.864  13.377  -3.671
  185   1HG2  VAL  24          1HG2      VAL  24   2.521  12.005  -1.482
  186   2HG2  VAL  24          2HG2      VAL  24   1.987  13.058  -0.173
  187   3HG2  VAL  24          3HG2      VAL  24   0.827  12.484  -1.373
  188    H    ASN  25           H        ASN  25   5.710  15.390  -2.864
  189    HA   ASN  25           HA       ASN  25   6.487  17.258  -3.871
  190   1HB   ASN  25          1HB       ASN  25   4.685  16.962  -5.510
  191   2HB   ASN  25          2HB       ASN  25   3.574  17.834  -4.461
  192   1HD2  ASN  25          2HD2      ASN  25   3.174  19.326  -6.088
  193   2HD2  ASN  25          1HD2      ASN  25   4.316  20.557  -6.514
  194    H    GLU  26           H        GLU  26   3.453  18.708  -2.761
  195    HA   GLU  26           HA       GLU  26   4.914  19.913  -0.508
  196   1HB   GLU  26          1HB       GLU  26   4.515  21.569  -2.341
  197   2HB   GLU  26          2HB       GLU  26   2.788  21.299  -2.155
  198   1HG   GLU  26          1HG       GLU  26   3.163  21.969   0.299
  199   2HG   GLU  26          2HG       GLU  26   4.698  22.622  -0.272
  200    H    GLN  27           H        GLN  27   2.455  17.927  -1.493
  201    HA   GLN  27           HA       GLN  27   0.435  18.801   0.380
  202   1HB   GLN  27          1HB       GLN  27   0.517  16.349  -1.387
  203   2HB   GLN  27          2HB       GLN  27  -0.882  16.928  -0.493
  204   1HG   GLN  27          1HG       GLN  27  -0.849  18.997  -1.825
  205   2HG   GLN  27          2HG       GLN  27   0.507  18.355  -2.750
  206   1HE2  GLN  27          2HE2      GLN  27   0.153  16.686  -4.211
  207   2HE2  GLN  27          1HE2      GLN  27  -1.432  16.252  -4.752
  208    H    ILE  28           H        ILE  28   0.931  18.458   2.442
  209    HA   ILE  28           HA       ILE  28   2.167  15.975   3.298
  210    HB   ILE  28           HB       ILE  28   1.187  18.326   4.934
  211   1HG1  ILE  28          1HG1      ILE  28   3.994  17.553   4.101
  212   2HG1  ILE  28          2HG1      ILE  28   3.058  18.870   3.403
  213   1HG2  ILE  28          1HG2      ILE  28   2.528  17.354   6.747
  214   2HG2  ILE  28          2HG2      ILE  28   1.225  16.278   6.243
  215   3HG2  ILE  28          3HG2      ILE  28   2.882  15.959   5.728
  216   1HD1  ILE  28          1HD1      ILE  28   4.686  19.692   5.001
  217   2HD1  ILE  28          2HD1      ILE  28   3.043  20.001   5.565
  218   3HD1  ILE  28          3HD1      ILE  28   3.981  18.679   6.260
  219    H    LEU  29           H        LEU  29   0.804  14.289   3.208
  220    HA   LEU  29           HA       LEU  29  -1.988  14.626   3.950
  221   1HB   LEU  29          1HB       LEU  29  -0.498  12.204   2.930
  222   2HB   LEU  29          2HB       LEU  29  -2.230  12.283   3.197
  223    HG   LEU  29           HG       LEU  29  -0.663  13.882   1.169
  224   1HD1  LEU  29          1HD1      LEU  29  -1.947  12.601  -0.467
  225   2HD1  LEU  29          2HD1      LEU  29  -0.958  11.549   0.546
  226   3HD1  LEU  29          3HD1      LEU  29  -2.692  11.680   0.839
  227   1HD2  LEU  29          1HD2      LEU  29  -3.620  13.875   1.758
  228   2HD2  LEU  29          2HD2      LEU  29  -2.500  15.198   2.084
  229   3HD2  LEU  29          3HD2      LEU  29  -2.834  14.714   0.421
  230    H    GLN  30           H        GLN  30  -3.030  13.204   5.499
  231    HA   GLN  30           HA       GLN  30  -1.235  12.208   7.601
  232   1HB   GLN  30          1HB       GLN  30  -3.451  14.225   7.984
  233   2HB   GLN  30          2HB       GLN  30  -2.718  13.330   9.308
  234   1HG   GLN  30          1HG       GLN  30  -1.137  15.066   7.433
  235   2HG   GLN  30          2HG       GLN  30  -1.861  15.664   8.922
  236   1HE2  GLN  30          2HE2      GLN  30  -0.572  12.433   8.713
  237   2HE2  GLN  30          1HE2      GLN  30   0.816  12.708   9.706
  238    H    GLN  31           H        GLN  31  -2.808  10.801   5.689
  239    HA   GLN  31           HA       GLN  31  -4.314   9.155   7.544
  240   1HB   GLN  31          1HB       GLN  31  -5.857  10.900   6.373
  241   2HB   GLN  31          2HB       GLN  31  -5.624   9.914   4.937
  242   1HG   GLN  31          1HG       GLN  31  -6.527   7.975   6.142
  243   2HG   GLN  31          2HG       GLN  31  -6.800   8.996   7.553
  244   1HE2  GLN  31          2HE2      GLN  31  -8.455  10.521   7.515
  245   2HE2  GLN  31          1HE2      GLN  31  -9.704  10.478   6.318
  246    H    SER  32           H        SER  32  -5.373   7.392   5.619
  247    HA   SER  32           HA       SER  32  -2.921   6.278   4.502
  248   1HB   SER  32          1HB       SER  32  -4.474   4.844   5.872
  249   2HB   SER  32          2HB       SER  32  -5.677   5.026   4.597
  250    HG   SER  32           HG       SER  32  -3.121   3.818   4.391
  251    H    PHE  33           H        PHE  33  -2.556   6.075   2.351
  252    HA   PHE  33           HA       PHE  33  -4.707   6.592   0.467
  253   1HB   PHE  33          1HB       PHE  33  -3.282   8.220  -0.807
  254   2HB   PHE  33          2HB       PHE  33  -3.877   8.821   0.734
  255    HD1  PHE  33           HD1      PHE  33  -2.331   9.037   2.653
  256    HD2  PHE  33           HD2      PHE  33  -0.958   7.981  -1.234
  257    HE1  PHE  33           HE1      PHE  33  -0.040   9.654   3.299
  258    HE2  PHE  33           HE2      PHE  33   1.336   8.595  -0.593
  259    HZ   PHE  33           HZ       PHE  33   1.798   9.432   1.676
  260    H    ILE  34           H        ILE  34  -4.320   5.768  -1.604
  261    HA   ILE  34           HA       ILE  34  -2.195   3.742  -1.626
  262    HB   ILE  34           HB       ILE  34  -4.635   3.933  -3.400
  263   1HG1  ILE  34          1HG1      ILE  34  -4.148   2.108  -1.039
  264   2HG1  ILE  34          2HG1      ILE  34  -5.162   3.546  -0.989
  265   1HG2  ILE  34          1HG2      ILE  34  -4.095   1.616  -3.996
  266   2HG2  ILE  34          2HG2      ILE  34  -2.791   2.722  -4.429
  267   3HG2  ILE  34          3HG2      ILE  34  -2.645   1.703  -2.997
  268   1HD1  ILE  34          1HD1      ILE  34  -5.624   1.118  -2.706
  269   2HD1  ILE  34          2HD1      ILE  34  -6.496   1.534  -1.230
  270   3HD1  ILE  34          3HD1      ILE  34  -6.642   2.557  -2.658
  271    H    LEU  35           H        LEU  35  -0.435   4.213  -2.751
  272    HA   LEU  35           HA       LEU  35  -0.665   6.124  -4.974
  273   1HB   LEU  35          1HB       LEU  35   0.878   6.772  -3.186
  274   2HB   LEU  35          2HB       LEU  35   1.756   5.267  -3.381
  275    HG   LEU  35           HG       LEU  35   2.454   5.955  -5.632
  276   1HD1  LEU  35          1HD1      LEU  35   2.048   8.239  -6.402
  277   2HD1  LEU  35          2HD1      LEU  35   0.541   7.343  -6.218
  278   3HD1  LEU  35          3HD1      LEU  35   1.014   8.529  -5.003
  279   1HD2  LEU  35          1HD2      LEU  35   3.023   8.003  -3.494
  280   2HD2  LEU  35          2HD2      LEU  35   3.882   6.482  -3.735
  281   3HD2  LEU  35          3HD2      LEU  35   3.975   7.752  -4.956
  282    H    MET  36           H        MET  36  -0.666   5.304  -6.936
  283    HA   MET  36           HA       MET  36   0.786   2.782  -7.413
  284   1HB   MET  36          1HB       MET  36  -1.800   3.777  -8.614
  285   2HB   MET  36          2HB       MET  36  -0.885   2.435  -9.286
  286   1HG   MET  36          1HG       MET  36  -1.133   1.223  -7.170
  287   2HG   MET  36          2HG       MET  36  -2.083   2.562  -6.528
  288   1HE   MET  36          1HE       MET  36  -3.955   0.724  -5.917
  289   2HE   MET  36          2HE       MET  36  -2.997  -0.550  -6.673
  290   3HE   MET  36          3HE       MET  36  -4.691  -0.342  -7.113
  291    HA   PRO  37           HA       PRO  37   3.025   4.888 -10.632
  292   1HB   PRO  37          1HB       PRO  37   2.766   2.558 -12.395
  293   2HB   PRO  37          2HB       PRO  37   4.208   3.218 -11.623
  294   1HG   PRO  37          1HG       PRO  37   3.131   0.874 -10.861
  295   2HG   PRO  37          2HG       PRO  37   3.916   1.970  -9.708
  296   1HD   PRO  37          1HD       PRO  37   0.993   1.569 -10.249
  297   2HD   PRO  37          2HD       PRO  37   1.837   1.738  -8.694
  298    H    ASP  38           H        ASP  38   0.415   5.680 -10.683
  299    HA   ASP  38           HA       ASP  38   0.039   6.295 -13.458
  300   1HB   ASP  38          1HB       ASP  38  -1.122   4.115 -13.326
  301   2HB   ASP  38          2HB       ASP  38  -2.144   4.753 -12.039
  302    H    GLU  39           H        GLU  39  -1.515   6.278 -10.263
  303    HA   GLU  39           HA       GLU  39  -1.722   9.145 -10.267
  304   1HB   GLU  39          1HB       GLU  39  -3.860   7.712 -11.368
  305   2HB   GLU  39          2HB       GLU  39  -4.378   8.081  -9.730
  306   1HG   GLU  39          1HG       GLU  39  -3.315  10.169 -11.611
  307   2HG   GLU  39          2HG       GLU  39  -5.020   9.736 -11.525
  308    H    LEU  40           H        LEU  40  -2.840   9.883  -8.219
  309    HA   LEU  40           HA       LEU  40  -2.075   8.107  -6.010
  310   1HB   LEU  40          1HB       LEU  40  -1.128  10.359  -5.996
  311   2HB   LEU  40          2HB       LEU  40  -2.734  11.057  -6.078
  312    HG   LEU  40           HG       LEU  40  -3.231  10.104  -3.843
  313   1HD1  LEU  40          1HD1      LEU  40  -1.376   9.263  -2.483
  314   2HD1  LEU  40          2HD1      LEU  40  -1.697   8.225  -3.873
  315   3HD1  LEU  40          3HD1      LEU  40  -0.321   9.326  -3.894
  316   1HD2  LEU  40          1HD2      LEU  40  -1.843  11.672  -2.585
  317   2HD2  LEU  40          2HD2      LEU  40  -0.777  11.850  -3.978
  318   3HD2  LEU  40          3HD2      LEU  40  -2.449  12.401  -4.072
  319    H    VAL  41           H        VAL  41  -3.681   6.856  -5.278
  320    HA   VAL  41           HA       VAL  41  -6.440   7.682  -5.684
  321    HB   VAL  41           HB       VAL  41  -5.389   5.089  -4.550
  322   1HG1  VAL  41          1HG1      VAL  41  -8.119   5.825  -5.592
  323   2HG1  VAL  41          2HG1      VAL  41  -7.619   4.217  -5.067
  324   3HG1  VAL  41          3HG1      VAL  41  -7.691   5.542  -3.905
  325   1HG2  VAL  41          1HG2      VAL  41  -4.612   5.412  -6.835
  326   2HG2  VAL  41          2HG2      VAL  41  -5.832   4.142  -6.764
  327   3HG2  VAL  41          3HG2      VAL  41  -6.263   5.745  -7.361
  328    H    GLU  42           H        GLU  42  -7.048   9.133  -4.206
  329    HA   GLU  42           HA       GLU  42  -6.624   8.549  -1.364
  330   1HB   GLU  42          1HB       GLU  42  -7.652  11.032  -2.758
  331   2HB   GLU  42          2HB       GLU  42  -7.530  10.853  -1.014
  332   1HG   GLU  42          1HG       GLU  42  -5.105  10.570  -1.221
  333   2HG   GLU  42          2HG       GLU  42  -5.238  10.789  -2.966
  334    H    HIS  43           H        HIS  43  -8.902   9.955  -0.420
  335    HA   HIS  43           HA       HIS  43 -11.079   9.642   0.149
  336   1HB   HIS  43          1HB       HIS  43 -11.381   8.492  -2.637
  337   2HB   HIS  43          2HB       HIS  43 -12.699   8.973  -1.578
  338    HD1  HIS  43           HD1      HIS  43 -11.510  10.108  -4.501
  339    HD2  HIS  43           HD2      HIS  43 -11.761  11.965  -0.784
  340    HE1  HIS  43           HE1      HIS  43 -11.484  12.581  -4.971
  341    HE2  HIS  43           HE2      HIS  43 -11.483  13.683  -2.702
  342    H    TRP  44           H        TRP  44  -9.327   7.775   1.030
  343    HA   TRP  44           HA       TRP  44 -10.944   5.313   0.974
  344   1HB   TRP  44          1HB       TRP  44  -8.702   5.228  -0.297
  345   2HB   TRP  44          2HB       TRP  44  -7.943   5.310   1.287
  346    HD1  TRP  44           HD1      TRP  44 -10.860   3.121  -0.079
  347    HE1  TRP  44           HE1      TRP  44 -10.343   0.665   0.507
  348    HE3  TRP  44           HE3      TRP  44  -6.346   3.776   2.230
  349    HZ2  TRP  44           HZ2      TRP  44  -8.287  -0.794   1.783
  350    HZ3  TRP  44           HZ3      TRP  44  -5.169   1.799   3.102
  351    HH2  TRP  44           HH2      TRP  44  -6.120  -0.437   2.882
  352    HA   PRO  45           HA       PRO  45 -10.800   6.937   5.220
  353   1HB   PRO  45          1HB       PRO  45 -13.244   5.375   5.590
  354   2HB   PRO  45          2HB       PRO  45 -12.999   7.119   5.723
  355   1HG   PRO  45          1HG       PRO  45 -14.405   6.000   3.703
  356   2HG   PRO  45          2HG       PRO  45 -13.460   7.486   3.499
  357   1HD   PRO  45          1HD       PRO  45 -12.770   4.677   2.716
  358   2HD   PRO  45          2HD       PRO  45 -12.510   6.192   1.823
  359    H    VAL  46           H        VAL  46  -8.953   5.525   5.545
  360    HA   VAL  46           HA       VAL  46  -9.705   3.273   7.268
  361    HB   VAL  46           HB       VAL  46  -7.477   3.240   5.221
  362   1HG1  VAL  46          1HG1      VAL  46  -8.151   1.203   7.344
  363   2HG1  VAL  46          2HG1      VAL  46  -6.957   0.997   6.062
  364   3HG1  VAL  46          3HG1      VAL  46  -6.715   2.225   7.304
  365   1HG2  VAL  46          1HG2      VAL  46  -9.924   1.508   5.543
  366   2HG2  VAL  46          2HG2      VAL  46  -9.678   2.739   4.304
  367   3HG2  VAL  46          3HG2      VAL  46  -8.666   1.295   4.327
  368    HA   PRO  47           HA       PRO  47  -6.970   5.866   9.867
  369   1HB   PRO  47          1HB       PRO  47  -8.337   4.249  11.927
  370   2HB   PRO  47          2HB       PRO  47  -8.146   6.001  11.823
  371   1HG   PRO  47          1HG       PRO  47 -10.510   4.822  11.379
  372   2HG   PRO  47          2HG       PRO  47 -10.002   6.259  10.472
  373   1HD   PRO  47          1HD       PRO  47 -10.009   3.388   9.630
  374   2HD   PRO  47          2HD       PRO  47 -10.433   4.838   8.697
  375    H    SER  48           H        SER  48  -5.315   5.140  11.392
  376    HA   SER  48           HA       SER  48  -3.798   3.039  10.443
  377   1HB   SER  48          1HB       SER  48  -3.636   4.032  13.283
  378   2HB   SER  48          2HB       SER  48  -2.322   3.516  12.222
  379    HG   SER  48           HG       SER  48  -2.163   5.594  11.830
  380    H    LEU  49           H        LEU  49  -4.553   1.016  10.345
  381    HA   LEU  49           HA       LEU  49  -5.315  -1.026  10.886
  382   1HB   LEU  49          1HB       LEU  49  -4.389  -0.248  13.648
  383   2HB   LEU  49          2HB       LEU  49  -4.806  -1.865  13.131
  384    HG   LEU  49           HG       LEU  49  -2.492  -0.216  12.131
  385   1HD1  LEU  49          1HD1      LEU  49  -2.176  -1.157  14.360
  386   2HD1  LEU  49          2HD1      LEU  49  -2.592  -2.757  13.748
  387   3HD1  LEU  49          3HD1      LEU  49  -1.134  -1.948  13.177
  388   1HD2  LEU  49          1HD2      LEU  49  -3.359  -2.996  11.337
  389   2HD2  LEU  49          2HD2      LEU  49  -3.445  -1.555  10.323
  390   3HD2  LEU  49          3HD2      LEU  49  -1.877  -2.188  10.826
  391    H    GLY  50           H        GLY  50  -7.056   1.421  11.251
  392   1HA   GLY  50          1HA       GLY  50  -8.932   0.522  13.298
  393   2HA   GLY  50          2HA       GLY  50  -9.023   2.024  12.387
  394    H    GLN  51           H        GLN  51  -9.709   1.901  10.156
  395    HA   GLN  51           HA       GLN  51 -11.772  -0.125   9.834
  396   1HB   GLN  51          1HB       GLN  51 -11.192   2.419   8.311
  397   2HB   GLN  51          2HB       GLN  51 -12.495   1.311   7.907
  398   1HG   GLN  51          1HG       GLN  51 -13.492   1.679  10.109
  399   2HG   GLN  51          2HG       GLN  51 -12.190   2.801  10.506
  400   1HE2  GLN  51          2HE2      GLN  51 -15.073   2.296   8.645
  401   2HE2  GLN  51          1HE2      GLN  51 -15.298   3.945   8.161
  402    H    LEU  52           H        LEU  52  -8.826  -0.572   9.445
  403    HA   LEU  52           HA       LEU  52  -8.518  -1.189   6.659
  404   1HB   LEU  52          1HB       LEU  52  -6.595  -0.694   8.156
  405   2HB   LEU  52          2HB       LEU  52  -6.926  -2.173   9.033
  406    HG   LEU  52           HG       LEU  52  -6.421  -3.491   7.028
  407   1HD1  LEU  52          1HD1      LEU  52  -5.450  -2.420   5.058
  408   2HD1  LEU  52          2HD1      LEU  52  -7.108  -1.886   5.332
  409   3HD1  LEU  52          3HD1      LEU  52  -5.760  -0.834   5.765
  410   1HD2  LEU  52          1HD2      LEU  52  -4.017  -3.059   6.954
  411   2HD2  LEU  52          2HD2      LEU  52  -4.272  -1.500   7.737
  412   3HD2  LEU  52          3HD2      LEU  52  -4.634  -2.993   8.605
  413    H    GLN  53           H        GLN  53 -10.357  -2.386   6.236
  414    HA   GLN  53           HA       GLN  53 -10.554  -5.037   7.504
  415   1HB   GLN  53          1HB       GLN  53 -12.823  -3.208   6.674
  416   2HB   GLN  53          2HB       GLN  53 -12.997  -4.802   7.396
  417   1HG   GLN  53          1HG       GLN  53 -12.235  -4.074   9.478
  418   2HG   GLN  53          2HG       GLN  53 -11.536  -2.602   8.804
  419   1HE2  GLN  53          2HE2      GLN  53 -13.413  -2.928  10.998
  420   2HE2  GLN  53          1HE2      GLN  53 -14.818  -2.003  10.572
  421    HA   PRO  54           HA       PRO  54 -10.678  -6.925   3.503
  422   1HB   PRO  54          1HB       PRO  54 -13.266  -8.182   4.264
  423   2HB   PRO  54          2HB       PRO  54 -11.773  -8.935   3.690
  424   1HG   PRO  54          1HG       PRO  54 -12.465  -9.087   6.254
  425   2HG   PRO  54          2HG       PRO  54 -10.772  -8.847   5.783
  426   1HD   PRO  54          1HD       PRO  54 -12.746  -6.867   6.846
  427   2HD   PRO  54          2HD       PRO  54 -11.009  -7.020   7.182
  428    H    ALA  55           H        ALA  55 -13.597  -5.366   4.662
  429    HA   ALA  55           HA       ALA  55 -14.976  -5.196   2.209
  430   1HB   ALA  55          1HB       ALA  55 -15.116  -3.330   4.577
  431   2HB   ALA  55          2HB       ALA  55 -16.303  -3.455   3.279
  432   3HB   ALA  55          3HB       ALA  55 -16.052  -4.811   4.378
  433    H    HIS  56           H        HIS  56 -12.742  -2.939   3.815
  434    HA   HIS  56           HA       HIS  56 -12.863  -1.043   1.656
  435   1HB   HIS  56          1HB       HIS  56 -11.163  -1.254   4.132
  436   2HB   HIS  56          2HB       HIS  56 -10.835  -0.043   2.897
  437    HD1  HIS  56           HD1      HIS  56 -12.136   0.054   6.011
  438    HD2  HIS  56           HD2      HIS  56 -13.797   1.094   2.341
  439    HE1  HIS  56           HE1      HIS  56 -13.990   1.673   6.536
  440    HE2  HIS  56           HE2      HIS  56 -14.920   2.365   4.296
  441    H    MET  57           H        MET  57 -10.848  -3.719   2.580
  442    HA   MET  57           HA       MET  57  -8.703  -3.177   0.787
  443   1HB   MET  57          1HB       MET  57  -8.482  -4.649   2.763
  444   2HB   MET  57          2HB       MET  57  -9.576  -5.804   2.014
  445   1HG   MET  57          1HG       MET  57  -7.282  -6.523   1.774
  446   2HG   MET  57          2HG       MET  57  -7.976  -6.142   0.199
  447   1HE   MET  57          1HE       MET  57  -5.495  -6.112  -0.828
  448   2HE   MET  57          2HE       MET  57  -4.836  -6.468   0.770
  449   3HE   MET  57          3HE       MET  57  -4.189  -5.123  -0.169
  450    H    ASP  58           H        ASP  58 -11.828  -4.584   0.478
  451    HA   ASP  58           HA       ASP  58 -11.484  -6.254  -1.741
  452   1HB   ASP  58          1HB       ASP  58 -13.517  -6.040  -0.216
  453   2HB   ASP  58          2HB       ASP  58 -13.970  -4.637  -1.177
  454    H    ALA  59           H        ALA  59 -11.913  -2.787  -1.495
  455    HA   ALA  59           HA       ALA  59 -12.307  -2.218  -4.231
  456   1HB   ALA  59          1HB       ALA  59 -12.696  -0.585  -2.431
  457   2HB   ALA  59          2HB       ALA  59 -10.959  -0.510  -2.136
  458   3HB   ALA  59          3HB       ALA  59 -11.617   0.048  -3.674
  459    H    VAL  60           H        VAL  60  -9.400  -2.497  -2.242
  460    HA   VAL  60           HA       VAL  60  -7.541  -1.838  -4.282
  461    HB   VAL  60           HB       VAL  60  -7.030  -3.569  -1.854
  462   1HG1  VAL  60          1HG1      VAL  60  -4.742  -2.693  -2.031
  463   2HG1  VAL  60          2HG1      VAL  60  -5.223  -3.584  -3.474
  464   3HG1  VAL  60          3HG1      VAL  60  -5.198  -1.821  -3.494
  465   1HG2  VAL  60          1HG2      VAL  60  -8.114  -1.510  -1.149
  466   2HG2  VAL  60          2HG2      VAL  60  -6.413  -1.505  -0.683
  467   3HG2  VAL  60          3HG2      VAL  60  -6.948  -0.562  -2.073
  468    H    LEU  61           H        LEU  61  -8.978  -4.826  -3.126
  469    HA   LEU  61           HA       LEU  61  -7.454  -6.659  -4.594
  470   1HB   LEU  61          1HB       LEU  61 -10.368  -6.848  -3.823
  471   2HB   LEU  61          2HB       LEU  61  -9.353  -8.191  -4.312
  472    HG   LEU  61           HG       LEU  61  -8.989  -6.528  -1.817
  473   1HD1  LEU  61          1HD1      LEU  61  -9.935  -9.369  -2.164
  474   2HD1  LEU  61          2HD1      LEU  61  -9.690  -8.529  -0.634
  475   3HD1  LEU  61          3HD1      LEU  61 -10.952  -7.992  -1.741
  476   1HD2  LEU  61          1HD2      LEU  61  -7.303  -8.180  -1.208
  477   2HD2  LEU  61          2HD2      LEU  61  -7.517  -8.986  -2.763
  478   3HD2  LEU  61          3HD2      LEU  61  -6.864  -7.349  -2.701
  479    H    ALA  62           H        ALA  62 -10.334  -4.806  -5.450
  480    HA   ALA  62           HA       ALA  62 -10.770  -6.048  -7.966
  481   1HB   ALA  62          1HB       ALA  62 -12.533  -4.832  -6.793
  482   2HB   ALA  62          2HB       ALA  62 -11.644  -3.324  -7.009
  483   3HB   ALA  62          3HB       ALA  62 -12.278  -4.182  -8.412
  484    H    LEU  63           H        LEU  63  -8.801  -3.359  -6.896
  485    HA   LEU  63           HA       LEU  63  -8.174  -2.341  -9.474
  486   1HB   LEU  63          1HB       LEU  63  -6.605  -2.161  -6.898
  487   2HB   LEU  63          2HB       LEU  63  -6.315  -1.196  -8.333
  488    HG   LEU  63           HG       LEU  63  -8.839  -1.127  -6.677
  489   1HD1  LEU  63          1HD1      LEU  63  -6.571   0.848  -6.869
  490   2HD1  LEU  63          2HD1      LEU  63  -8.075   1.084  -5.978
  491   3HD1  LEU  63          3HD1      LEU  63  -6.943  -0.175  -5.481
  492   1HD2  LEU  63          1HD2      LEU  63  -9.399   0.831  -8.037
  493   2HD2  LEU  63          2HD2      LEU  63  -7.951   0.567  -9.008
  494   3HD2  LEU  63          3HD2      LEU  63  -9.252  -0.623  -9.023
  495    H    ASN  64           H        ASN  64  -7.220  -5.107  -7.779
  496    HA   ASN  64           HA       ASN  64  -5.890  -6.861  -8.246
  497   1HB   ASN  64          1HB       ASN  64  -6.934  -6.714 -10.483
  498   2HB   ASN  64          2HB       ASN  64  -5.630  -5.650 -11.003
  499   1HD2  ASN  64          2HD2      ASN  64  -6.494  -8.896 -10.081
  500   2HD2  ASN  64          1HD2      ASN  64  -5.069  -9.664 -10.700
  501    HA   PRO  65           HA       PRO  65  -1.858  -4.863  -7.772
  502   1HB   PRO  65          1HB       PRO  65  -1.584  -5.253  -5.106
  503   2HB   PRO  65          2HB       PRO  65  -2.406  -3.847  -5.783
  504   1HG   PRO  65          1HG       PRO  65  -3.529  -6.130  -4.340
  505   2HG   PRO  65          2HG       PRO  65  -4.263  -4.559  -4.695
  506   1HD   PRO  65          1HD       PRO  65  -4.619  -7.096  -6.071
  507   2HD   PRO  65          2HD       PRO  65  -5.508  -5.576  -6.289
  508    H    ALA  66           H        ALA  66  -0.184  -6.157  -8.291
  509    HA   ALA  66           HA       ALA  66  -0.251  -8.981  -7.718
  510   1HB   ALA  66          1HB       ALA  66   1.906  -9.057  -8.876
  511   2HB   ALA  66          2HB       ALA  66   0.707  -8.171  -9.817
  512   3HB   ALA  66          3HB       ALA  66   1.947  -7.295  -8.921
  513    H    VAL  67           H        VAL  67   1.576  -6.165  -6.682
  514    HA   VAL  67           HA       VAL  67   2.209  -7.578  -4.195
  515    HB   VAL  67           HB       VAL  67   4.265  -7.574  -5.502
  516   1HG1  VAL  67          1HG1      VAL  67   3.938  -4.582  -5.646
  517   2HG1  VAL  67          2HG1      VAL  67   5.361  -5.484  -6.171
  518   3HG1  VAL  67          3HG1      VAL  67   3.816  -5.718  -6.990
  519   1HG2  VAL  67          1HG2      VAL  67   4.481  -7.298  -3.099
  520   2HG2  VAL  67          2HG2      VAL  67   5.747  -6.403  -3.938
  521   3HG2  VAL  67          3HG2      VAL  67   4.356  -5.547  -3.271
  522    H    ILE  68           H        ILE  68   1.933  -6.373  -2.367
  523    HA   ILE  68           HA       ILE  68   1.251  -3.541  -2.738
  524    HB   ILE  68           HB       ILE  68  -0.869  -4.598  -2.494
  525   1HG1  ILE  68          1HG1      ILE  68  -0.065  -3.473   0.199
  526   2HG1  ILE  68          2HG1      ILE  68  -0.535  -2.518  -1.203
  527   1HG2  ILE  68          1HG2      ILE  68   0.211  -5.989  -0.052
  528   2HG2  ILE  68          2HG2      ILE  68  -1.447  -6.076  -0.646
  529   3HG2  ILE  68          3HG2      ILE  68  -0.128  -6.739  -1.612
  530   1HD1  ILE  68          1HD1      ILE  68  -2.288  -4.466   0.277
  531   2HD1  ILE  68          2HD1      ILE  68  -2.355  -2.708   0.389
  532   3HD1  ILE  68          3HD1      ILE  68  -2.763  -3.510  -1.128
  533    H    LEU  69           H        LEU  69   2.364  -2.244  -1.516
  534    HA   LEU  69           HA       LEU  69   3.889  -3.364   0.727
  535   1HB   LEU  69          1HB       LEU  69   4.273  -0.840  -0.884
  536   2HB   LEU  69          2HB       LEU  69   5.252  -1.285   0.501
  537    HG   LEU  69           HG       LEU  69   5.037  -2.990  -1.979
  538   1HD1  LEU  69          1HD1      LEU  69   5.983  -0.823  -2.571
  539   2HD1  LEU  69          2HD1      LEU  69   7.139  -0.953  -1.244
  540   3HD1  LEU  69          3HD1      LEU  69   7.223  -2.076  -2.600
  541   1HD2  LEU  69          1HD2      LEU  69   7.001  -2.969   0.309
  542   2HD2  LEU  69          2HD2      LEU  69   5.728  -4.161   0.045
  543   3HD2  LEU  69          3HD2      LEU  69   7.062  -4.027  -1.100
  544    H    LEU  70           H        LEU  70   3.027  -3.053   2.644
  545    HA   LEU  70           HA       LEU  70   1.146  -0.850   3.030
  546   1HB   LEU  70          1HB       LEU  70   0.519  -3.177   3.666
  547   2HB   LEU  70          2HB       LEU  70   1.810  -3.168   4.852
  548    HG   LEU  70           HG       LEU  70   0.670  -1.288   6.016
  549   1HD1  LEU  70          1HD1      LEU  70  -1.658  -0.797   5.451
  550   2HD1  LEU  70          2HD1      LEU  70  -0.573  -0.390   4.123
  551   3HD1  LEU  70          3HD1      LEU  70  -1.545  -1.861   4.048
  552   1HD2  LEU  70          1HD2      LEU  70  -1.119  -2.659   6.974
  553   2HD2  LEU  70          2HD2      LEU  70  -0.967  -3.791   5.629
  554   3HD2  LEU  70          3HD2      LEU  70   0.367  -3.584   6.763
  555    H    GLY  71           H        GLY  71   2.308   0.968   3.409
  556   1HA   GLY  71          1HA       GLY  71   4.550   0.893   5.283
  557   2HA   GLY  71          2HA       GLY  71   4.041   2.275   4.319
  558    H    THR  72           H        THR  72   3.647   0.552   7.289
  559    HA   THR  72           HA       THR  72   1.257   1.980   8.069
  560    HB   THR  72           HB       THR  72   1.548   0.702  10.213
  561    HG1  THR  72           HG1      THR  72   3.754   0.326  10.224
  562   1HG2  THR  72          1HG2      THR  72   0.123  -0.171   8.459
  563   2HG2  THR  72          2HG2      THR  72   1.519  -0.860   7.627
  564   3HG2  THR  72          3HG2      THR  72   1.024  -1.495   9.196
  565    H    GLY  73           H        GLY  73   3.012   3.928   7.643
  566   1HA   GLY  73          1HA       GLY  73   3.943   5.777   8.618
  567   2HA   GLY  73          2HA       GLY  73   3.250   5.228  10.136
  568    H    GLU  74           H        GLU  74   4.790   5.263  11.605
  569    HA   GLU  74           HA       GLU  74   7.558   4.972  10.899
  570   1HB   GLU  74          1HB       GLU  74   6.417   6.498  12.701
  571   2HB   GLU  74          2HB       GLU  74   6.550   5.075  13.721
  572   1HG   GLU  74          1HG       GLU  74   8.903   6.281  12.301
  573   2HG   GLU  74          2HG       GLU  74   8.391   6.786  13.907
  574    H    ARG  75           H        ARG  75   5.429   3.246  13.199
  575    HA   ARG  75           HA       ARG  75   7.360   1.096  13.394
  576   1HB   ARG  75          1HB       ARG  75   4.662   1.479  14.700
  577   2HB   ARG  75          2HB       ARG  75   5.723   0.112  15.002
  578   1HG   ARG  75          1HG       ARG  75   6.293   3.004  15.621
  579   2HG   ARG  75          2HG       ARG  75   5.934   1.722  16.778
  580   1HD   ARG  75          1HD       ARG  75   8.057   0.691  15.373
  581   2HD   ARG  75          2HD       ARG  75   8.442   2.410  15.450
  582    HE   ARG  75           HE       ARG  75   8.139   0.576  17.725
  583   1HH1  ARG  75          1HH1      ARG  75   9.036   3.742  16.479
  584   2HH1  ARG  75          2HH1      ARG  75   9.759   4.248  17.978
  585   1HH2  ARG  75          1HH2      ARG  75   9.082   1.260  19.684
  586   2HH2  ARG  75          2HH2      ARG  75   9.778   2.856  19.793
  587    H    GLN  76           H        GLN  76   7.136  -0.948  12.641
  588    HA   GLN  76           HA       GLN  76   5.463  -1.384  10.378
  589   1HB   GLN  76          1HB       GLN  76   7.702  -2.391  10.635
  590   2HB   GLN  76          2HB       GLN  76   7.112  -3.340  11.991
  591   1HG   GLN  76          1HG       GLN  76   5.476  -4.399  10.426
  592   2HG   GLN  76          2HG       GLN  76   6.301  -3.570   9.106
  593   1HE2  GLN  76          2HE2      GLN  76   6.996  -5.442   8.124
  594   2HE2  GLN  76          1HE2      GLN  76   8.217  -6.467   8.811
  595    H    GLN  77           H        GLN  77   3.375  -1.806  10.478
  596    HA   GLN  77           HA       GLN  77   2.345  -3.417  12.724
  597   1HB   GLN  77          1HB       GLN  77   0.992  -1.132  11.270
  598   2HB   GLN  77          2HB       GLN  77   0.249  -2.117  12.525
  599   1HG   GLN  77          1HG       GLN  77   1.734  -1.283  14.180
  600   2HG   GLN  77          2HG       GLN  77   2.749  -0.507  12.966
  601   1HE2  GLN  77          2HE2      GLN  77   2.083   1.417  12.039
  602   2HE2  GLN  77          1HE2      GLN  77   0.807   2.369  12.709
  603    H    PHE  78           H        PHE  78   0.188  -4.485  12.123
  604    HA   PHE  78           HA       PHE  78   0.173  -5.308   9.319
  605   1HB   PHE  78          1HB       PHE  78   0.078  -7.713  10.023
  606   2HB   PHE  78          2HB       PHE  78   1.626  -6.934  10.320
  607    HD1  PHE  78           HD1      PHE  78   2.349  -6.424  12.590
  608    HD2  PHE  78           HD2      PHE  78  -1.312  -8.460  11.836
  609    HE1  PHE  78           HE1      PHE  78   2.259  -7.127  14.946
  610    HE2  PHE  78           HE2      PHE  78  -1.410  -9.164  14.189
  611    HZ   PHE  78           HZ       PHE  78   0.377  -8.499  15.747
  612    HA   PRO  79           HA       PRO  79  -4.204  -5.357   9.950
  613   1HB   PRO  79          1HB       PRO  79  -4.618  -7.099   7.706
  614   2HB   PRO  79          2HB       PRO  79  -4.788  -5.345   7.769
  615   1HG   PRO  79          1HG       PRO  79  -2.850  -6.676   6.331
  616   2HG   PRO  79          2HG       PRO  79  -2.719  -4.996   6.883
  617   1HD   PRO  79          1HD       PRO  79  -1.540  -7.481   8.062
  618   2HD   PRO  79          2HD       PRO  79  -0.837  -5.854   7.913
  619    H    SER  80           H        SER  80  -6.108  -6.953   9.869
  620    HA   SER  80           HA       SER  80  -5.468  -9.132  11.631
  621   1HB   SER  80          1HB       SER  80  -8.125  -8.294  10.454
  622   2HB   SER  80          2HB       SER  80  -7.891  -9.410  11.800
  623    HG   SER  80           HG       SER  80  -7.351  -6.626  11.698
  624    H    THR  81           H        THR  81  -6.710 -11.276  11.225
  625    HA   THR  81           HA       THR  81  -5.302 -12.502   9.132
  626    HB   THR  81           HB       THR  81  -6.811 -14.492   9.824
  627    HG1  THR  81           HG1      THR  81  -7.662 -14.070  12.002
  628   1HG2  THR  81          1HG2      THR  81  -4.982 -13.142  11.811
  629   2HG2  THR  81          2HG2      THR  81  -5.465 -14.837  11.853
  630   3HG2  THR  81          3HG2      THR  81  -4.483 -14.234  10.519
  631    H    ASP  82           H        ASP  82  -8.695 -11.532   9.424
  632    HA   ASP  82           HA       ASP  82  -9.635 -12.897   7.136
  633   1HB   ASP  82          1HB       ASP  82 -10.636 -10.451   8.583
  634   2HB   ASP  82          2HB       ASP  82 -11.449 -11.082   7.156
  635    H    VAL  83           H        VAL  83  -7.955  -9.879   7.542
  636    HA   VAL  83           HA       VAL  83  -8.389  -8.935   4.872
  637    HB   VAL  83           HB       VAL  83  -6.172  -8.145   6.772
  638   1HG1  VAL  83          1HG1      VAL  83  -6.168  -6.044   5.508
  639   2HG1  VAL  83          2HG1      VAL  83  -5.808  -7.426   4.473
  640   3HG1  VAL  83          3HG1      VAL  83  -7.411  -6.690   4.435
  641   1HG2  VAL  83          1HG2      VAL  83  -7.637  -6.294   7.464
  642   2HG2  VAL  83          2HG2      VAL  83  -8.941  -6.977   6.493
  643   3HG2  VAL  83          3HG2      VAL  83  -8.318  -7.868   7.882
  644    H    LEU  84           H        LEU  84  -5.893 -10.742   6.567
  645    HA   LEU  84           HA       LEU  84  -3.986 -10.879   4.507
  646   1HB   LEU  84          1HB       LEU  84  -4.566 -12.932   6.647
  647   2HB   LEU  84          2HB       LEU  84  -3.084 -12.797   5.722
  648    HG   LEU  84           HG       LEU  84  -4.099 -10.724   7.672
  649   1HD1  LEU  84          1HD1      LEU  84  -3.416 -12.765   8.805
  650   2HD1  LEU  84          2HD1      LEU  84  -1.882 -12.751   7.934
  651   3HD1  LEU  84          3HD1      LEU  84  -2.251 -11.472   9.091
  652   1HD2  LEU  84          1HD2      LEU  84  -1.885  -9.725   7.396
  653   2HD2  LEU  84          2HD2      LEU  84  -1.487 -10.936   6.179
  654   3HD2  LEU  84          3HD2      LEU  84  -2.766  -9.763   5.868
  655    H    ALA  85           H        ALA  85  -6.714 -12.960   5.341
  656    HA   ALA  85           HA       ALA  85  -6.263 -15.023   3.517
  657   1HB   ALA  85          1HB       ALA  85  -8.602 -15.598   3.820
  658   2HB   ALA  85          2HB       ALA  85  -7.870 -15.153   5.362
  659   3HB   ALA  85          3HB       ALA  85  -8.919 -14.010   4.521
  660    H    ALA  86           H        ALA  86  -7.860 -11.916   3.100
  661    HA   ALA  86           HA       ALA  86  -8.981 -12.433   0.553
  662   1HB   ALA  86          1HB       ALA  86  -9.732 -10.600   2.003
  663   2HB   ALA  86          2HB       ALA  86  -8.189  -9.783   1.761
  664   3HB   ALA  86          3HB       ALA  86  -9.283 -10.024   0.399
  665    H    CYS  87           H        CYS  87  -5.830 -11.435   1.621
  666    HA   CYS  87           HA       CYS  87  -4.935 -10.688  -1.022
  667   1HB   CYS  87          1HB       CYS  87  -3.301 -11.111   1.489
  668   2HB   CYS  87          2HB       CYS  87  -2.805 -10.244   0.038
  669    HG   CYS  87           HG       CYS  87  -5.208  -9.255   2.270
  670    H    LEU  88           H        LEU  88  -4.575 -13.379   1.220
  671    HA   LEU  88           HA       LEU  88  -2.642 -14.841  -0.196
  672   1HB   LEU  88          1HB       LEU  88  -4.816 -15.786   1.673
  673   2HB   LEU  88          2HB       LEU  88  -3.508 -16.798   1.092
  674    HG   LEU  88           HG       LEU  88  -3.144 -14.312   2.766
  675   1HD1  LEU  88          1HD1      LEU  88  -2.993 -17.225   3.533
  676   2HD1  LEU  88          2HD1      LEU  88  -2.596 -15.858   4.575
  677   3HD1  LEU  88          3HD1      LEU  88  -4.253 -16.089   4.016
  678   1HD2  LEU  88          1HD2      LEU  88  -1.242 -14.790   1.312
  679   2HD2  LEU  88          2HD2      LEU  88  -0.843 -15.099   3.002
  680   3HD2  LEU  88          3HD2      LEU  88  -1.188 -16.445   1.916
  681    H    THR  89           H        THR  89  -6.176 -14.903  -0.342
  682    HA   THR  89           HA       THR  89  -6.401 -17.189  -1.967
  683    HB   THR  89           HB       THR  89  -8.703 -16.149  -2.537
  684    HG1  THR  89           HG1      THR  89  -8.252 -14.549  -0.268
  685   1HG2  THR  89          1HG2      THR  89  -9.576 -16.765  -0.327
  686   2HG2  THR  89          2HG2      THR  89  -8.380 -17.930  -0.897
  687   3HG2  THR  89          3HG2      THR  89  -7.937 -16.738   0.326
  688    H    ARG  90           H        ARG  90  -5.878 -13.817  -2.759
  689    HA   ARG  90           HA       ARG  90  -6.223 -14.398  -5.602
  690   1HB   ARG  90          1HB       ARG  90  -5.676 -11.785  -4.186
  691   2HB   ARG  90          2HB       ARG  90  -5.877 -11.958  -5.923
  692   1HG   ARG  90          1HG       ARG  90  -8.162 -12.883  -5.477
  693   2HG   ARG  90          2HG       ARG  90  -7.939 -12.427  -3.786
  694   1HD   ARG  90          1HD       ARG  90  -7.570 -10.098  -4.487
  695   2HD   ARG  90          2HD       ARG  90  -7.858 -10.571  -6.160
  696    HE   ARG  90           HE       ARG  90  -9.934 -10.944  -4.098
  697   1HH1  ARG  90          1HH1      ARG  90  -8.870  -9.638  -7.176
  698   2HH1  ARG  90          2HH1      ARG  90 -10.431  -9.018  -7.606
  699   1HH2  ARG  90          1HH2      ARG  90 -11.991 -10.087  -4.641
  700   2HH2  ARG  90          2HH2      ARG  90 -12.203  -9.271  -6.167
  701    H    GLY  91           H        GLY  91  -3.787 -14.490  -3.330
  702   1HA   GLY  91          1HA       GLY  91  -1.547 -14.971  -3.592
  703   2HA   GLY  91          2HA       GLY  91  -1.790 -14.939  -5.331
  704    H    ILE  92           H        ILE  92  -2.414 -12.385  -2.987
  705    HA   ILE  92           HA       ILE  92  -0.786 -10.569  -4.589
  706    HB   ILE  92           HB       ILE  92  -2.574  -9.981  -2.223
  707   1HG1  ILE  92          1HG1      ILE  92  -3.088  -9.633  -5.187
  708   2HG1  ILE  92          2HG1      ILE  92  -3.802 -10.883  -4.172
  709   1HG2  ILE  92          1HG2      ILE  92  -1.275  -8.134  -4.223
  710   2HG2  ILE  92          2HG2      ILE  92  -2.424  -7.649  -2.977
  711   3HG2  ILE  92          3HG2      ILE  92  -0.849  -8.296  -2.519
  712   1HD1  ILE  92          1HD1      ILE  92  -5.358  -9.070  -4.568
  713   2HD1  ILE  92          2HD1      ILE  92  -4.930  -9.166  -2.860
  714   3HD1  ILE  92          3HD1      ILE  92  -4.213  -7.919  -3.879
  715    H    GLY  93           H        GLY  93   1.214 -10.007  -4.023
  716   1HA   GLY  93          1HA       GLY  93   2.425 -11.057  -1.653
  717   2HA   GLY  93          2HA       GLY  93   3.182  -9.983  -2.822
  718    H    LEU  94           H        LEU  94   1.509 -10.219   0.180
  719    HA   LEU  94           HA       LEU  94   1.371  -7.323   0.497
  720   1HB   LEU  94          1HB       LEU  94  -0.572  -8.560   1.210
  721   2HB   LEU  94          2HB       LEU  94   0.408  -9.602   2.223
  722    HG   LEU  94           HG       LEU  94   0.923  -7.686   3.688
  723   1HD1  LEU  94          1HD1      LEU  94  -1.013  -6.178   1.937
  724   2HD1  LEU  94          2HD1      LEU  94  -0.305  -5.595   3.444
  725   3HD1  LEU  94          3HD1      LEU  94   0.725  -5.895   2.044
  726   1HD2  LEU  94          1HD2      LEU  94  -1.300  -7.473   4.682
  727   2HD2  LEU  94          2HD2      LEU  94  -2.018  -8.142   3.218
  728   3HD2  LEU  94          3HD2      LEU  94  -0.956  -9.138   4.214
  729    H    GLU  95           H        GLU  95   3.091  -6.291   1.228
  730    HA   GLU  95           HA       GLU  95   4.714  -7.605   3.309
  731   1HB   GLU  95          1HB       GLU  95   5.618  -5.622   1.215
  732   2HB   GLU  95          2HB       GLU  95   6.617  -6.212   2.534
  733   1HG   GLU  95          1HG       GLU  95   6.131  -8.548   1.577
  734   2HG   GLU  95          2HG       GLU  95   5.618  -7.674   0.130
  735    H    ALA  96           H        ALA  96   4.417  -6.709   5.216
  736    HA   ALA  96           HA       ALA  96   3.508  -3.975   5.487
  737   1HB   ALA  96          1HB       ALA  96   2.641  -5.687   7.000
  738   2HB   ALA  96          2HB       ALA  96   4.271  -6.010   7.587
  739   3HB   ALA  96          3HB       ALA  96   3.517  -4.445   7.894
  740    H    MET  97           H        MET  97   4.866  -2.306   5.522
  741    HA   MET  97           HA       MET  97   7.648  -2.759   6.371
  742   1HB   MET  97          1HB       MET  97   6.758  -1.300   3.876
  743   2HB   MET  97          2HB       MET  97   8.401  -1.313   4.494
  744   1HG   MET  97          1HG       MET  97   6.902  -3.783   3.658
  745   2HG   MET  97          2HG       MET  97   7.986  -2.875   2.605
  746   1HE   MET  97          1HE       MET  97  10.280  -1.980   4.598
  747   2HE   MET  97          2HE       MET  97  10.590  -2.645   2.994
  748   3HE   MET  97          3HE       MET  97  11.432  -3.302   4.398
  749    H    THR  98           H        THR  98   8.813  -0.623   6.631
  750    HA   THR  98           HA       THR  98   7.166   1.237   8.093
  751    HB   THR  98           HB       THR  98   9.331   2.471   8.423
  752    HG1  THR  98           HG1      THR  98  11.245   1.360   7.756
  753   1HG2  THR  98          1HG2      THR  98   9.335  -0.466   9.133
  754   2HG2  THR  98          2HG2      THR  98  10.336   0.772   9.896
  755   3HG2  THR  98          3HG2      THR  98   8.582   0.831  10.062
  756    H    ASN  99           H        ASN  99   7.073   3.516   7.567
  757    HA   ASN  99           HA       ASN  99   6.156   3.934   4.973
  758   1HB   ASN  99          1HB       ASN  99   5.603   5.254   7.058
  759   2HB   ASN  99          2HB       ASN  99   7.134   6.094   6.846
  760   1HD2  ASN  99          2HD2      ASN  99   3.938   5.593   5.591
  761   2HD2  ASN  99          1HD2      ASN  99   3.922   6.968   4.546
  762    H    ALA 100           H        ALA 100   9.224   4.969   6.442
  763    HA   ALA 100           HA       ALA 100  10.241   6.300   4.188
  764   1HB   ALA 100          1HB       ALA 100  11.791   4.967   6.401
  765   2HB   ALA 100          2HB       ALA 100  12.390   6.210   5.302
  766   3HB   ALA 100          3HB       ALA 100  11.116   6.595   6.459
  767    H    ALA 101           H        ALA 101  10.502   2.910   5.179
  768    HA   ALA 101           HA       ALA 101  12.455   2.288   3.171
  769   1HB   ALA 101          1HB       ALA 101  12.193  -0.018   3.875
  770   2HB   ALA 101          2HB       ALA 101  12.349   1.041   5.277
  771   3HB   ALA 101          3HB       ALA 101  10.765   0.413   4.817
  772    H    ALA 102           H        ALA 102   8.961   1.882   3.508
  773    HA   ALA 102           HA       ALA 102   8.516   0.281   1.250
  774   1HB   ALA 102          1HB       ALA 102   6.673   2.347   2.448
  775   2HB   ALA 102          2HB       ALA 102   6.202   1.029   1.377
  776   3HB   ALA 102          3HB       ALA 102   6.830   0.674   2.985
  777    H    ALA 103           H        ALA 103   8.818   3.767   1.606
  778    HA   ALA 103           HA       ALA 103   8.033   4.540  -0.969
  779   1HB   ALA 103          1HB       ALA 103   8.339   6.115   0.878
  780   2HB   ALA 103          2HB       ALA 103  10.081   5.842   0.822
  781   3HB   ALA 103          3HB       ALA 103   9.262   6.599  -0.545
  782    H    ARG 104           H        ARG 104  11.117   3.375   0.271
  783    HA   ARG 104           HA       ARG 104  12.626   3.989  -2.062
  784   1HB   ARG 104          1HB       ARG 104  13.232   1.875   0.009
  785   2HB   ARG 104          2HB       ARG 104  14.369   2.604  -1.114
  786   1HG   ARG 104          1HG       ARG 104  13.939   4.797   0.007
  787   2HG   ARG 104          2HG       ARG 104  13.005   3.918   1.220
  788   1HD   ARG 104          1HD       ARG 104  15.936   3.677   0.593
  789   2HD   ARG 104          2HD       ARG 104  15.185   4.178   2.106
  790    HE   ARG 104           HE       ARG 104  14.830   1.433   1.093
  791   1HH1  ARG 104          1HH1      ARG 104  15.884   3.653   3.601
  792   2HH1  ARG 104          2HH1      ARG 104  16.241   2.386   4.741
  793   1HH2  ARG 104          1HH2      ARG 104  15.308  -0.218   2.575
  794   2HH2  ARG 104          2HH2      ARG 104  15.939   0.181   4.146
  795    H    THR 105           H        THR 105  10.956   1.096  -0.900
  796    HA   THR 105           HA       THR 105  11.750  -0.611  -3.002
  797    HB   THR 105           HB       THR 105   9.121  -0.832  -1.543
  798    HG1  THR 105           HG1      THR 105  11.708  -1.640  -0.617
  799   1HG2  THR 105          1HG2      THR 105   9.554  -3.236  -1.774
  800   2HG2  THR 105          2HG2      THR 105   9.537  -2.436  -3.345
  801   3HG2  THR 105          3HG2      THR 105  11.072  -2.883  -2.600
  802    H    TYR 106           H        TYR 106   8.949   1.517  -2.558
  803    HA   TYR 106           HA       TYR 106   7.562   0.872  -4.898
  804   1HB   TYR 106          1HB       TYR 106   6.507   2.221  -3.196
  805   2HB   TYR 106          2HB       TYR 106   7.718   3.486  -3.383
  806    HD1  TYR 106           HD1      TYR 106   4.953   1.749  -5.170
  807    HD2  TYR 106           HD2      TYR 106   7.400   5.224  -4.932
  808    HE1  TYR 106           HE1      TYR 106   3.540   2.854  -6.852
  809    HE2  TYR 106           HE2      TYR 106   5.992   6.336  -6.611
  810    HH   TYR 106           HH       TYR 106   2.968   5.141  -7.565
  811    H    ASN 107           H        ASN 107  10.143   3.221  -4.324
  812    HA   ASN 107           HA       ASN 107  10.263   4.489  -6.771
  813   1HB   ASN 107          1HB       ASN 107  11.686   5.313  -5.094
  814   2HB   ASN 107          2HB       ASN 107  12.389   3.732  -4.783
  815   1HD2  ASN 107          2HD2      ASN 107  12.392   6.514  -6.899
  816   2HD2  ASN 107          1HD2      ASN 107  13.895   6.146  -7.683
  817    H    VAL 108           H        VAL 108  11.656   1.359  -5.873
  818    HA   VAL 108           HA       VAL 108  12.946   0.974  -8.399
  819    HB   VAL 108           HB       VAL 108  12.263  -1.105  -6.311
  820   1HG1  VAL 108          1HG1      VAL 108  12.827  -2.079  -8.465
  821   2HG1  VAL 108          2HG1      VAL 108  14.304  -1.119  -8.535
  822   3HG1  VAL 108          3HG1      VAL 108  14.122  -2.369  -7.304
  823   1HG2  VAL 108          1HG2      VAL 108  13.573   0.688  -5.323
  824   2HG2  VAL 108          2HG2      VAL 108  14.551  -0.771  -5.487
  825   3HG2  VAL 108          3HG2      VAL 108  14.758   0.561  -6.623
  826    H    LEU 109           H        LEU 109  10.036  -0.415  -6.878
  827    HA   LEU 109           HA       LEU 109   9.419  -2.146  -9.017
  828   1HB   LEU 109          1HB       LEU 109   7.586  -1.018  -6.903
  829   2HB   LEU 109          2HB       LEU 109   7.225  -2.390  -7.933
  830    HG   LEU 109           HG       LEU 109   9.409  -2.259  -5.852
  831   1HD1  LEU 109          1HD1      LEU 109   6.830  -3.818  -5.925
  832   2HD1  LEU 109          2HD1      LEU 109   8.070  -3.921  -4.676
  833   3HD1  LEU 109          3HD1      LEU 109   7.168  -2.422  -4.900
  834   1HD2  LEU 109          1HD2      LEU 109  10.081  -3.631  -7.755
  835   2HD2  LEU 109          2HD2      LEU 109   9.748  -4.632  -6.340
  836   3HD2  LEU 109          3HD2      LEU 109   8.569  -4.534  -7.648
  837    H    ALA 110           H        ALA 110   8.425   1.168  -8.316
  838    HA   ALA 110           HA       ALA 110   6.416   1.261 -10.345
  839   1HB   ALA 110          1HB       ALA 110   6.376   2.747  -8.393
  840   2HB   ALA 110          2HB       ALA 110   7.837   3.544  -8.980
  841   3HB   ALA 110          3HB       ALA 110   6.340   3.648  -9.908
  842    H    SER 111           H        SER 111   9.859   1.751 -10.306
  843    HA   SER 111           HA       SER 111   9.947   3.225 -12.764
  844   1HB   SER 111          1HB       SER 111  12.134   1.776 -11.253
  845   2HB   SER 111          2HB       SER 111  12.397   2.835 -12.640
  846    HG   SER 111           HG       SER 111  11.768   3.456 -10.005
  847    H    GLU 112           H        GLU 112   9.677  -0.090 -11.930
  848    HA   GLU 112           HA       GLU 112  10.550  -0.966 -14.570
  849   1HB   GLU 112          1HB       GLU 112  11.119  -2.292 -12.526
  850   2HB   GLU 112          2HB       GLU 112   9.405  -2.619 -12.308
  851   1HG   GLU 112          1HG       GLU 112   9.321  -3.818 -14.395
  852   2HG   GLU 112          2HG       GLU 112  10.998  -3.398 -14.740
  853    H    GLY 113           H        GLY 113   7.717  -0.033 -12.924
  854   1HA   GLY 113          1HA       GLY 113   5.625   0.364 -13.864
  855   2HA   GLY 113          2HA       GLY 113   6.130  -0.523 -15.296
  856    H    ARG 114           H        ARG 114   6.150  -1.586 -11.923
  857    HA   ARG 114           HA       ARG 114   4.681  -3.972 -12.680
  858   1HB   ARG 114          1HB       ARG 114   5.914  -3.091 -10.072
  859   2HB   ARG 114          2HB       ARG 114   5.018  -4.588 -10.261
  860   1HG   ARG 114          1HG       ARG 114   6.678  -5.227 -12.040
  861   2HG   ARG 114          2HG       ARG 114   7.629  -3.826 -11.532
  862   1HD   ARG 114          1HD       ARG 114   7.685  -4.710  -9.247
  863   2HD   ARG 114          2HD       ARG 114   6.761  -6.115  -9.772
  864    HE   ARG 114           HE       ARG 114   9.185  -5.753 -11.270
  865   1HH1  ARG 114          1HH1      ARG 114   7.764  -7.110  -8.373
  866   2HH1  ARG 114          2HH1      ARG 114   9.080  -8.209  -8.077
  867   1HH2  ARG 114          1HH2      ARG 114  10.917  -7.196 -10.894
  868   2HH2  ARG 114          2HH2      ARG 114  10.872  -8.262  -9.524
  869    H    ARG 115           H        ARG 115   2.938  -4.741 -11.169
  870    HA   ARG 115           HA       ARG 115   1.035  -2.577 -10.721
  871   1HB   ARG 115          1HB       ARG 115   0.729  -5.584 -10.663
  872   2HB   ARG 115          2HB       ARG 115  -0.568  -4.464 -10.261
  873   1HG   ARG 115          1HG       ARG 115  -0.506  -3.532 -12.484
  874   2HG   ARG 115          2HG       ARG 115   0.878  -4.546 -12.898
  875   1HD   ARG 115          1HD       ARG 115  -0.477  -6.544 -12.622
  876   2HD   ARG 115          2HD       ARG 115  -1.856  -5.560 -12.128
  877    HE   ARG 115           HE       ARG 115  -1.916  -4.654 -14.375
  878   1HH1  ARG 115          1HH1      ARG 115   0.050  -7.517 -13.912
  879   2HH1  ARG 115          2HH1      ARG 115  -0.033  -7.986 -15.582
  880   1HH2  ARG 115          1HH2      ARG 115  -2.005  -5.247 -16.556
  881   2HH2  ARG 115          2HH2      ARG 115  -1.203  -6.694 -17.099
  882    H    VAL 116           H        VAL 116   2.423  -1.779  -9.005
  883    HA   VAL 116           HA       VAL 116   2.222  -3.310  -6.513
  884    HB   VAL 116           HB       VAL 116   4.506  -2.740  -7.041
  885   1HG1  VAL 116          1HG1      VAL 116   3.612   0.137  -7.159
  886   2HG1  VAL 116          2HG1      VAL 116   5.279  -0.432  -7.264
  887   3HG1  VAL 116          3HG1      VAL 116   4.122  -0.852  -8.528
  888   1HG2  VAL 116          1HG2      VAL 116   3.465  -0.963  -4.837
  889   2HG2  VAL 116          2HG2      VAL 116   3.883  -2.671  -4.689
  890   3HG2  VAL 116          3HG2      VAL 116   5.139  -1.483  -5.040
  891    H    ALA 117           H        ALA 117   0.843  -2.701  -5.032
  892    HA   ALA 117           HA       ALA 117  -0.364  -0.033  -5.211
  893   1HB   ALA 117          1HB       ALA 117  -2.106  -0.918  -3.739
  894   2HB   ALA 117          2HB       ALA 117  -1.919  -1.924  -5.175
  895   3HB   ALA 117          3HB       ALA 117  -1.245  -2.454  -3.634
  896    H    LEU 118           H        LEU 118   0.826   1.402  -4.100
  897    HA   LEU 118           HA       LEU 118   2.133   0.606  -1.635
  898   1HB   LEU 118          1HB       LEU 118   3.279   2.081  -3.255
  899   2HB   LEU 118          2HB       LEU 118   2.039   3.296  -3.010
  900    HG   LEU 118           HG       LEU 118   2.727   3.468  -0.629
  901   1HD1  LEU 118          1HD1      LEU 118   3.677   1.243  -0.360
  902   2HD1  LEU 118          2HD1      LEU 118   4.970   1.647  -1.489
  903   3HD1  LEU 118          3HD1      LEU 118   4.858   2.484   0.060
  904   1HD2  LEU 118          1HD2      LEU 118   3.592   5.033  -2.283
  905   2HD2  LEU 118          2HD2      LEU 118   4.810   4.678  -1.059
  906   3HD2  LEU 118          3HD2      LEU 118   4.917   3.928  -2.652
  907    H    ALA 119           H        ALA 119   0.610   0.285  -0.099
  908    HA   ALA 119           HA       ALA 119  -1.470   2.254   0.359
  909   1HB   ALA 119          1HB       ALA 119  -1.981  -0.126   0.643
  910   2HB   ALA 119          2HB       ALA 119  -0.770  -0.234   1.921
  911   3HB   ALA 119          3HB       ALA 119  -2.207   0.764   2.149
  912    H    MET 120           H        MET 120  -0.554   4.104   1.037
  913    HA   MET 120           HA       MET 120   1.619   3.986   2.985
  914   1HB   MET 120          1HB       MET 120   1.361   5.416   0.708
  915   2HB   MET 120          2HB       MET 120   0.731   6.577   1.867
  916   1HG   MET 120          1HG       MET 120   3.080   6.949   1.495
  917   2HG   MET 120          2HG       MET 120   2.805   6.408   3.150
  918   1HE   MET 120          1HE       MET 120   6.334   4.969   1.845
  919   2HE   MET 120          2HE       MET 120   5.589   6.152   2.919
  920   3HE   MET 120          3HE       MET 120   5.549   6.400   1.174
  921    H    ILE 121           H        ILE 121   0.992   3.991   5.035
  922    HA   ILE 121           HA       ILE 121  -1.289   5.666   5.841
  923    HB   ILE 121           HB       ILE 121   0.137   3.523   7.438
  924   1HG1  ILE 121          1HG1      ILE 121  -2.535   3.400   6.018
  925   2HG1  ILE 121          2HG1      ILE 121  -1.063   2.594   5.483
  926   1HG2  ILE 121          1HG2      ILE 121  -0.910   5.224   8.832
  927   2HG2  ILE 121          2HG2      ILE 121  -2.434   5.012   7.970
  928   3HG2  ILE 121          3HG2      ILE 121  -1.786   3.699   8.952
  929   1HD1  ILE 121          1HD1      ILE 121  -2.569   1.052   6.608
  930   2HD1  ILE 121          2HD1      ILE 121  -1.063   1.237   7.507
  931   3HD1  ILE 121          3HD1      ILE 121  -2.526   2.053   8.060
  932    H    VAL 122           H        VAL 122  -0.822   7.584   6.741
  933    HA   VAL 122           HA       VAL 122   1.681   7.810   8.272
  934    HB   VAL 122           HB       VAL 122   1.779  10.229   7.489
  935   1HG1  VAL 122          1HG1      VAL 122   3.338   8.523   6.721
  936   2HG1  VAL 122          2HG1      VAL 122   2.206   8.039   5.460
  937   3HG1  VAL 122          3HG1      VAL 122   2.942   9.642   5.416
  938   1HG2  VAL 122          1HG2      VAL 122   0.747  10.717   5.319
  939   2HG2  VAL 122          2HG2      VAL 122  -0.078   9.159   5.363
  940   3HG2  VAL 122          3HG2      VAL 122  -0.468  10.399   6.557
  941    H    GLY 123           H        GLY 123   1.168   8.083  10.311
  942   1HA   GLY 123          1HA       GLY 123   0.421   9.778  11.927
  943   2HA   GLY 123          2HA       GLY 123  -1.043   9.925  10.964
  944    H    GLY 124           H        GLY 124  -1.571   9.538  13.485
  945   1HA   GLY 124          1HA       GLY 124  -3.385   7.947  14.069
  946   2HA   GLY 124          2HA       GLY 124  -2.263   6.668  13.633
  947    H    LEU 125           H        LEU 125  -0.304   6.461  14.951
  948    HA   LEU 125           HA       LEU 125  -0.947   7.057  17.761
  949   1HB   LEU 125          1HB       LEU 125   0.680   4.822  16.546
  950   2HB   LEU 125          2HB       LEU 125   0.584   5.126  18.267
  951    HG   LEU 125           HG       LEU 125  -1.959   4.821  17.992
  952   1HD1  LEU 125          1HD1      LEU 125  -2.644   3.386  16.145
  953   2HD1  LEU 125          2HD1      LEU 125  -2.035   4.933  15.559
  954   3HD1  LEU 125          3HD1      LEU 125  -1.025   3.490  15.455
  955   1HD2  LEU 125          1HD2      LEU 125  -0.097   2.482  17.615
  956   2HD2  LEU 125          2HD2      LEU 125  -0.514   3.243  19.150
  957   3HD2  LEU 125          3HD2      LEU 125  -1.751   2.400  18.219
  958    H    GLU 126           H        GLU 126   0.390   8.896  15.991
  959    HA   GLU 126           HA       GLU 126   3.115   8.897  17.102
  960   1HB   GLU 126          1HB       GLU 126   3.398  10.635  15.133
  961   2HB   GLU 126          2HB       GLU 126   3.504   8.904  14.848
  962   1HG   GLU 126          1HG       GLU 126   2.172  10.070  13.152
  963   2HG   GLU 126          2HG       GLU 126   1.245   8.851  14.022
  964    H    HIS 127           H        HIS 127   0.245  10.191  17.765
  965    HA   HIS 127           HA       HIS 127   1.102  12.937  18.130
  966   1HB   HIS 127          1HB       HIS 127  -1.169  13.337  18.990
  967   2HB   HIS 127          2HB       HIS 127  -1.193  12.569  17.410
  968    HD1  HIS 127           HD1      HIS 127  -2.543  10.487  17.197
  969    HD2  HIS 127           HD2      HIS 127  -1.808  11.496  21.161
  970    HE1  HIS 127           HE1      HIS 127  -3.926   8.896  18.569
  971    HE2  HIS 127           HE2      HIS 127  -3.609   9.652  20.956
  972    H    HIS 128           H        HIS 128   0.760  13.998  20.238
  973    HA   HIS 128           HA       HIS 128   1.363  12.241  22.518
  974   1HB   HIS 128          1HB       HIS 128   3.493  13.089  21.567
  975   2HB   HIS 128          2HB       HIS 128   2.914  14.736  21.770
  976    HD1  HIS 128           HD1      HIS 128   3.892  15.822  23.726
  977    HD2  HIS 128           HD2      HIS 128   3.474  11.723  24.304
  978    HE1  HIS 128           HE1      HIS 128   4.835  15.357  26.012
  979    HE2  HIS 128           HE2      HIS 128   4.777  12.849  26.240
  980    H    HIS 129           H        HIS 129   0.075  12.719  24.195
  981    HA   HIS 129           HA       HIS 129  -1.767  14.906  23.986
  982   1HB   HIS 129          1HB       HIS 129  -2.267  12.628  24.993
  983   2HB   HIS 129          2HB       HIS 129  -1.338  13.135  26.397
  984    HD1  HIS 129           HD1      HIS 129  -4.596  12.579  25.847
  985    HD2  HIS 129           HD2      HIS 129  -2.625  16.094  26.895
  986    HE1  HIS 129           HE1      HIS 129  -6.335  14.045  26.927
  987    HE2  HIS 129           HE2      HIS 129  -5.085  16.090  27.703
  988    H    HIS 130           H        HIS 130   0.561  14.034  26.544
  989    HA   HIS 130           HA       HIS 130   1.683  15.247  28.084
  990   1HB   HIS 130          1HB       HIS 130   2.680  16.351  26.110
  991   2HB   HIS 130          2HB       HIS 130   1.387  17.544  26.139
  992    HD1  HIS 130           HD1      HIS 130   4.235  16.331  28.352
  993    HD2  HIS 130           HD2      HIS 130   1.917  19.725  27.686
  994    HE1  HIS 130           HE1      HIS 130   5.239  18.137  29.792
  995    HE2  HIS 130           HE2      HIS 130   3.733  20.136  29.486
  996    H    HIS 131           H        HIS 131   0.362  15.254  29.783
  997    HA   HIS 131           HA       HIS 131  -1.996  16.880  29.926
  998   1HB   HIS 131          1HB       HIS 131  -1.707  14.668  31.086
  999   2HB   HIS 131          2HB       HIS 131  -0.567  15.446  32.176
 1000    HD1  HIS 131           HD1      HIS 131  -4.202  15.145  31.421
 1001    HD2  HIS 131           HD2      HIS 131  -1.736  17.143  34.113
 1002    HE1  HIS 131           HE1      HIS 131  -5.727  16.023  33.218
 1003    HE2  HIS 131           HE2      HIS 131  -4.234  17.302  34.789
 1004    H    HIS 132           H        HIS 132  -2.152  18.922  30.576
 1005    HA   HIS 132           HA       HIS 132  -0.206  19.954  32.497
 1006   1HB   HIS 132          1HB       HIS 132   0.502  20.755  30.255
 1007   2HB   HIS 132          2HB       HIS 132  -1.092  21.464  30.021
 1008    HD1  HIS 132           HD1      HIS 132  -1.411  23.800  30.843
 1009    HD2  HIS 132           HD2      HIS 132   2.003  22.026  32.412
 1010    HE1  HIS 132           HE1      HIS 132  -0.219  25.624  32.094
 1011    HE2  HIS 132           HE2      HIS 132   1.789  24.504  33.134
  Start of MODEL    5
    1   1H    MET   1          1HT       MET   1  -0.967  28.186 -24.164
    2   2H    MET   1          2HT       MET   1  -1.618  28.823 -22.734
    3   3H    MET   1          3HT       MET   1  -2.650  28.232 -23.942
    4    HA   MET   1           HA       MET   1  -1.779  26.004 -23.626
    5   1HB   MET   1          1HB       MET   1   0.447  26.614 -22.829
    6   2HB   MET   1          2HB       MET   1  -0.244  27.324 -21.378
    7   1HG   MET   1          1HG       MET   1  -1.037  25.130 -20.670
    8   2HG   MET   1          2HG       MET   1  -0.357  24.412 -22.127
    9   1HE   MET   1          1HE       MET   1   0.234  23.441 -19.118
   10   2HE   MET   1          2HE       MET   1   1.964  23.118 -19.219
   11   3HE   MET   1          3HE       MET   1   0.901  22.646 -20.545
   12    HA   PRO   2           HA       PRO   2  -5.259  26.332 -20.752
   13   1HB   PRO   2          1HB       PRO   2  -6.844  24.554 -21.979
   14   2HB   PRO   2          2HB       PRO   2  -6.634  26.190 -22.610
   15   1HG   PRO   2          1HG       PRO   2  -5.481  23.626 -23.577
   16   2HG   PRO   2          2HG       PRO   2  -5.967  25.060 -24.496
   17   1HD   PRO   2          1HD       PRO   2  -3.347  24.374 -23.718
   18   2HD   PRO   2          2HD       PRO   2  -3.879  25.935 -24.368
   19    H    LEU   3           H        LEU   3  -5.904  24.972 -19.071
   20    HA   LEU   3           HA       LEU   3  -4.324  22.523 -18.802
   21   1HB   LEU   3          1HB       LEU   3  -5.963  24.027 -16.762
   22   2HB   LEU   3          2HB       LEU   3  -5.025  22.584 -16.432
   23    HG   LEU   3           HG       LEU   3  -3.917  25.261 -17.288
   24   1HD1  LEU   3          1HD1      LEU   3  -2.939  25.292 -15.041
   25   2HD1  LEU   3          2HD1      LEU   3  -4.701  25.262 -14.991
   26   3HD1  LEU   3          3HD1      LEU   3  -3.785  23.793 -14.658
   27   1HD2  LEU   3          1HD2      LEU   3  -2.481  22.705 -16.577
   28   2HD2  LEU   3          2HD2      LEU   3  -2.601  23.408 -18.190
   29   3HD2  LEU   3          3HD2      LEU   3  -1.723  24.260 -16.919
   30    H    ASN   4           H        ASN   4  -7.548  23.342 -17.579
   31    HA   ASN   4           HA       ASN   4  -9.577  22.350 -17.750
   32   1HB   ASN   4          1HB       ASN   4  -8.349  20.914 -20.110
   33   2HB   ASN   4          2HB       ASN   4 -10.037  20.768 -19.637
   34   1HD2  ASN   4          2HD2      ASN   4 -10.220  23.576 -18.826
   35   2HD2  ASN   4          1HD2      ASN   4 -10.275  24.493 -20.294
   36    H    GLN   5           H        GLN   5  -7.218  19.772 -18.502
   37    HA   GLN   5           HA       GLN   5  -8.527  17.973 -16.641
   38   1HB   GLN   5          1HB       GLN   5  -6.035  17.659 -18.329
   39   2HB   GLN   5          2HB       GLN   5  -6.739  16.383 -17.345
   40   1HG   GLN   5          1HG       GLN   5  -8.779  16.475 -18.683
   41   2HG   GLN   5          2HG       GLN   5  -8.075  17.758 -19.666
   42   1HE2  GLN   5          2HE2      GLN   5  -6.418  17.268 -21.099
   43   2HE2  GLN   5          1HE2      GLN   5  -6.074  15.640 -21.595
   44    H    GLU   6           H        GLU   6  -7.681  20.230 -15.386
   45    HA   GLU   6           HA       GLU   6  -5.072  19.815 -14.175
   46   1HB   GLU   6          1HB       GLU   6  -5.590  21.992 -13.063
   47   2HB   GLU   6          2HB       GLU   6  -5.646  22.065 -14.820
   48   1HG   GLU   6          1HG       GLU   6  -8.134  21.762 -14.648
   49   2HG   GLU   6          2HG       GLU   6  -7.963  21.983 -12.908
   50    H    HIS   7           H        HIS   7  -7.416  18.022 -13.680
   51    HA   HIS   7           HA       HIS   7  -8.248  18.496 -10.986
   52   1HB   HIS   7          1HB       HIS   7  -9.665  17.275 -12.598
   53   2HB   HIS   7          2HB       HIS   7  -8.483  15.972 -12.634
   54    HD1  HIS   7           HD1      HIS   7 -10.094  17.796  -9.696
   55    HD2  HIS   7           HD2      HIS   7  -9.571  13.956 -11.211
   56    HE1  HIS   7           HE1      HIS   7 -11.141  16.251  -8.009
   57    HE2  HIS   7           HE2      HIS   7 -11.037  13.970  -9.078
   58    HA   PRO   8           HA       PRO   8  -4.914  15.291  -9.839
   59   1HB   PRO   8          1HB       PRO   8  -3.339  14.515 -12.112
   60   2HB   PRO   8          2HB       PRO   8  -4.405  13.506 -11.133
   61   1HG   PRO   8          1HG       PRO   8  -4.870  14.156 -13.765
   62   2HG   PRO   8          2HG       PRO   8  -6.129  13.682 -12.612
   63   1HD   PRO   8          1HD       PRO   8  -5.330  16.418 -13.531
   64   2HD   PRO   8          2HD       PRO   8  -6.952  15.758 -13.226
   65    H    ASP   9           H        ASP   9  -2.477  15.328  -9.638
   66    HA   ASP   9           HA       ASP   9  -1.563  18.052  -9.925
   67   1HB   ASP   9          1HB       ASP   9  -0.318  15.597  -8.681
   68   2HB   ASP   9          2HB       ASP   9   0.511  17.146  -8.770
   69    H    TYR  10           H        TYR  10   0.836  18.284 -10.501
   70    HA   TYR  10           HA       TYR  10   1.220  17.524 -13.217
   71   1HB   TYR  10          1HB       TYR  10   3.617  18.547 -12.537
   72   2HB   TYR  10          2HB       TYR  10   2.215  19.554 -12.890
   73    HD1  TYR  10           HD1      TYR  10   4.345  18.206 -10.200
   74    HD2  TYR  10           HD2      TYR  10   1.109  20.796 -11.161
   75    HE1  TYR  10           HE1      TYR  10   4.479  19.199  -7.953
   76    HE2  TYR  10           HE2      TYR  10   1.234  21.798  -8.921
   77    HH   TYR  10           HH       TYR  10   3.826  21.406  -6.855
   78    H    THR  11           H        THR  11   1.206  15.252 -13.150
   79    HA   THR  11           HA       THR  11   2.128  13.171 -13.132
   80    HB   THR  11           HB       THR  11   4.740  14.391 -12.204
   81    HG1  THR  11           HG1      THR  11   4.263  15.567 -14.013
   82   1HG2  THR  11          1HG2      THR  11   4.625  11.932 -12.245
   83   2HG2  THR  11          2HG2      THR  11   4.131  11.988 -13.936
   84   3HG2  THR  11          3HG2      THR  11   5.738  12.546 -13.468
   85    H    TYR  12           H        TYR  12   3.279  11.591 -11.451
   86    HA   TYR  12           HA       TYR  12   2.942  12.569  -8.719
   87   1HB   TYR  12          1HB       TYR  12   1.498  10.219  -9.916
   88   2HB   TYR  12          2HB       TYR  12   1.851  10.276  -8.191
   89    HD1  TYR  12           HD1      TYR  12   0.905  12.128  -6.807
   90    HD2  TYR  12           HD2      TYR  12  -0.282  11.508 -10.846
   91    HE1  TYR  12           HE1      TYR  12  -1.081  13.524  -6.431
   92    HE2  TYR  12           HE2      TYR  12  -2.273  12.905 -10.478
   93    HH   TYR  12           HH       TYR  12  -2.659  14.851  -7.665
   94    H    ALA  13           H        ALA  13   4.941  12.425  -8.015
   95    HA   ALA  13           HA       ALA  13   6.268   9.805  -8.193
   96   1HB   ALA  13          1HB       ALA  13   8.424  10.924  -8.394
   97   2HB   ALA  13          2HB       ALA  13   7.355  11.382  -9.720
   98   3HB   ALA  13          3HB       ALA  13   7.623  12.496  -8.379
   99    H    LEU  14           H        LEU  14   7.294   9.099  -6.361
  100    HA   LEU  14           HA       LEU  14   6.534  10.390  -3.895
  101   1HB   LEU  14          1HB       LEU  14   6.415   7.938  -4.158
  102   2HB   LEU  14          2HB       LEU  14   8.153   7.884  -4.379
  103    HG   LEU  14           HG       LEU  14   8.453   8.735  -2.073
  104   1HD1  LEU  14          1HD1      LEU  14   6.352   9.949  -1.849
  105   2HD1  LEU  14          2HD1      LEU  14   5.459   8.428  -1.899
  106   3HD1  LEU  14          3HD1      LEU  14   6.543   8.772  -0.550
  107   1HD2  LEU  14          1HD2      LEU  14   7.794   6.676  -0.942
  108   2HD2  LEU  14          2HD2      LEU  14   6.739   6.263  -2.294
  109   3HD2  LEU  14          3HD2      LEU  14   8.486   6.336  -2.528
  110    H    ARG  15           H        ARG  15   7.722  11.864  -2.920
  111    HA   ARG  15           HA       ARG  15  10.410  12.416  -3.814
  112   1HB   ARG  15          1HB       ARG  15   8.569  13.725  -1.819
  113   2HB   ARG  15          2HB       ARG  15  10.220  14.272  -2.084
  114   1HG   ARG  15          1HG       ARG  15   8.291  14.022  -4.356
  115   2HG   ARG  15          2HG       ARG  15   8.324  15.458  -3.329
  116   1HD   ARG  15          1HD       ARG  15  10.709  14.341  -4.802
  117   2HD   ARG  15          2HD       ARG  15   9.708  15.674  -5.379
  118    HE   ARG  15           HE       ARG  15  10.416  16.560  -2.959
  119   1HH1  ARG  15          1HH1      ARG  15  12.334  15.118  -5.513
  120   2HH1  ARG  15          2HH1      ARG  15  13.776  16.001  -5.101
  121   1HH2  ARG  15          1HH2      ARG  15  12.300  17.733  -2.433
  122   2HH2  ARG  15          2HH2      ARG  15  13.758  17.478  -3.345
  123    H    ALA  16           H        ALA  16   9.018  12.011  -0.565
  124    HA   ALA  16           HA       ALA  16  11.121  10.207   0.209
  125   1HB   ALA  16          1HB       ALA  16  12.259  12.360   0.441
  126   2HB   ALA  16          2HB       ALA  16  10.969  12.930   1.499
  127   3HB   ALA  16          3HB       ALA  16  12.005  11.596   2.009
  128    H    ALA  17           H        ALA  17  10.861   9.530   2.483
  129    HA   ALA  17           HA       ALA  17   8.049   9.717   3.325
  130   1HB   ALA  17          1HB       ALA  17   8.217   7.408   4.098
  131   2HB   ALA  17          2HB       ALA  17   8.558   7.526   2.372
  132   3HB   ALA  17          3HB       ALA  17   9.882   7.332   3.520
  133    H    ASP  18           H        ASP  18   7.674  10.173   5.417
  134    HA   ASP  18           HA       ASP  18  10.035  10.534   7.146
  135   1HB   ASP  18          1HB       ASP  18   9.105  12.670   6.735
  136   2HB   ASP  18          2HB       ASP  18   7.459  12.081   6.932
  137    H    GLY  19           H        GLY  19   6.757   9.326   6.955
  138   1HA   GLY  19          1HA       GLY  19   6.282   7.349   8.375
  139   2HA   GLY  19          2HA       GLY  19   7.051   8.235   9.688
  140    H    ARG  20           H        ARG  20   6.049  10.576   9.862
  141    HA   ARG  20           HA       ARG  20   3.128  10.232   9.907
  142   1HB   ARG  20          1HB       ARG  20   3.053  11.881  11.660
  143   2HB   ARG  20          2HB       ARG  20   4.261  10.678  12.087
  144   1HG   ARG  20          1HG       ARG  20   5.897  12.391  10.957
  145   2HG   ARG  20          2HG       ARG  20   4.602  13.532  11.331
  146   1HD   ARG  20          1HD       ARG  20   6.050  13.581  13.192
  147   2HD   ARG  20          2HD       ARG  20   4.667  12.606  13.692
  148    HE   ARG  20           HE       ARG  20   6.959  11.169  12.606
  149   1HH1  ARG  20          1HH1      ARG  20   5.201  12.205  15.462
  150   2HH1  ARG  20          2HH1      ARG  20   5.982  11.045  16.505
  151   1HH2  ARG  20          1HH2      ARG  20   7.975   9.668  13.977
  152   2HH2  ARG  20          2HH2      ARG  20   7.551   9.600  15.665
  153    H    HIS  21           H        HIS  21   5.373  11.337   7.953
  154    HA   HIS  21           HA       HIS  21   3.550  13.301   6.761
  155   1HB   HIS  21          1HB       HIS  21   6.558  13.631   6.918
  156   2HB   HIS  21          2HB       HIS  21   5.466  14.671   6.018
  157    HD1  HIS  21           HD1      HIS  21   6.777  14.003   9.426
  158    HD2  HIS  21           HD2      HIS  21   3.932  16.447   7.618
  159    HE1  HIS  21           HE1      HIS  21   6.221  15.777  11.126
  160    HE2  HIS  21           HE2      HIS  21   4.458  17.216  10.037
  161    H    ALA  22           H        ALA  22   3.367  13.100   4.562
  162    HA   ALA  22           HA       ALA  22   5.267  11.356   3.164
  163   1HB   ALA  22          1HB       ALA  22   2.263  11.201   2.903
  164   2HB   ALA  22          2HB       ALA  22   3.425  10.314   1.917
  165   3HB   ALA  22          3HB       ALA  22   3.307   9.990   3.647
  166    H    LYS  23           H        LYS  23   6.093  12.384   1.452
  167    HA   LYS  23           HA       LYS  23   4.627  14.734   0.466
  168   1HB   LYS  23          1HB       LYS  23   7.594  14.160   0.422
  169   2HB   LYS  23          2HB       LYS  23   6.835  15.582  -0.281
  170   1HG   LYS  23          1HG       LYS  23   5.988  16.179   1.975
  171   2HG   LYS  23          2HG       LYS  23   6.900  14.820   2.631
  172   1HD   LYS  23          1HD       LYS  23   8.980  15.809   1.841
  173   2HD   LYS  23          2HD       LYS  23   8.085  17.148   1.117
  174   1HE   LYS  23          1HE       LYS  23   7.234  17.723   3.382
  175   2HE   LYS  23          2HE       LYS  23   8.276  16.469   4.049
  176   1HZ   LYS  23          1HZ       LYS  23   9.220  18.829   2.505
  177   2HZ   LYS  23          2HZ       LYS  23   9.263  18.688   4.196
  178   3HZ   LYS  23          3HZ       LYS  23  10.200  17.652   3.236
  179    H    VAL  24           H        VAL  24   3.515  14.173  -1.277
  180    HA   VAL  24           HA       VAL  24   4.858  12.627  -3.388
  181    HB   VAL  24           HB       VAL  24   1.941  13.420  -3.207
  182   1HG1  VAL  24          1HG1      VAL  24   2.676  13.052  -5.489
  183   2HG1  VAL  24          2HG1      VAL  24   3.371  11.495  -5.036
  184   3HG1  VAL  24          3HG1      VAL  24   1.626  11.734  -4.968
  185   1HG2  VAL  24          1HG2      VAL  24   3.251  10.782  -2.555
  186   2HG2  VAL  24          2HG2      VAL  24   2.508  11.891  -1.403
  187   3HG2  VAL  24          3HG2      VAL  24   1.513  11.077  -2.612
  188    H    ASN  25           H        ASN  25   5.682  13.700  -5.065
  189    HA   ASN  25           HA       ASN  25   6.345  15.406  -6.406
  190   1HB   ASN  25          1HB       ASN  25   3.568  16.486  -5.876
  191   2HB   ASN  25          2HB       ASN  25   4.684  17.130  -7.075
  192   1HD2  ASN  25          2HD2      ASN  25   2.046  16.001  -7.434
  193   2HD2  ASN  25          1HD2      ASN  25   2.235  14.685  -8.543
  194    H    GLU  26           H        GLU  26   4.286  17.524  -4.482
  195    HA   GLU  26           HA       GLU  26   6.502  18.145  -2.703
  196   1HB   GLU  26          1HB       GLU  26   6.366  20.540  -3.035
  197   2HB   GLU  26          2HB       GLU  26   6.731  19.756  -4.565
  198   1HG   GLU  26          1HG       GLU  26   4.483  20.044  -5.322
  199   2HG   GLU  26          2HG       GLU  26   3.979  20.640  -3.741
  200    H    GLN  27           H        GLN  27   3.543  17.118  -2.904
  201    HA   GLN  27           HA       GLN  27   2.289  18.983  -1.022
  202   1HB   GLN  27          1HB       GLN  27   1.096  18.375  -3.144
  203   2HB   GLN  27          2HB       GLN  27   1.029  16.713  -2.577
  204   1HG   GLN  27          1HG       GLN  27  -1.071  17.701  -2.130
  205   2HG   GLN  27          2HG       GLN  27  -0.237  17.527  -0.589
  206   1HE2  GLN  27          2HE2      GLN  27   0.500  20.004  -2.953
  207   2HE2  GLN  27          1HE2      GLN  27  -0.080  21.340  -2.010
  208    H    ILE  28           H        ILE  28   2.201  18.447   1.057
  209    HA   ILE  28           HA       ILE  28   2.981  15.792   1.905
  210    HB   ILE  28           HB       ILE  28   2.154  18.149   3.608
  211   1HG1  ILE  28          1HG1      ILE  28   4.931  17.225   2.826
  212   2HG1  ILE  28          2HG1      ILE  28   4.117  18.640   2.167
  213   1HG2  ILE  28          1HG2      ILE  28   3.649  15.617   4.293
  214   2HG2  ILE  28          2HG2      ILE  28   3.349  16.960   5.397
  215   3HG2  ILE  28          3HG2      ILE  28   1.999  16.014   4.769
  216   1HD1  ILE  28          1HD1      ILE  28   5.726  19.263   3.868
  217   2HD1  ILE  28          2HD1      ILE  28   4.085  19.651   4.386
  218   3HD1  ILE  28          3HD1      ILE  28   4.904  18.234   5.042
  219    H    LEU  29           H        LEU  29   1.456  14.283   1.732
  220    HA   LEU  29           HA       LEU  29  -1.318  14.964   2.389
  221   1HB   LEU  29          1HB       LEU  29  -0.167  12.490   1.091
  222   2HB   LEU  29          2HB       LEU  29  -1.872  12.785   1.370
  223    HG   LEU  29           HG       LEU  29  -0.096  14.429  -0.439
  224   1HD1  LEU  29          1HD1      LEU  29  -1.389  13.417  -2.255
  225   2HD1  LEU  29          2HD1      LEU  29  -0.497  12.203  -1.337
  226   3HD1  LEU  29          3HD1      LEU  29  -2.231  12.399  -1.086
  227   1HD2  LEU  29          1HD2      LEU  29  -3.078  14.533   0.017
  228   2HD2  LEU  29          2HD2      LEU  29  -1.908  15.731   0.571
  229   3HD2  LEU  29          3HD2      LEU  29  -2.171  15.488  -1.156
  230    H    GLN  30           H        GLN  30  -1.468  14.912   4.573
  231    HA   GLN  30           HA       GLN  30  -0.443  12.580   6.000
  232   1HB   GLN  30          1HB       GLN  30  -1.615  15.178   6.997
  233   2HB   GLN  30          2HB       GLN  30  -1.129  13.854   8.047
  234   1HG   GLN  30          1HG       GLN  30   1.170  14.049   7.146
  235   2HG   GLN  30          2HG       GLN  30   0.649  15.461   6.229
  236   1HE2  GLN  30          2HE2      GLN  30  -0.558  14.748   9.415
  237   2HE2  GLN  30          1HE2      GLN  30   0.252  16.045  10.232
  238    H    GLN  31           H        GLN  31  -2.238  11.582   4.527
  239    HA   GLN  31           HA       GLN  31  -4.608  11.232   6.236
  240   1HB   GLN  31          1HB       GLN  31  -4.624  11.273   3.209
  241   2HB   GLN  31          2HB       GLN  31  -6.004  10.949   4.239
  242   1HG   GLN  31          1HG       GLN  31  -5.787  13.265   5.133
  243   2HG   GLN  31          2HG       GLN  31  -4.540  13.551   3.914
  244   1HE2  GLN  31          2HE2      GLN  31  -5.124  13.520   1.717
  245   2HE2  GLN  31          1HE2      GLN  31  -6.766  13.728   1.199
  246    H    SER  32           H        SER  32  -5.828   9.216   4.992
  247    HA   SER  32           HA       SER  32  -3.795   7.139   4.591
  248   1HB   SER  32          1HB       SER  32  -5.558   6.791   6.389
  249   2HB   SER  32          2HB       SER  32  -6.754   6.732   5.092
  250    HG   SER  32           HG       SER  32  -5.390   4.738   5.994
  251    H    PHE  33           H        PHE  33  -3.398   6.726   2.511
  252    HA   PHE  33           HA       PHE  33  -5.549   6.953   0.557
  253   1HB   PHE  33          1HB       PHE  33  -4.259   8.473  -0.880
  254   2HB   PHE  33          2HB       PHE  33  -4.624   9.215   0.671
  255    HD1  PHE  33           HD1      PHE  33  -2.851   9.584   2.319
  256    HD2  PHE  33           HD2      PHE  33  -2.007   7.982  -1.532
  257    HE1  PHE  33           HE1      PHE  33  -0.467  10.097   2.633
  258    HE2  PHE  33           HE2      PHE  33   0.381   8.489  -1.222
  259    HZ   PHE  33           HZ       PHE  33   1.153   9.547   0.861
  260    H    ILE  34           H        ILE  34  -4.879   6.236  -1.603
  261    HA   ILE  34           HA       ILE  34  -2.752   4.198  -1.448
  262    HB   ILE  34           HB       ILE  34  -5.195   4.154  -3.233
  263   1HG1  ILE  34          1HG1      ILE  34  -4.607   2.479  -0.781
  264   2HG1  ILE  34          2HG1      ILE  34  -5.718   3.846  -0.812
  265   1HG2  ILE  34          1HG2      ILE  34  -4.509   1.856  -3.729
  266   2HG2  ILE  34          2HG2      ILE  34  -3.266   3.017  -4.194
  267   3HG2  ILE  34          3HG2      ILE  34  -3.078   2.066  -2.720
  268   1HD1  ILE  34          1HD1      ILE  34  -6.891   1.720  -0.958
  269   2HD1  ILE  34          2HD1      ILE  34  -7.118   2.681  -2.420
  270   3HD1  ILE  34          3HD1      ILE  34  -5.997   1.320  -2.424
  271    H    LEU  35           H        LEU  35  -1.034   4.695  -2.625
  272    HA   LEU  35           HA       LEU  35  -1.359   6.596  -4.841
  273   1HB   LEU  35          1HB       LEU  35   0.133   7.335  -3.055
  274   2HB   LEU  35          2HB       LEU  35   1.087   5.873  -3.225
  275    HG   LEU  35           HG       LEU  35   1.727   6.584  -5.510
  276   1HD1  LEU  35          1HD1      LEU  35   1.293   8.889  -6.209
  277   2HD1  LEU  35          2HD1      LEU  35  -0.203   7.974  -6.029
  278   3HD1  LEU  35          3HD1      LEU  35   0.279   9.128  -4.786
  279   1HD2  LEU  35          1HD2      LEU  35   3.254   8.361  -4.813
  280   2HD2  LEU  35          2HD2      LEU  35   2.323   8.581  -3.332
  281   3HD2  LEU  35          3HD2      LEU  35   3.180   7.066  -3.618
  282    H    MET  36           H        MET  36  -1.384   5.735  -6.775
  283    HA   MET  36           HA       MET  36   0.106   3.259  -7.304
  284   1HB   MET  36          1HB       MET  36  -1.879   4.671  -9.104
  285   2HB   MET  36          2HB       MET  36  -1.250   3.042  -9.294
  286   1HG   MET  36          1HG       MET  36  -3.022   3.966  -7.042
  287   2HG   MET  36          2HG       MET  36  -3.562   3.088  -8.471
  288   1HE   MET  36          1HE       MET  36  -2.941   0.585  -8.998
  289   2HE   MET  36          2HE       MET  36  -1.846  -0.386  -8.015
  290   3HE   MET  36          3HE       MET  36  -1.226   0.990  -8.928
  291    HA   PRO  37           HA       PRO  37   3.118   5.493  -9.725
  292   1HB   PRO  37          1HB       PRO  37   2.997   3.532 -11.896
  293   2HB   PRO  37          2HB       PRO  37   4.304   3.856 -10.757
  294   1HG   PRO  37          1HG       PRO  37   2.852   1.589 -10.661
  295   2HG   PRO  37          2HG       PRO  37   3.497   2.360  -9.200
  296   1HD   PRO  37          1HD       PRO  37   0.720   2.462 -10.327
  297   2HD   PRO  37          2HD       PRO  37   1.244   2.258  -8.640
  298    H    ASP  38           H        ASP  38   0.374   6.272 -10.194
  299    HA   ASP  38           HA       ASP  38   0.496   7.900 -12.425
  300   1HB   ASP  38          1HB       ASP  38   0.460   5.935 -13.852
  301   2HB   ASP  38          2HB       ASP  38  -0.920   5.277 -12.979
  302    H    GLU  39           H        GLU  39  -1.684   5.755 -10.672
  303    HA   GLU  39           HA       GLU  39  -3.784   7.793 -10.733
  304   1HB   GLU  39          1HB       GLU  39  -4.213   5.477 -11.591
  305   2HB   GLU  39          2HB       GLU  39  -3.960   4.877  -9.960
  306   1HG   GLU  39          1HG       GLU  39  -5.894   6.002  -9.164
  307   2HG   GLU  39          2HG       GLU  39  -6.078   6.880 -10.684
  308    H    LEU  40           H        LEU  40  -5.006   8.199  -8.745
  309    HA   LEU  40           HA       LEU  40  -3.546   7.559  -6.287
  310   1HB   LEU  40          1HB       LEU  40  -2.738   9.741  -6.983
  311   2HB   LEU  40          2HB       LEU  40  -4.381  10.324  -7.162
  312    HG   LEU  40           HG       LEU  40  -4.708  10.047  -4.713
  313   1HD1  LEU  40          1HD1      LEU  40  -3.035   8.327  -4.305
  314   2HD1  LEU  40          2HD1      LEU  40  -1.750   9.464  -4.713
  315   3HD1  LEU  40          3HD1      LEU  40  -2.749   9.738  -3.285
  316   1HD2  LEU  40          1HD2      LEU  40  -3.365  11.986  -4.067
  317   2HD2  LEU  40          2HD2      LEU  40  -2.403  11.808  -5.535
  318   3HD2  LEU  40          3HD2      LEU  40  -4.117  12.213  -5.645
  319    H    VAL  41           H        VAL  41  -4.866   6.862  -4.750
  320    HA   VAL  41           HA       VAL  41  -7.723   7.543  -4.865
  321    HB   VAL  41           HB       VAL  41  -6.303   5.561  -3.065
  322   1HG1  VAL  41          1HG1      VAL  41  -8.559   4.717  -2.588
  323   2HG1  VAL  41          2HG1      VAL  41  -8.362   6.397  -2.084
  324   3HG1  VAL  41          3HG1      VAL  41  -9.242   6.017  -3.564
  325   1HG2  VAL  41          1HG2      VAL  41  -7.278   3.826  -4.494
  326   2HG2  VAL  41          2HG2      VAL  41  -7.924   5.073  -5.562
  327   3HG2  VAL  41          3HG2      VAL  41  -6.180   4.868  -5.397
  328    H    GLU  42           H        GLU  42  -8.250   9.339  -3.795
  329    HA   GLU  42           HA       GLU  42  -6.320  10.523  -2.002
  330   1HB   GLU  42          1HB       GLU  42  -7.722  11.648  -3.884
  331   2HB   GLU  42          2HB       GLU  42  -8.995  11.708  -2.674
  332   1HG   GLU  42          1HG       GLU  42  -6.415  12.735  -1.754
  333   2HG   GLU  42          2HG       GLU  42  -7.120  13.633  -3.095
  334    H    HIS  43           H        HIS  43  -9.284   8.770  -1.723
  335    HA   HIS  43           HA       HIS  43  -9.252   9.305   1.173
  336   1HB   HIS  43          1HB       HIS  43 -11.675   9.124  -0.616
  337   2HB   HIS  43          2HB       HIS  43 -11.761   8.988   1.135
  338    HD1  HIS  43           HD1      HIS  43  -9.434  11.390   1.281
  339    HD2  HIS  43           HD2      HIS  43 -13.240  11.479  -0.389
  340    HE1  HIS  43           HE1      HIS  43 -10.124  13.804   1.300
  341    HE2  HIS  43           HE2      HIS  43 -12.328  13.852   0.088
  342    H    TRP  44           H        TRP  44  -8.391   7.467   1.941
  343    HA   TRP  44           HA       TRP  44  -9.876   4.992   1.342
  344   1HB   TRP  44          1HB       TRP  44  -7.415   5.025   0.702
  345   2HB   TRP  44          2HB       TRP  44  -7.051   5.147   2.419
  346    HD1  TRP  44           HD1      TRP  44  -9.651   2.802   0.747
  347    HE1  TRP  44           HE1      TRP  44  -9.042   0.374   1.358
  348    HE3  TRP  44           HE3      TRP  44  -5.299   3.676   3.285
  349    HZ2  TRP  44           HZ2      TRP  44  -6.977  -0.984   2.724
  350    HZ3  TRP  44           HZ3      TRP  44  -4.065   1.758   4.208
  351    HH2  TRP  44           HH2      TRP  44  -4.889  -0.523   3.933
  352    HA   PRO  45           HA       PRO  45 -11.317   5.830   5.454
  353   1HB   PRO  45          1HB       PRO  45 -12.785   3.313   5.262
  354   2HB   PRO  45          2HB       PRO  45 -13.401   4.966   5.298
  355   1HG   PRO  45          1HG       PRO  45 -13.514   3.426   3.083
  356   2HG   PRO  45          2HG       PRO  45 -13.315   5.187   3.009
  357   1HD   PRO  45          1HD       PRO  45 -11.244   3.034   2.738
  358   2HD   PRO  45          2HD       PRO  45 -11.461   4.516   1.779
  359    H    VAL  46           H        VAL  46  -8.748   4.606   5.486
  360    HA   VAL  46           HA       VAL  46  -9.139   2.910   7.863
  361    HB   VAL  46           HB       VAL  46  -6.949   2.471   5.820
  362   1HG1  VAL  46          1HG1      VAL  46  -6.456   0.452   7.129
  363   2HG1  VAL  46          2HG1      VAL  46  -6.244   1.923   8.080
  364   3HG1  VAL  46          3HG1      VAL  46  -7.681   0.927   8.306
  365   1HG2  VAL  46          1HG2      VAL  46  -9.091   1.746   4.932
  366   2HG2  VAL  46          2HG2      VAL  46  -8.089   0.351   5.328
  367   3HG2  VAL  46          3HG2      VAL  46  -9.408   0.823   6.400
  368    HA   PRO  47           HA       PRO  47  -6.516   6.585   8.827
  369   1HB   PRO  47          1HB       PRO  47  -8.054   6.801  11.276
  370   2HB   PRO  47          2HB       PRO  47  -7.948   7.941   9.935
  371   1HG   PRO  47          1HG       PRO  47 -10.202   6.527  10.525
  372   2HG   PRO  47          2HG       PRO  47  -9.797   7.081   8.891
  373   1HD   PRO  47          1HD       PRO  47  -9.455   4.367  10.112
  374   2HD   PRO  47          2HD       PRO  47 -10.010   4.809   8.482
  375    H    SER  48           H        SER  48  -7.211   3.649  10.410
  376    HA   SER  48           HA       SER  48  -4.632   3.680  11.720
  377   1HB   SER  48          1HB       SER  48  -7.174   3.215  13.314
  378   2HB   SER  48          2HB       SER  48  -5.528   3.037  13.922
  379    HG   SER  48           HG       SER  48  -5.677   5.438  12.851
  380    H    LEU  49           H        LEU  49  -4.044   1.495  12.502
  381    HA   LEU  49           HA       LEU  49  -4.586  -0.421  10.520
  382   1HB   LEU  49          1HB       LEU  49  -2.522  -0.328  11.882
  383   2HB   LEU  49          2HB       LEU  49  -3.438  -0.869  13.275
  384    HG   LEU  49           HG       LEU  49  -3.928  -2.993  12.103
  385   1HD1  LEU  49          1HD1      LEU  49  -2.690  -3.559  10.076
  386   2HD1  LEU  49          2HD1      LEU  49  -3.769  -2.190   9.806
  387   3HD1  LEU  49          3HD1      LEU  49  -2.038  -1.921  10.012
  388   1HD2  LEU  49          1HD2      LEU  49  -1.006  -2.291  12.332
  389   2HD2  LEU  49          2HD2      LEU  49  -2.049  -2.852  13.638
  390   3HD2  LEU  49          3HD2      LEU  49  -1.670  -3.925  12.290
  391    H    GLY  50           H        GLY  50  -6.061   0.161  13.637
  392   1HA   GLY  50          1HA       GLY  50  -7.448  -2.320  13.823
  393   2HA   GLY  50          2HA       GLY  50  -7.818  -0.857  14.722
  394    H    GLN  51           H        GLN  51  -7.861   0.225  11.696
  395    HA   GLN  51           HA       GLN  51 -10.742  -0.280  11.405
  396   1HB   GLN  51          1HB       GLN  51  -9.099   1.876  10.067
  397   2HB   GLN  51          2HB       GLN  51 -10.850   1.754  10.114
  398   1HG   GLN  51          1HG       GLN  51  -9.050   2.274  12.468
  399   2HG   GLN  51          2HG       GLN  51 -10.033   3.469  11.628
  400   1HE2  GLN  51          2HE2      GLN  51 -12.269   1.579  11.310
  401   2HE2  GLN  51          1HE2      GLN  51 -13.010   1.472  12.869
  402    H    LEU  52           H        LEU  52  -8.031  -1.628  10.373
  403    HA   LEU  52           HA       LEU  52  -8.562  -1.673   7.528
  404   1HB   LEU  52          1HB       LEU  52  -6.245  -1.694   8.357
  405   2HB   LEU  52          2HB       LEU  52  -6.545  -3.229   9.150
  406    HG   LEU  52           HG       LEU  52  -6.918  -4.290   6.959
  407   1HD1  LEU  52          1HD1      LEU  52  -6.167  -1.594   5.838
  408   2HD1  LEU  52          2HD1      LEU  52  -6.378  -3.077   4.907
  409   3HD1  LEU  52          3HD1      LEU  52  -7.755  -2.356   5.742
  410   1HD2  LEU  52          1HD2      LEU  52  -4.603  -4.216   6.184
  411   2HD2  LEU  52          2HD2      LEU  52  -4.319  -2.773   7.157
  412   3HD2  LEU  52          3HD2      LEU  52  -4.687  -4.309   7.944
  413    H    GLN  53           H        GLN  53 -10.588  -2.562   7.427
  414    HA   GLN  53           HA       GLN  53 -10.820  -5.386   8.199
  415   1HB   GLN  53          1HB       GLN  53 -12.992  -3.354   7.613
  416   2HB   GLN  53          2HB       GLN  53 -13.264  -5.030   8.077
  417   1HG   GLN  53          1HG       GLN  53 -12.232  -4.633  10.232
  418   2HG   GLN  53          2HG       GLN  53 -11.856  -2.976   9.771
  419   1HE2  GLN  53          2HE2      GLN  53 -14.434  -2.638   8.403
  420   2HE2  GLN  53          1HE2      GLN  53 -15.602  -2.434   9.663
  421    HA   PRO  54           HA       PRO  54 -10.738  -6.824   4.051
  422   1HB   PRO  54          1HB       PRO  54 -13.386  -8.102   4.578
  423   2HB   PRO  54          2HB       PRO  54 -11.901  -8.810   3.928
  424   1HG   PRO  54          1HG       PRO  54 -12.585  -9.279   6.439
  425   2HG   PRO  54          2HG       PRO  54 -10.892  -8.943   6.028
  426   1HD   PRO  54          1HD       PRO  54 -12.932  -7.149   7.285
  427   2HD   PRO  54          2HD       PRO  54 -11.200  -7.312   7.644
  428    H    ALA  55           H        ALA  55 -13.791  -5.420   5.131
  429    HA   ALA  55           HA       ALA  55 -14.879  -4.992   2.548
  430   1HB   ALA  55          1HB       ALA  55 -16.256  -5.053   4.569
  431   2HB   ALA  55          2HB       ALA  55 -15.504  -3.559   5.126
  432   3HB   ALA  55          3HB       ALA  55 -16.494  -3.556   3.667
  433    H    HIS  56           H        HIS  56 -12.469  -3.339   4.358
  434    HA   HIS  56           HA       HIS  56 -12.706  -0.916   2.736
  435   1HB   HIS  56          1HB       HIS  56 -10.964  -1.622   5.099
  436   2HB   HIS  56          2HB       HIS  56 -10.736  -0.152   4.160
  437    HD1  HIS  56           HD1      HIS  56 -11.457   0.032   7.143
  438    HD2  HIS  56           HD2      HIS  56 -14.247   0.064   4.057
  439    HE1  HIS  56           HE1      HIS  56 -13.492   1.163   8.080
  440    HE2  HIS  56           HE2      HIS  56 -15.237   0.943   6.277
  441    H    MET  57           H        MET  57 -10.868  -3.819   3.008
  442    HA   MET  57           HA       MET  57  -8.738  -2.922   1.267
  443   1HB   MET  57          1HB       MET  57  -8.498  -4.684   3.087
  444   2HB   MET  57          2HB       MET  57  -9.412  -5.765   2.044
  445   1HG   MET  57          1HG       MET  57  -7.050  -6.187   1.821
  446   2HG   MET  57          2HG       MET  57  -7.692  -5.534   0.314
  447   1HE   MET  57          1HE       MET  57  -4.026  -4.114   0.479
  448   2HE   MET  57          2HE       MET  57  -5.176  -5.065  -0.463
  449   3HE   MET  57          3HE       MET  57  -4.573  -5.681   1.076
  450    H    ASP  58           H        ASP  58 -11.877  -4.088   0.992
  451    HA   ASP  58           HA       ASP  58 -11.976  -5.641  -1.271
  452   1HB   ASP  58          1HB       ASP  58 -13.922  -5.218   0.116
  453   2HB   ASP  58          2HB       ASP  58 -13.915  -3.518  -0.338
  454    H    ALA  59           H        ALA  59 -12.034  -2.098  -1.082
  455    HA   ALA  59           HA       ALA  59 -12.334  -1.581  -3.814
  456   1HB   ALA  59          1HB       ALA  59 -11.526   0.658  -3.314
  457   2HB   ALA  59          2HB       ALA  59 -12.642   0.111  -2.064
  458   3HB   ALA  59          3HB       ALA  59 -10.905   0.105  -1.759
  459    H    VAL  60           H        VAL  60  -9.462  -2.164  -1.865
  460    HA   VAL  60           HA       VAL  60  -7.588  -1.447  -3.886
  461    HB   VAL  60           HB       VAL  60  -7.060  -3.338  -1.598
  462   1HG1  VAL  60          1HG1      VAL  60  -5.295  -1.385  -3.065
  463   2HG1  VAL  60          2HG1      VAL  60  -4.802  -2.398  -1.708
  464   3HG1  VAL  60          3HG1      VAL  60  -5.279  -3.141  -3.234
  465   1HG2  VAL  60          1HG2      VAL  60  -6.487  -1.387  -0.229
  466   2HG2  VAL  60          2HG2      VAL  60  -7.061  -0.323  -1.514
  467   3HG2  VAL  60          3HG2      VAL  60  -8.192  -1.392  -0.681
  468    H    LEU  61           H        LEU  61  -9.051  -4.458  -2.786
  469    HA   LEU  61           HA       LEU  61  -7.605  -6.173  -4.517
  470   1HB   LEU  61          1HB       LEU  61 -10.297  -6.538  -3.201
  471   2HB   LEU  61          2HB       LEU  61  -9.407  -7.808  -4.016
  472    HG   LEU  61           HG       LEU  61  -8.477  -6.332  -1.550
  473   1HD1  LEU  61          1HD1      LEU  61  -8.886  -8.436  -0.390
  474   2HD1  LEU  61          2HD1      LEU  61 -10.371  -7.804  -1.102
  475   3HD1  LEU  61          3HD1      LEU  61  -9.521  -9.141  -1.877
  476   1HD2  LEU  61          1HD2      LEU  61  -7.282  -8.693  -3.000
  477   2HD2  LEU  61          2HD2      LEU  61  -6.622  -7.057  -2.962
  478   3HD2  LEU  61          3HD2      LEU  61  -6.703  -8.010  -1.480
  479    H    ALA  62           H        ALA  62 -10.515  -4.272  -4.880
  480    HA   ALA  62           HA       ALA  62 -11.471  -5.494  -7.252
  481   1HB   ALA  62          1HB       ALA  62 -12.878  -4.097  -5.803
  482   2HB   ALA  62          2HB       ALA  62 -11.936  -2.681  -6.267
  483   3HB   ALA  62          3HB       ALA  62 -12.893  -3.539  -7.476
  484    H    LEU  63           H        LEU  63  -9.203  -2.877  -6.627
  485    HA   LEU  63           HA       LEU  63  -8.940  -2.047  -9.335
  486   1HB   LEU  63          1HB       LEU  63  -6.996  -1.778  -7.039
  487   2HB   LEU  63          2HB       LEU  63  -6.874  -0.934  -8.571
  488    HG   LEU  63           HG       LEU  63  -9.092  -0.592  -6.549
  489   1HD1  LEU  63          1HD1      LEU  63  -6.975   0.366  -5.807
  490   2HD1  LEU  63          2HD1      LEU  63  -6.829   1.239  -7.332
  491   3HD1  LEU  63          3HD1      LEU  63  -8.136   1.629  -6.215
  492   1HD2  LEU  63          1HD2      LEU  63  -9.798   1.271  -7.988
  493   2HD2  LEU  63          2HD2      LEU  63  -8.572   0.811  -9.169
  494   3HD2  LEU  63          3HD2      LEU  63  -9.910  -0.282  -8.814
  495    H    ASN  64           H        ASN  64  -7.590  -4.599  -7.456
  496    HA   ASN  64           HA       ASN  64  -6.219  -6.337  -7.876
  497   1HB   ASN  64          1HB       ASN  64  -7.065  -5.704 -10.695
  498   2HB   ASN  64          2HB       ASN  64  -5.972  -7.034 -10.330
  499   1HD2  ASN  64          2HD2      ASN  64  -9.207  -5.840 -10.112
  500   2HD2  ASN  64          1HD2      ASN  64  -9.936  -7.317  -9.585
  501    HA   PRO  65           HA       PRO  65  -2.420  -4.036  -8.862
  502   1HB   PRO  65          1HB       PRO  65  -1.578  -4.126  -6.167
  503   2HB   PRO  65          2HB       PRO  65  -2.193  -2.718  -7.032
  504   1HG   PRO  65          1HG       PRO  65  -3.446  -4.005  -4.888
  505   2HG   PRO  65          2HG       PRO  65  -4.203  -2.846  -5.993
  506   1HD   PRO  65          1HD       PRO  65  -4.309  -5.831  -6.006
  507   2HD   PRO  65          2HD       PRO  65  -5.568  -4.651  -6.438
  508    H    ALA  66           H        ALA  66  -0.261  -4.900  -8.770
  509    HA   ALA  66           HA       ALA  66  -0.222  -7.792  -8.539
  510   1HB   ALA  66          1HB       ALA  66   1.955  -5.879  -9.388
  511   2HB   ALA  66          2HB       ALA  66   2.006  -7.635  -9.529
  512   3HB   ALA  66          3HB       ALA  66   0.835  -6.710 -10.468
  513    H    VAL  67           H        VAL  67   1.057  -4.981  -6.921
  514    HA   VAL  67           HA       VAL  67   1.742  -6.646  -4.631
  515    HB   VAL  67           HB       VAL  67   3.857  -6.558  -5.773
  516   1HG1  VAL  67          1HG1      VAL  67   3.517  -3.568  -5.862
  517   2HG1  VAL  67          2HG1      VAL  67   4.964  -4.451  -6.349
  518   3HG1  VAL  67          3HG1      VAL  67   3.456  -4.674  -7.235
  519   1HG2  VAL  67          1HG2      VAL  67   5.261  -5.393  -4.127
  520   2HG2  VAL  67          2HG2      VAL  67   3.827  -4.588  -3.491
  521   3HG2  VAL  67          3HG2      VAL  67   3.983  -6.340  -3.365
  522    H    ILE  68           H        ILE  68   1.518  -5.582  -2.670
  523    HA   ILE  68           HA       ILE  68   0.617  -2.779  -2.812
  524    HB   ILE  68           HB       ILE  68  -0.665  -4.915  -1.095
  525   1HG1  ILE  68          1HG1      ILE  68  -1.781  -3.522  -3.540
  526   2HG1  ILE  68          2HG1      ILE  68  -1.181  -5.177  -3.516
  527   1HG2  ILE  68          1HG2      ILE  68  -0.709  -2.699  -0.090
  528   2HG2  ILE  68          2HG2      ILE  68  -1.402  -2.026  -1.566
  529   3HG2  ILE  68          3HG2      ILE  68  -2.327  -3.178  -0.601
  530   1HD1  ILE  68          1HD1      ILE  68  -3.604  -5.106  -3.399
  531   2HD1  ILE  68          2HD1      ILE  68  -2.919  -5.788  -1.923
  532   3HD1  ILE  68          3HD1      ILE  68  -3.516  -4.129  -1.933
  533    H    LEU  69           H        LEU  69   1.730  -1.523  -1.489
  534    HA   LEU  69           HA       LEU  69   3.135  -2.772   0.774
  535   1HB   LEU  69          1HB       LEU  69   3.762  -0.282  -0.808
  536   2HB   LEU  69          2HB       LEU  69   4.596  -0.728   0.668
  537    HG   LEU  69           HG       LEU  69   4.535  -2.462  -1.802
  538   1HD1  LEU  69          1HD1      LEU  69   6.813  -1.676  -2.200
  539   2HD1  LEU  69          2HD1      LEU  69   5.657  -0.348  -2.278
  540   3HD1  LEU  69          3HD1      LEU  69   6.668  -0.554  -0.847
  541   1HD2  LEU  69          1HD2      LEU  69   6.391  -3.612  -0.709
  542   2HD2  LEU  69          2HD2      LEU  69   6.245  -2.537   0.682
  543   3HD2  LEU  69          3HD2      LEU  69   4.940  -3.657   0.291
  544    H    LEU  70           H        LEU  70   2.336  -2.359   2.696
  545    HA   LEU  70           HA       LEU  70   0.519  -0.086   3.018
  546   1HB   LEU  70          1HB       LEU  70  -0.316  -2.298   3.672
  547   2HB   LEU  70          2HB       LEU  70   1.021  -2.482   4.790
  548    HG   LEU  70           HG       LEU  70   0.151  -0.537   6.083
  549   1HD1  LEU  70          1HD1      LEU  70  -2.210  -0.790   4.224
  550   2HD1  LEU  70          2HD1      LEU  70  -2.133   0.220   5.668
  551   3HD1  LEU  70          3HD1      LEU  70  -1.084   0.566   4.294
  552   1HD2  LEU  70          1HD2      LEU  70  -1.716  -1.747   7.095
  553   2HD2  LEU  70          2HD2      LEU  70  -1.775  -2.828   5.703
  554   3HD2  LEU  70          3HD2      LEU  70  -0.362  -2.824   6.757
  555    H    GLY  71           H        GLY  71   1.350   1.716   3.816
  556   1HA   GLY  71          1HA       GLY  71   3.728   1.525   5.546
  557   2HA   GLY  71          2HA       GLY  71   3.239   2.952   4.642
  558    H    THR  72           H        THR  72   2.625   0.988   7.469
  559    HA   THR  72           HA       THR  72   0.598   2.813   8.457
  560    HB   THR  72           HB       THR  72   0.911   1.174  10.526
  561    HG1  THR  72           HG1      THR  72   2.457  -0.206  10.013
  562   1HG2  THR  72          1HG2      THR  72  -0.404   0.355   7.933
  563   2HG2  THR  72          2HG2      THR  72  -0.756  -0.320   9.525
  564   3HG2  THR  72          3HG2      THR  72  -1.124   1.371   9.183
  565    H    GLY  73           H        GLY  73   1.990   4.692   8.573
  566   1HA   GLY  73          1HA       GLY  73   3.438   6.155   9.607
  567   2HA   GLY  73          2HA       GLY  73   2.853   5.402  11.081
  568    H    GLU  74           H        GLU  74   4.300   4.445  12.331
  569    HA   GLU  74           HA       GLU  74   6.715   3.327  11.093
  570   1HB   GLU  74          1HB       GLU  74   7.758   4.015  13.447
  571   2HB   GLU  74          2HB       GLU  74   7.774   5.096  12.065
  572   1HG   GLU  74          1HG       GLU  74   7.147   6.298  14.053
  573   2HG   GLU  74          2HG       GLU  74   5.784   6.229  12.941
  574    H    ARG  75           H        ARG  75   4.201   2.117  11.851
  575    HA   ARG  75           HA       ARG  75   5.102   0.330  14.022
  576   1HB   ARG  75          1HB       ARG  75   2.268   0.968  13.169
  577   2HB   ARG  75          2HB       ARG  75   2.729  -0.113  14.476
  578   1HG   ARG  75          1HG       ARG  75   3.380   2.819  14.399
  579   2HG   ARG  75          2HG       ARG  75   1.981   2.126  15.222
  580   1HD   ARG  75          1HD       ARG  75   3.266   1.126  16.847
  581   2HD   ARG  75          2HD       ARG  75   4.697   1.053  15.817
  582    HE   ARG  75           HE       ARG  75   4.796   3.546  16.117
  583   1HH1  ARG  75          1HH1      ARG  75   3.206   1.533  18.518
  584   2HH1  ARG  75          2HH1      ARG  75   3.580   2.610  19.835
  585   1HH2  ARG  75          1HH2      ARG  75   5.312   4.915  17.815
  586   2HH2  ARG  75          2HH2      ARG  75   4.810   4.535  19.440
  587    H    GLN  76           H        GLN  76   5.857  -1.508  13.130
  588    HA   GLN  76           HA       GLN  76   4.434  -2.598  10.814
  589   1HB   GLN  76          1HB       GLN  76   6.835  -2.550  10.524
  590   2HB   GLN  76          2HB       GLN  76   7.078  -3.398  12.045
  591   1HG   GLN  76          1HG       GLN  76   6.234  -5.415  11.180
  592   2HG   GLN  76          2HG       GLN  76   5.539  -4.613   9.774
  593   1HE2  GLN  76          2HE2      GLN  76   6.804  -4.168   8.030
  594   2HE2  GLN  76          1HE2      GLN  76   8.421  -4.766   7.846
  595    H    GLN  77           H        GLN  77   2.616  -3.391  11.663
  596    HA   GLN  77           HA       GLN  77   2.900  -5.695  13.467
  597   1HB   GLN  77          1HB       GLN  77   1.944  -3.904  14.782
  598   2HB   GLN  77          2HB       GLN  77   0.776  -3.539  13.520
  599   1HG   GLN  77          1HG       GLN  77  -0.283  -4.713  15.346
  600   2HG   GLN  77          2HG       GLN  77  -0.299  -5.701  13.887
  601   1HE2  GLN  77          2HE2      GLN  77  -0.511  -7.621  14.969
  602   2HE2  GLN  77          1HE2      GLN  77   0.754  -8.307  15.929
  603    H    PHE  78           H        PHE  78   1.933  -7.507  12.748
  604    HA   PHE  78           HA       PHE  78   0.753  -7.500  10.150
  605   1HB   PHE  78          1HB       PHE  78   0.464  -9.939  10.510
  606   2HB   PHE  78          2HB       PHE  78   2.110  -9.396  10.799
  607    HD1  PHE  78           HD1      PHE  78  -0.856 -10.897  12.242
  608    HD2  PHE  78           HD2      PHE  78   2.983  -9.278  13.105
  609    HE1  PHE  78           HE1      PHE  78  -0.902 -11.977  14.451
  610    HE2  PHE  78           HE2      PHE  78   2.942 -10.353  15.318
  611    HZ   PHE  78           HZ       PHE  78   0.997 -11.703  15.993
  612    HA   PRO  79           HA       PRO  79  -3.422  -6.892  11.618
  613   1HB   PRO  79          1HB       PRO  79  -4.309  -7.332   8.898
  614   2HB   PRO  79          2HB       PRO  79  -4.268  -5.824   9.812
  615   1HG   PRO  79          1HG       PRO  79  -2.659  -6.342   7.662
  616   2HG   PRO  79          2HG       PRO  79  -2.237  -5.217   8.965
  617   1HD   PRO  79          1HD       PRO  79  -1.331  -8.033   8.517
  618   2HD   PRO  79          2HD       PRO  79  -0.416  -6.627   9.104
  619    H    SER  80           H        SER  80  -5.613  -8.047  10.832
  620    HA   SER  80           HA       SER  80  -5.383 -10.740  11.665
  621   1HB   SER  80          1HB       SER  80  -7.393  -9.204  11.970
  622   2HB   SER  80          2HB       SER  80  -7.771  -9.509  10.276
  623    HG   SER  80           HG       SER  80  -8.760 -11.217  10.986
  624    H    THR  81           H        THR  81  -5.651 -12.649  10.504
  625    HA   THR  81           HA       THR  81  -4.340 -12.736   8.030
  626    HB   THR  81           HB       THR  81  -6.140 -14.913   9.093
  627    HG1  THR  81           HG1      THR  81  -3.703 -13.895  10.064
  628   1HG2  THR  81          1HG2      THR  81  -5.171 -15.294   6.871
  629   2HG2  THR  81          2HG2      THR  81  -3.561 -14.989   7.518
  630   3HG2  THR  81          3HG2      THR  81  -4.478 -16.393   8.063
  631    H    ASP  82           H        ASP  82  -7.654 -12.233   8.791
  632    HA   ASP  82           HA       ASP  82  -9.009 -13.229   6.589
  633   1HB   ASP  82          1HB       ASP  82  -9.637 -10.563   7.864
  634   2HB   ASP  82          2HB       ASP  82 -10.759 -11.674   7.087
  635    H    VAL  83           H        VAL  83  -7.324 -10.152   6.961
  636    HA   VAL  83           HA       VAL  83  -8.050  -9.237   4.326
  637    HB   VAL  83           HB       VAL  83  -6.009  -8.089   6.245
  638   1HG1  VAL  83          1HG1      VAL  83  -6.336  -6.009   4.994
  639   2HG1  VAL  83          2HG1      VAL  83  -5.717  -7.298   3.963
  640   3HG1  VAL  83          3HG1      VAL  83  -7.421  -6.849   3.885
  641   1HG2  VAL  83          1HG2      VAL  83  -7.770  -6.540   6.934
  642   2HG2  VAL  83          2HG2      VAL  83  -8.920  -7.378   5.891
  643   3HG2  VAL  83          3HG2      VAL  83  -8.217  -8.211   7.278
  644    H    LEU  84           H        LEU  84  -5.265 -10.674   5.899
  645    HA   LEU  84           HA       LEU  84  -3.404 -10.146   3.819
  646   1HB   LEU  84          1HB       LEU  84  -3.306 -12.208   6.020
  647   2HB   LEU  84          2HB       LEU  84  -1.953 -11.734   5.011
  648    HG   LEU  84           HG       LEU  84  -3.399  -9.943   6.964
  649   1HD1  LEU  84          1HD1      LEU  84  -2.048 -11.636   8.071
  650   2HD1  LEU  84          2HD1      LEU  84  -0.659 -11.193   7.077
  651   3HD1  LEU  84          3HD1      LEU  84  -1.317 -10.040   8.238
  652   1HD2  LEU  84          1HD2      LEU  84  -2.564  -8.694   5.047
  653   2HD2  LEU  84          2HD2      LEU  84  -1.610  -8.340   6.487
  654   3HD2  LEU  84          3HD2      LEU  84  -0.971  -9.423   5.251
  655    H    ALA  85           H        ALA  85  -5.312 -13.006   4.706
  656    HA   ALA  85           HA       ALA  85  -4.146 -14.810   2.914
  657   1HB   ALA  85          1HB       ALA  85  -5.576 -15.491   4.783
  658   2HB   ALA  85          2HB       ALA  85  -6.977 -14.813   3.953
  659   3HB   ALA  85          3HB       ALA  85  -6.120 -16.190   3.257
  660    H    ALA  86           H        ALA  86  -6.898 -12.625   2.503
  661    HA   ALA  86           HA       ALA  86  -7.790 -13.582   0.025
  662   1HB   ALA  86          1HB       ALA  86  -9.105 -12.088   1.454
  663   2HB   ALA  86          2HB       ALA  86  -7.980 -10.775   1.109
  664   3HB   ALA  86          3HB       ALA  86  -8.960 -11.458  -0.188
  665    H    CYS  87           H        CYS  87  -5.206 -11.379   0.855
  666    HA   CYS  87           HA       CYS  87  -4.804 -10.527  -1.874
  667   1HB   CYS  87          1HB       CYS  87  -3.023 -10.128   0.539
  668   2HB   CYS  87          2HB       CYS  87  -2.926  -9.259  -0.989
  669    HG   CYS  87           HG       CYS  87  -5.281  -8.961   1.460
  670    H    LEU  88           H        LEU  88  -3.145 -12.595   0.476
  671    HA   LEU  88           HA       LEU  88  -0.904 -13.183  -1.112
  672   1HB   LEU  88          1HB       LEU  88  -2.145 -14.756   1.142
  673   2HB   LEU  88          2HB       LEU  88  -0.565 -15.081   0.454
  674    HG   LEU  88           HG       LEU  88  -1.357 -12.526   1.855
  675   1HD1  LEU  88          1HD1      LEU  88   0.376 -14.811   2.782
  676   2HD1  LEU  88          2HD1      LEU  88   0.102 -13.299   3.648
  677   3HD1  LEU  88          3HD1      LEU  88  -1.234 -14.420   3.386
  678   1HD2  LEU  88          1HD2      LEU  88   0.339 -12.167   0.143
  679   2HD2  LEU  88          2HD2      LEU  88   1.032 -12.008   1.756
  680   3HD2  LEU  88          3HD2      LEU  88   1.313 -13.475   0.817
  681    H    THR  89           H        THR  89  -4.030 -14.802  -0.813
  682    HA   THR  89           HA       THR  89  -3.317 -17.161  -2.180
  683    HB   THR  89           HB       THR  89  -5.834 -17.332  -2.611
  684    HG1  THR  89           HG1      THR  89  -6.080 -15.262  -0.712
  685   1HG2  THR  89          1HG2      THR  89  -6.312 -17.838  -0.261
  686   2HG2  THR  89          2HG2      THR  89  -4.721 -18.438  -0.731
  687   3HG2  THR  89          3HG2      THR  89  -4.861 -16.962   0.225
  688    H    ARG  90           H        ARG  90  -4.457 -14.028  -3.332
  689    HA   ARG  90           HA       ARG  90  -4.756 -15.053  -6.037
  690   1HB   ARG  90          1HB       ARG  90  -5.070 -12.204  -5.087
  691   2HB   ARG  90          2HB       ARG  90  -5.608 -12.872  -6.622
  692   1HG   ARG  90          1HG       ARG  90  -7.006 -14.471  -5.103
  693   2HG   ARG  90          2HG       ARG  90  -6.767 -13.204  -3.899
  694   1HD   ARG  90          1HD       ARG  90  -8.146 -13.024  -6.560
  695   2HD   ARG  90          2HD       ARG  90  -8.805 -12.695  -4.962
  696    HE   ARG  90           HE       ARG  90  -6.634 -10.968  -5.757
  697   1HH1  ARG  90          1HH1      ARG  90 -10.099 -11.443  -5.647
  698   2HH1  ARG  90          2HH1      ARG  90 -10.465  -9.762  -5.938
  699   1HH2  ARG  90          1HH2      ARG  90  -7.117  -8.762  -6.164
  700   2HH2  ARG  90          2HH2      ARG  90  -8.769  -8.248  -6.251
  701    H    GLY  91           H        GLY  91  -2.143 -14.367  -4.329
  702   1HA   GLY  91          1HA       GLY  91   0.036 -14.196  -5.103
  703   2HA   GLY  91          2HA       GLY  91  -0.592 -13.893  -6.714
  704    H    ILE  92           H        ILE  92  -1.764 -11.979  -4.092
  705    HA   ILE  92           HA       ILE  92  -0.363  -9.666  -5.215
  706    HB   ILE  92           HB       ILE  92  -2.662  -9.707  -3.251
  707   1HG1  ILE  92          1HG1      ILE  92  -2.693  -9.200  -6.240
  708   2HG1  ILE  92          2HG1      ILE  92  -3.279 -10.663  -5.455
  709   1HG2  ILE  92          1HG2      ILE  92  -1.452  -7.471  -4.875
  710   2HG2  ILE  92          2HG2      ILE  92  -2.886  -7.336  -3.857
  711   3HG2  ILE  92          3HG2      ILE  92  -1.318  -7.687  -3.129
  712   1HD1  ILE  92          1HD1      ILE  92  -5.105  -9.181  -6.059
  713   2HD1  ILE  92          2HD1      ILE  92  -4.993  -9.362  -4.308
  714   3HD1  ILE  92          3HD1      ILE  92  -4.399  -7.894  -5.084
  715    H    GLY  93           H        GLY  93   1.426  -9.042  -4.227
  716   1HA   GLY  93          1HA       GLY  93   2.120 -10.059  -1.628
  717   2HA   GLY  93          2HA       GLY  93   3.108  -9.019  -2.644
  718    H    LEU  94           H        LEU  94   0.628  -9.129  -0.200
  719    HA   LEU  94           HA       LEU  94   0.720  -6.237   0.153
  720   1HB   LEU  94          1HB       LEU  94  -1.458  -7.226   0.345
  721   2HB   LEU  94          2HB       LEU  94  -0.878  -8.417   1.492
  722    HG   LEU  94           HG       LEU  94  -0.502  -6.622   3.148
  723   1HD1  LEU  94          1HD1      LEU  94  -1.803  -4.848   1.088
  724   2HD1  LEU  94          2HD1      LEU  94  -1.420  -4.395   2.748
  725   3HD1  LEU  94          3HD1      LEU  94  -0.122  -4.768   1.613
  726   1HD2  LEU  94          1HD2      LEU  94  -2.863  -6.181   3.622
  727   2HD2  LEU  94          2HD2      LEU  94  -3.288  -6.731   2.002
  728   3HD2  LEU  94          3HD2      LEU  94  -2.591  -7.862   3.163
  729    H    GLU  95           H        GLU  95   2.528  -5.557   1.134
  730    HA   GLU  95           HA       GLU  95   3.435  -7.060   3.500
  731   1HB   GLU  95          1HB       GLU  95   5.088  -5.258   1.722
  732   2HB   GLU  95          2HB       GLU  95   5.675  -6.188   3.093
  733   1HG   GLU  95          1HG       GLU  95   4.735  -8.220   1.765
  734   2HG   GLU  95          2HG       GLU  95   4.838  -7.119   0.390
  735    H    ALA  96           H        ALA  96   3.039  -6.112   5.353
  736    HA   ALA  96           HA       ALA  96   2.472  -3.276   5.497
  737   1HB   ALA  96          1HB       ALA  96   1.109  -4.877   6.759
  738   2HB   ALA  96          2HB       ALA  96   2.533  -5.351   7.685
  739   3HB   ALA  96          3HB       ALA  96   1.899  -3.710   7.821
  740    H    MET  97           H        MET  97   4.020  -1.837   5.716
  741    HA   MET  97           HA       MET  97   6.338  -2.463   7.417
  742   1HB   MET  97          1HB       MET  97   6.449  -1.047   4.742
  743   2HB   MET  97          2HB       MET  97   7.801  -1.253   5.842
  744   1HG   MET  97          1HG       MET  97   7.627  -3.691   5.554
  745   2HG   MET  97          2HG       MET  97   6.331  -3.436   4.386
  746   1HE   MET  97          1HE       MET  97   7.578  -4.786   2.492
  747   2HE   MET  97          2HE       MET  97   8.860  -5.158   3.643
  748   3HE   MET  97          3HE       MET  97   9.264  -4.519   2.050
  749    H    THR  98           H        THR  98   7.622  -0.124   7.444
  750    HA   THR  98           HA       THR  98   5.705   1.758   8.532
  751    HB   THR  98           HB       THR  98   7.664   3.093   9.166
  752    HG1  THR  98           HG1      THR  98   9.758   1.732   8.702
  753   1HG2  THR  98          1HG2      THR  98   8.037   0.157   9.779
  754   2HG2  THR  98          2HG2      THR  98   8.732   1.497  10.693
  755   3HG2  THR  98          3HG2      THR  98   6.984   1.270  10.652
  756    H    ASN  99           H        ASN  99   5.836   4.068   7.815
  757    HA   ASN  99           HA       ASN  99   5.327   4.362   5.095
  758   1HB   ASN  99          1HB       ASN  99   4.551   5.967   6.741
  759   2HB   ASN  99          2HB       ASN  99   6.203   6.410   7.146
  760   1HD2  ASN  99          2HD2      ASN  99   3.679   6.646   4.748
  761   2HD2  ASN  99          1HD2      ASN  99   4.353   7.992   3.901
  762    H    ALA 100           H        ALA 100   8.314   4.859   6.904
  763    HA   ALA 100           HA       ALA 100   9.822   5.861   4.706
  764   1HB   ALA 100          1HB       ALA 100  10.399   6.363   7.031
  765   2HB   ALA 100          2HB       ALA 100  10.793   4.664   7.295
  766   3HB   ALA 100          3HB       ALA 100  11.749   5.626   6.168
  767    H    ALA 101           H        ALA 101   9.331   2.643   6.083
  768    HA   ALA 101           HA       ALA 101  11.387   1.400   4.532
  769   1HB   ALA 101          1HB       ALA 101  10.614   0.438   6.641
  770   2HB   ALA 101          2HB       ALA 101   9.029   0.142   5.928
  771   3HB   ALA 101          3HB       ALA 101  10.447  -0.705   5.309
  772    H    ALA 102           H        ALA 102   7.890   1.773   4.187
  773    HA   ALA 102           HA       ALA 102   7.551   0.124   1.938
  774   1HB   ALA 102          1HB       ALA 102   5.449   1.310   1.595
  775   2HB   ALA 102          2HB       ALA 102   5.685   0.925   3.300
  776   3HB   ALA 102          3HB       ALA 102   5.964   2.568   2.720
  777    H    ALA 103           H        ALA 103   8.415   3.538   2.239
  778    HA   ALA 103           HA       ALA 103   8.324   4.261  -0.457
  779   1HB   ALA 103          1HB       ALA 103  10.269   5.230   1.630
  780   2HB   ALA 103          2HB       ALA 103   9.863   6.048   0.122
  781   3HB   ALA 103          3HB       ALA 103   8.640   5.855   1.377
  782    H    ARG 104           H        ARG 104  10.794   2.542   1.351
  783    HA   ARG 104           HA       ARG 104  12.867   2.683  -0.558
  784   1HB   ARG 104          1HB       ARG 104  12.257   0.771   1.684
  785   2HB   ARG 104          2HB       ARG 104  13.664   0.563   0.651
  786   1HG   ARG 104          1HG       ARG 104  14.637   2.569   1.390
  787   2HG   ARG 104          2HG       ARG 104  13.131   3.116   2.130
  788   1HD   ARG 104          1HD       ARG 104  13.299   1.554   3.880
  789   2HD   ARG 104          2HD       ARG 104  14.536   0.623   3.038
  790    HE   ARG 104           HE       ARG 104  16.120   1.999   3.923
  791   1HH1  ARG 104          1HH1      ARG 104  13.030   3.667   4.124
  792   2HH1  ARG 104          2HH1      ARG 104  13.679   5.003   5.028
  793   1HH2  ARG 104          1HH2      ARG 104  16.940   3.705   5.163
  794   2HH2  ARG 104          2HH2      ARG 104  15.896   5.009   5.642
  795    H    THR 105           H        THR 105  10.456   0.152   0.093
  796    HA   THR 105           HA       THR 105  11.288  -1.525  -2.034
  797    HB   THR 105           HB       THR 105   8.528  -1.497  -0.823
  798    HG1  THR 105           HG1      THR 105  10.501  -3.110   0.311
  799   1HG2  THR 105          1HG2      THR 105   8.896  -3.034  -2.701
  800   2HG2  THR 105          2HG2      THR 105  10.281  -3.731  -1.861
  801   3HG2  THR 105          3HG2      THR 105   8.659  -3.917  -1.193
  802    H    TYR 106           H        TYR 106   8.919   1.057  -1.734
  803    HA   TYR 106           HA       TYR 106   7.539   0.647  -4.143
  804   1HB   TYR 106          1HB       TYR 106   6.764   2.150  -2.330
  805   2HB   TYR 106          2HB       TYR 106   8.062   3.271  -2.726
  806    HD1  TYR 106           HD1      TYR 106   7.804   4.858  -4.461
  807    HD2  TYR 106           HD2      TYR 106   4.975   1.709  -4.053
  808    HE1  TYR 106           HE1      TYR 106   6.348   5.961  -6.109
  809    HE2  TYR 106           HE2      TYR 106   3.510   2.802  -5.700
  810    HH   TYR 106           HH       TYR 106   3.116   5.035  -6.627
  811    H    ASN 107           H        ASN 107  10.504   2.425  -3.419
  812    HA   ASN 107           HA       ASN 107  10.869   3.693  -5.880
  813   1HB   ASN 107          1HB       ASN 107  12.267   4.260  -3.995
  814   2HB   ASN 107          2HB       ASN 107  12.912   2.623  -3.923
  815   1HD2  ASN 107          2HD2      ASN 107  12.955   5.649  -5.639
  816   2HD2  ASN 107          1HD2      ASN 107  14.392   5.340  -6.556
  817    H    VAL 108           H        VAL 108  11.909   0.477  -4.812
  818    HA   VAL 108           HA       VAL 108  13.253  -0.232  -7.195
  819    HB   VAL 108           HB       VAL 108  11.932  -2.100  -5.217
  820   1HG1  VAL 108          1HG1      VAL 108  12.589  -3.200  -7.284
  821   2HG1  VAL 108          2HG1      VAL 108  14.217  -2.541  -7.135
  822   3HG1  VAL 108          3HG1      VAL 108  13.627  -3.709  -5.953
  823   1HG2  VAL 108          1HG2      VAL 108  14.102  -2.173  -4.083
  824   2HG2  VAL 108          2HG2      VAL 108  14.716  -0.936  -5.180
  825   3HG2  VAL 108          3HG2      VAL 108  13.410  -0.552  -4.059
  826    H    LEU 109           H        LEU 109   9.940  -0.735  -6.072
  827    HA   LEU 109           HA       LEU 109   9.136  -2.323  -8.287
  828   1HB   LEU 109          1HB       LEU 109   7.485  -0.716  -6.337
  829   2HB   LEU 109          2HB       LEU 109   6.846  -1.904  -7.459
  830    HG   LEU 109           HG       LEU 109   8.805  -2.517  -5.246
  831   1HD1  LEU 109          1HD1      LEU 109   6.641  -1.867  -4.348
  832   2HD1  LEU 109          2HD1      LEU 109   5.841  -3.023  -5.413
  833   3HD1  LEU 109          3HD1      LEU 109   6.917  -3.597  -4.139
  834   1HD2  LEU 109          1HD2      LEU 109   8.261  -4.854  -5.755
  835   2HD2  LEU 109          2HD2      LEU 109   7.265  -4.320  -7.109
  836   3HD2  LEU 109          3HD2      LEU 109   9.005  -4.039  -7.130
  837    H    ALA 110           H        ALA 110   9.177   1.119  -7.646
  838    HA   ALA 110           HA       ALA 110   7.541   1.943  -9.798
  839   1HB   ALA 110          1HB       ALA 110   8.548   4.144  -9.487
  840   2HB   ALA 110          2HB       ALA 110   8.118   3.423  -7.937
  841   3HB   ALA 110          3HB       ALA 110   9.800   3.436  -8.466
  842    H    SER 111           H        SER 111  11.038   1.419  -9.518
  843    HA   SER 111           HA       SER 111  11.581   2.187 -12.212
  844   1HB   SER 111          1HB       SER 111  13.794   0.958 -11.718
  845   2HB   SER 111          2HB       SER 111  13.410   2.385 -10.756
  846    HG   SER 111           HG       SER 111  12.676  -0.198  -9.874
  847    H    GLU 112           H        GLU 112  10.218  -0.575 -10.834
  848    HA   GLU 112           HA       GLU 112  10.996  -2.362 -12.981
  849   1HB   GLU 112          1HB       GLU 112   9.787  -2.633 -10.361
  850   2HB   GLU 112          2HB       GLU 112   8.878  -3.523 -11.576
  851   1HG   GLU 112          1HG       GLU 112  11.812  -3.807 -10.978
  852   2HG   GLU 112          2HG       GLU 112  10.530  -4.947 -10.556
  853    H    GLY 113           H        GLY 113   8.474  -0.147 -12.233
  854   1HA   GLY 113          1HA       GLY 113   6.677   0.564 -13.484
  855   2HA   GLY 113          2HA       GLY 113   7.279  -0.431 -14.802
  856    H    ARG 114           H        ARG 114   6.483  -1.624 -11.607
  857    HA   ARG 114           HA       ARG 114   4.464  -3.357 -12.830
  858   1HB   ARG 114          1HB       ARG 114   5.781  -3.506 -10.110
  859   2HB   ARG 114          2HB       ARG 114   4.621  -4.667 -10.740
  860   1HG   ARG 114          1HG       ARG 114   6.177  -5.218 -12.555
  861   2HG   ARG 114          2HG       ARG 114   7.345  -4.081 -11.881
  862   1HD   ARG 114          1HD       ARG 114   7.386  -5.392  -9.800
  863   2HD   ARG 114          2HD       ARG 114   6.262  -6.545 -10.519
  864    HE   ARG 114           HE       ARG 114   8.751  -6.072 -11.962
  865   1HH1  ARG 114          1HH1      ARG 114   6.959  -8.129  -9.743
  866   2HH1  ARG 114          2HH1      ARG 114   8.001  -9.505 -10.010
  867   1HH2  ARG 114          1HH2      ARG 114  10.079  -7.870 -12.305
  868   2HH2  ARG 114          2HH2      ARG 114   9.758  -9.363 -11.471
  869    H    ARG 115           H        ARG 115   2.418  -3.704 -11.678
  870    HA   ARG 115           HA       ARG 115   1.316  -1.170 -10.896
  871   1HB   ARG 115          1HB       ARG 115   0.177  -3.082 -12.260
  872   2HB   ARG 115          2HB       ARG 115  -0.184  -3.760 -10.678
  873   1HG   ARG 115          1HG       ARG 115  -2.062  -2.464 -11.467
  874   2HG   ARG 115          2HG       ARG 115  -1.336  -1.671 -10.067
  875   1HD   ARG 115          1HD       ARG 115  -0.135  -0.143 -11.553
  876   2HD   ARG 115          2HD       ARG 115  -0.843  -0.942 -12.955
  877    HE   ARG 115           HE       ARG 115  -2.900  -0.026 -11.255
  878   1HH1  ARG 115          1HH1      ARG 115  -0.444   1.175 -13.443
  879   2HH1  ARG 115          2HH1      ARG 115  -1.356   2.587 -13.903
  880   1HH2  ARG 115          1HH2      ARG 115  -4.094   1.863 -11.805
  881   2HH2  ARG 115          2HH2      ARG 115  -3.427   2.987 -12.962
  882    H    VAL 116           H        VAL 116   2.351  -0.651  -9.006
  883    HA   VAL 116           HA       VAL 116   1.882  -2.384  -6.691
  884    HB   VAL 116           HB       VAL 116   4.202  -1.835  -6.943
  885   1HG1  VAL 116          1HG1      VAL 116   5.031   0.476  -6.959
  886   2HG1  VAL 116          2HG1      VAL 116   4.010   0.130  -8.355
  887   3HG1  VAL 116          3HG1      VAL 116   3.369   1.063  -7.002
  888   1HG2  VAL 116          1HG2      VAL 116   3.372  -1.863  -4.652
  889   2HG2  VAL 116          2HG2      VAL 116   4.682  -0.696  -4.830
  890   3HG2  VAL 116          3HG2      VAL 116   3.011  -0.140  -4.749
  891    H    ALA 117           H        ALA 117   0.528  -1.817  -5.133
  892    HA   ALA 117           HA       ALA 117  -0.718   0.839  -5.252
  893   1HB   ALA 117          1HB       ALA 117  -1.601  -1.654  -3.792
  894   2HB   ALA 117          2HB       ALA 117  -2.478  -0.125  -3.847
  895   3HB   ALA 117          3HB       ALA 117  -2.252  -1.066  -5.322
  896    H    LEU 118           H        LEU 118   0.382   2.259  -4.043
  897    HA   LEU 118           HA       LEU 118   1.693   1.372  -1.603
  898   1HB   LEU 118          1HB       LEU 118   2.778   2.939  -3.244
  899   2HB   LEU 118          2HB       LEU 118   1.597   4.148  -2.782
  900    HG   LEU 118           HG       LEU 118   2.454   4.035  -0.451
  901   1HD1  LEU 118          1HD1      LEU 118   4.570   2.278  -1.686
  902   2HD1  LEU 118          2HD1      LEU 118   4.610   2.942  -0.054
  903   3HD1  LEU 118          3HD1      LEU 118   3.362   1.782  -0.502
  904   1HD2  LEU 118          1HD2      LEU 118   4.535   5.249  -0.907
  905   2HD2  LEU 118          2HD2      LEU 118   4.490   4.691  -2.580
  906   3HD2  LEU 118          3HD2      LEU 118   3.230   5.766  -1.974
  907    H    ALA 119           H        ALA 119   0.065   0.950  -0.171
  908    HA   ALA 119           HA       ALA 119  -1.992   2.939   0.328
  909   1HB   ALA 119          1HB       ALA 119  -2.589   0.559   0.332
  910   2HB   ALA 119          2HB       ALA 119  -1.487   0.288   1.682
  911   3HB   ALA 119          3HB       ALA 119  -2.907   1.311   1.895
  912    H    MET 120           H        MET 120  -1.283   4.667   1.397
  913    HA   MET 120           HA       MET 120   0.660   4.262   3.561
  914   1HB   MET 120          1HB       MET 120   0.064   6.613   1.790
  915   2HB   MET 120          2HB       MET 120   0.924   6.815   3.309
  916   1HG   MET 120          1HG       MET 120   1.790   5.068   1.018
  917   2HG   MET 120          2HG       MET 120   2.447   6.654   1.421
  918   1HE   MET 120          1HE       MET 120   4.936   5.980   1.696
  919   2HE   MET 120          2HE       MET 120   4.459   4.421   1.026
  920   3HE   MET 120          3HE       MET 120   5.457   4.488   2.479
  921    H    ILE 121           H        ILE 121  -0.152   4.231   5.513
  922    HA   ILE 121           HA       ILE 121  -2.429   5.963   6.161
  923    HB   ILE 121           HB       ILE 121  -1.115   3.825   7.860
  924   1HG1  ILE 121          1HG1      ILE 121  -3.730   3.796   6.332
  925   2HG1  ILE 121          2HG1      ILE 121  -2.283   2.888   5.908
  926   1HG2  ILE 121          1HG2      ILE 121  -3.639   5.420   8.299
  927   2HG2  ILE 121          2HG2      ILE 121  -3.067   4.101   9.323
  928   3HG2  ILE 121          3HG2      ILE 121  -2.131   5.590   9.197
  929   1HD1  ILE 121          1HD1      ILE 121  -3.940   1.480   6.988
  930   2HD1  ILE 121          2HD1      ILE 121  -2.478   1.606   7.967
  931   3HD1  ILE 121          3HD1      ILE 121  -3.917   2.525   8.407
  932    H    VAL 122           H        VAL 122  -1.560   7.944   6.316
  933    HA   VAL 122           HA       VAL 122   1.024   8.295   7.620
  934    HB   VAL 122           HB       VAL 122  -0.681  10.336   6.184
  935   1HG1  VAL 122          1HG1      VAL 122   1.375  11.654   6.085
  936   2HG1  VAL 122          2HG1      VAL 122   0.896  11.330   7.751
  937   3HG1  VAL 122          3HG1      VAL 122   2.215  10.416   7.020
  938   1HG2  VAL 122          1HG2      VAL 122   1.665   8.728   5.175
  939   2HG2  VAL 122          2HG2      VAL 122  -0.017   8.541   4.678
  940   3HG2  VAL 122          3HG2      VAL 122   0.853  10.028   4.300
  941    H    GLY 123           H        GLY 123   1.090   8.683   9.709
  942   1HA   GLY 123          1HA       GLY 123  -0.198  10.847  10.930
  943   2HA   GLY 123          2HA       GLY 123  -1.115   9.393  11.296
  944    H    GLY 124           H        GLY 124  -0.192  10.568  13.426
  945   1HA   GLY 124          1HA       GLY 124   2.376   9.328  14.123
  946   2HA   GLY 124          2HA       GLY 124   1.552  10.579  15.046
  947    H    LEU 125           H        LEU 125   2.205   7.301  14.827
  948    HA   LEU 125           HA       LEU 125  -0.196   6.464  16.258
  949   1HB   LEU 125          1HB       LEU 125   2.171   4.919  15.204
  950   2HB   LEU 125          2HB       LEU 125   0.896   4.187  16.153
  951    HG   LEU 125           HG       LEU 125   0.377   3.662  13.935
  952   1HD1  LEU 125          1HD1      LEU 125  -1.703   4.843  13.474
  953   2HD1  LEU 125          2HD1      LEU 125  -1.547   4.452  15.186
  954   3HD1  LEU 125          3HD1      LEU 125  -1.250   6.099  14.629
  955   1HD2  LEU 125          1HD2      LEU 125   1.903   5.163  12.807
  956   2HD2  LEU 125          2HD2      LEU 125   0.288   5.299  12.112
  957   3HD2  LEU 125          3HD2      LEU 125   0.883   6.544  13.211
  958    H    GLU 126           H        GLU 126   2.877   7.621  16.945
  959    HA   GLU 126           HA       GLU 126   3.623   6.225  19.249
  960   1HB   GLU 126          1HB       GLU 126   4.022   9.176  18.751
  961   2HB   GLU 126          2HB       GLU 126   4.989   8.140  19.789
  962   1HG   GLU 126          1HG       GLU 126   5.850   6.954  17.891
  963   2HG   GLU 126          2HG       GLU 126   4.773   7.837  16.806
  964    H    HIS 127           H        HIS 127   1.492   8.995  18.796
  965    HA   HIS 127           HA       HIS 127  -0.079   9.990  20.107
  966   1HB   HIS 127          1HB       HIS 127  -0.756   7.547  20.414
  967   2HB   HIS 127          2HB       HIS 127   0.127   7.585  21.933
  968    HD1  HIS 127           HD1      HIS 127  -1.093   8.455  23.938
  969    HD2  HIS 127           HD2      HIS 127  -3.048   9.315  20.368
  970    HE1  HIS 127           HE1      HIS 127  -3.350   9.350  24.595
  971    HE2  HIS 127           HE2      HIS 127  -4.582   9.677  22.419
  972    H    HIS 128           H        HIS 128   2.797  10.342  20.533
  973    HA   HIS 128           HA       HIS 128   3.227  10.509  23.377
  974   1HB   HIS 128          1HB       HIS 128   5.016   9.929  21.708
  975   2HB   HIS 128          2HB       HIS 128   4.970  11.602  21.163
  976    HD1  HIS 128           HD1      HIS 128   6.833  12.905  22.141
  977    HD2  HIS 128           HD2      HIS 128   5.438   9.988  24.757
  978    HE1  HIS 128           HE1      HIS 128   8.242  13.120  24.210
  979    HE2  HIS 128           HE2      HIS 128   7.230  11.496  25.855
  980    H    HIS 129           H        HIS 129   1.718  12.474  21.130
  981    HA   HIS 129           HA       HIS 129   2.267  14.894  22.703
  982   1HB   HIS 129          1HB       HIS 129   2.626  15.010  20.217
  983   2HB   HIS 129          2HB       HIS 129   0.901  14.722  20.006
  984    HD1  HIS 129           HD1      HIS 129   3.364  17.337  20.997
  985    HD2  HIS 129           HD2      HIS 129  -0.761  16.911  20.669
  986    HE1  HIS 129           HE1      HIS 129   2.424  19.662  21.184
  987    HE2  HIS 129           HE2      HIS 129  -0.072  19.340  21.248
  988    H    HIS 130           H        HIS 130   0.776  15.649  24.019
  989    HA   HIS 130           HA       HIS 130  -1.627  14.416  24.632
  990   1HB   HIS 130          1HB       HIS 130  -0.600  15.969  26.165
  991   2HB   HIS 130          2HB       HIS 130  -0.754  17.287  25.013
  992    HD1  HIS 130           HD1      HIS 130  -2.757  15.244  27.453
  993    HD2  HIS 130           HD2      HIS 130  -3.225  18.560  24.982
  994    HE1  HIS 130           HE1      HIS 130  -4.941  16.300  28.130
  995    HE2  HIS 130           HE2      HIS 130  -5.074  18.432  26.786
  996    H    HIS 131           H        HIS 131  -3.303  14.087  23.352
  997    HA   HIS 131           HA       HIS 131  -3.942  15.997  21.233
  998   1HB   HIS 131          1HB       HIS 131  -3.889  13.535  20.761
  999   2HB   HIS 131          2HB       HIS 131  -5.250  13.334  21.857
 1000    HD1  HIS 131           HD1      HIS 131  -4.373  14.355  18.400
 1001    HD2  HIS 131           HD2      HIS 131  -7.728  14.365  20.866
 1002    HE1  HIS 131           HE1      HIS 131  -6.332  14.775  16.885
 1003    HE2  HIS 131           HE2      HIS 131  -8.325  14.958  18.416
 1004    H    HIS 132           H        HIS 132  -5.892  17.111  21.100
 1005    HA   HIS 132           HA       HIS 132  -7.213  17.543  23.651
 1006   1HB   HIS 132          1HB       HIS 132  -7.584  18.887  20.962
 1007   2HB   HIS 132          2HB       HIS 132  -8.415  19.359  22.441
 1008    HD1  HIS 132           HD1      HIS 132  -5.803  20.536  20.470
 1009    HD2  HIS 132           HD2      HIS 132  -6.157  19.777  24.549
 1010    HE1  HIS 132           HE1      HIS 132  -4.013  21.912  21.581
 1011    HE2  HIS 132           HE2      HIS 132  -4.388  21.594  24.054
  Start of MODEL    6
    1   1H    MET   1          1HT       MET   1 -12.402  24.505 -27.010
    2   2H    MET   1          2HT       MET   1 -11.421  23.430 -27.874
    3   3H    MET   1          3HT       MET   1 -12.350  24.581 -28.703
    4    HA   MET   1           HA       MET   1 -11.061  26.363 -27.849
    5   1HB   MET   1          1HB       MET   1  -9.626  24.186 -26.317
    6   2HB   MET   1          2HB       MET   1  -9.027  25.829 -26.475
    7   1HG   MET   1          1HG       MET   1 -10.983  26.676 -25.316
    8   2HG   MET   1          2HG       MET   1 -11.631  25.040 -25.195
    9   1HE   MET   1          1HE       MET   1 -11.925  25.405 -22.559
   10   2HE   MET   1          2HE       MET   1 -11.255  27.029 -22.719
   11   3HE   MET   1          3HE       MET   1 -10.614  25.926 -21.501
   12    HA   PRO   2           HA       PRO   2  -8.332  25.596 -31.306
   13   1HB   PRO   2          1HB       PRO   2  -6.630  27.741 -30.213
   14   2HB   PRO   2          2HB       PRO   2  -7.467  27.656 -31.765
   15   1HG   PRO   2          1HG       PRO   2  -8.286  29.303 -29.811
   16   2HG   PRO   2          2HG       PRO   2  -9.432  28.506 -30.905
   17   1HD   PRO   2          1HD       PRO   2  -8.709  27.818 -28.084
   18   2HD   PRO   2          2HD       PRO   2 -10.297  27.788 -28.882
   19    H    LEU   3           H        LEU   3  -6.953  26.184 -28.100
   20    HA   LEU   3           HA       LEU   3  -4.956  24.081 -28.629
   21   1HB   LEU   3          1HB       LEU   3  -4.619  26.566 -26.937
   22   2HB   LEU   3          2HB       LEU   3  -3.435  25.285 -27.103
   23    HG   LEU   3           HG       LEU   3  -4.371  27.067 -29.355
   24   1HD1  LEU   3          1HD1      LEU   3  -2.172  28.106 -29.180
   25   2HD1  LEU   3          2HD1      LEU   3  -3.084  28.297 -27.682
   26   3HD1  LEU   3          3HD1      LEU   3  -1.798  27.094 -27.784
   27   1HD2  LEU   3          1HD2      LEU   3  -2.497  26.091 -30.589
   28   2HD2  LEU   3          2HD2      LEU   3  -2.147  25.032 -29.223
   29   3HD2  LEU   3          3HD2      LEU   3  -3.661  24.854 -30.110
   30    H    ASN   4           H        ASN   4  -3.988  23.580 -26.212
   31    HA   ASN   4           HA       ASN   4  -4.324  22.668 -24.161
   32   1HB   ASN   4          1HB       ASN   4  -6.731  24.493 -24.178
   33   2HB   ASN   4          2HB       ASN   4  -6.260  23.525 -22.785
   34   1HD2  ASN   4          2HD2      ASN   4  -4.391  24.055 -21.656
   35   2HD2  ASN   4          1HD2      ASN   4  -3.609  25.592 -21.832
   36    H    GLN   5           H        GLN   5  -5.521  21.443 -26.613
   37    HA   GLN   5           HA       GLN   5  -7.848  20.087 -25.475
   38   1HB   GLN   5          1HB       GLN   5  -6.701  19.964 -28.266
   39   2HB   GLN   5          2HB       GLN   5  -8.160  19.142 -27.733
   40   1HG   GLN   5          1HG       GLN   5  -7.771  22.128 -27.720
   41   2HG   GLN   5          2HG       GLN   5  -8.575  21.226 -28.998
   42   1HE2  GLN   5          2HE2      GLN   5  -8.923  20.492 -25.572
   43   2HE2  GLN   5          1HE2      GLN   5 -10.579  20.973 -25.449
   44    H    GLU   6           H        GLU   6  -4.655  19.675 -25.274
   45    HA   GLU   6           HA       GLU   6  -4.745  16.756 -25.497
   46   1HB   GLU   6          1HB       GLU   6  -2.345  16.775 -25.207
   47   2HB   GLU   6          2HB       GLU   6  -2.776  17.944 -26.444
   48   1HG   GLU   6          1HG       GLU   6  -2.095  18.589 -23.581
   49   2HG   GLU   6          2HG       GLU   6  -1.013  18.758 -24.961
   50    H    HIS   7           H        HIS   7  -4.529  19.361 -23.210
   51    HA   HIS   7           HA       HIS   7  -4.839  19.506 -20.980
   52   1HB   HIS   7          1HB       HIS   7  -6.117  16.794 -21.366
   53   2HB   HIS   7          2HB       HIS   7  -6.161  17.693 -19.853
   54    HD1  HIS   7           HD1      HIS   7  -8.398  16.956 -22.329
   55    HD2  HIS   7           HD2      HIS   7  -7.087  20.589 -20.786
   56    HE1  HIS   7           HE1      HIS   7 -10.181  18.633 -22.923
   57    HE2  HIS   7           HE2      HIS   7  -9.264  20.855 -22.152
   58    HA   PRO   8           HA       PRO   8  -0.898  17.293 -20.187
   59   1HB   PRO   8          1HB       PRO   8   0.142  19.351 -18.712
   60   2HB   PRO   8          2HB       PRO   8   0.284  19.233 -20.469
   61   1HG   PRO   8          1HG       PRO   8  -1.642  20.829 -18.826
   62   2HG   PRO   8          2HG       PRO   8  -0.768  21.297 -20.297
   63   1HD   PRO   8          1HD       PRO   8  -3.357  20.560 -20.347
   64   2HD   PRO   8          2HD       PRO   8  -2.247  20.187 -21.681
   65    H    ASP   9           H        ASP   9  -1.147  15.779 -18.671
   66    HA   ASP   9           HA       ASP   9  -2.358  16.509 -16.107
   67   1HB   ASP   9          1HB       ASP   9  -2.745  14.152 -15.759
   68   2HB   ASP   9          2HB       ASP   9  -3.304  14.577 -17.372
   69    H    TYR  10           H        TYR  10  -1.361  16.036 -14.146
   70    HA   TYR  10           HA       TYR  10   1.534  15.531 -14.334
   71   1HB   TYR  10          1HB       TYR  10   0.006  17.106 -12.246
   72   2HB   TYR  10          2HB       TYR  10   1.738  16.795 -12.211
   73    HD1  TYR  10           HD1      TYR  10  -0.865  18.934 -13.441
   74    HD2  TYR  10           HD2      TYR  10   3.166  17.741 -14.087
   75    HE1  TYR  10           HE1      TYR  10  -0.482  20.973 -14.760
   76    HE2  TYR  10           HE2      TYR  10   3.562  19.777 -15.409
   77    HH   TYR  10           HH       TYR  10   2.236  21.410 -16.733
   78    H    THR  11           H        THR  11   1.994  13.520 -13.745
   79    HA   THR  11           HA       THR  11   0.314  11.926 -12.092
   80    HB   THR  11           HB       THR  11   3.215  11.418 -12.790
   81    HG1  THR  11           HG1      THR  11   0.962  11.464 -14.360
   82   1HG2  THR  11          1HG2      THR  11   2.592   9.062 -12.545
   83   2HG2  THR  11          2HG2      THR  11   2.284   9.952 -11.052
   84   3HG2  THR  11          3HG2      THR  11   0.947   9.535 -12.124
   85    H    TYR  12           H        TYR  12   0.264  11.777  -9.934
   86    HA   TYR  12           HA       TYR  12   1.687  13.534  -8.272
   87   1HB   TYR  12          1HB       TYR  12   0.114  11.041  -7.605
   88   2HB   TYR  12          2HB       TYR  12   0.740  12.158  -6.398
   89    HD1  TYR  12           HD1      TYR  12  -0.133  14.500  -6.329
   90    HD2  TYR  12           HD2      TYR  12  -1.896  11.503  -8.782
   91    HE1  TYR  12           HE1      TYR  12  -2.177  15.854  -6.505
   92    HE2  TYR  12           HE2      TYR  12  -3.943  12.853  -8.968
   93    HH   TYR  12           HH       TYR  12  -5.100  14.632  -7.620
   94    H    ALA  13           H        ALA  13   3.735  13.454  -7.703
   95    HA   ALA  13           HA       ALA  13   5.055  10.834  -7.486
   96   1HB   ALA  13          1HB       ALA  13   6.015  12.304  -9.191
   97   2HB   ALA  13          2HB       ALA  13   6.295  13.543  -7.967
   98   3HB   ALA  13          3HB       ALA  13   7.158  12.008  -7.880
   99    H    LEU  14           H        LEU  14   5.473  10.164  -5.504
  100    HA   LEU  14           HA       LEU  14   5.123  11.802  -3.204
  101   1HB   LEU  14          1HB       LEU  14   4.640   9.420  -3.154
  102   2HB   LEU  14          2HB       LEU  14   6.311   9.047  -3.527
  103    HG   LEU  14           HG       LEU  14   6.989  10.016  -1.352
  104   1HD1  LEU  14          1HD1      LEU  14   4.018  10.230  -0.881
  105   2HD1  LEU  14          2HD1      LEU  14   5.272  10.461   0.337
  106   3HD1  LEU  14          3HD1      LEU  14   5.151  11.573  -1.025
  107   1HD2  LEU  14          1HD2      LEU  14   4.904   7.848  -1.200
  108   2HD2  LEU  14          2HD2      LEU  14   6.610   7.626  -1.589
  109   3HD2  LEU  14          3HD2      LEU  14   6.137   8.184   0.015
  110    H    ARG  15           H        ARG  15   6.574  12.993  -2.109
  111    HA   ARG  15           HA       ARG  15   9.334  12.949  -3.108
  112   1HB   ARG  15          1HB       ARG  15   8.002  15.071  -3.322
  113   2HB   ARG  15          2HB       ARG  15   7.956  15.160  -1.569
  114   1HG   ARG  15          1HG       ARG  15  10.560  15.028  -3.048
  115   2HG   ARG  15          2HG       ARG  15   9.706  16.553  -2.826
  116   1HD   ARG  15          1HD       ARG  15   9.807  16.308  -0.427
  117   2HD   ARG  15          2HD       ARG  15  10.526  14.707  -0.587
  118    HE   ARG  15           HE       ARG  15  12.137  16.599  -1.920
  119   1HH1  ARG  15          1HH1      ARG  15  11.235  15.574   1.307
  120   2HH1  ARG  15          2HH1      ARG  15  12.707  16.135   2.036
  121   1HH2  ARG  15          1HH2      ARG  15  14.084  17.329  -0.949
  122   2HH2  ARG  15          2HH2      ARG  15  14.313  17.125   0.760
  123    H    ALA  16           H        ALA  16   7.546  13.471  -0.051
  124    HA   ALA  16           HA       ALA  16   9.961  12.522   1.349
  125   1HB   ALA  16          1HB       ALA  16   9.595  14.918   1.665
  126   2HB   ALA  16          2HB       ALA  16   7.989  14.586   2.311
  127   3HB   ALA  16          3HB       ALA  16   9.420  14.027   3.176
  128    H    ALA  17           H        ALA  17   9.756  10.913   2.728
  129    HA   ALA  17           HA       ALA  17   7.166  10.333   3.955
  130   1HB   ALA  17          1HB       ALA  17   7.316   8.835   2.016
  131   2HB   ALA  17          2HB       ALA  17   8.872   8.242   2.596
  132   3HB   ALA  17          3HB       ALA  17   7.408   7.935   3.530
  133    H    ASP  18           H        ASP  18   7.597  10.560   6.056
  134    HA   ASP  18           HA       ASP  18  10.150   9.520   7.095
  135   1HB   ASP  18          1HB       ASP  18  10.023  12.089   6.668
  136   2HB   ASP  18          2HB       ASP  18   8.977  12.113   8.081
  137    H    GLY  19           H        GLY  19   9.828  10.146   9.739
  138   1HA   GLY  19          1HA       GLY  19   7.957   8.143  10.540
  139   2HA   GLY  19          2HA       GLY  19   8.928   9.149  11.606
  140    H    ARG  20           H        ARG  20   5.855   8.509  10.425
  141    HA   ARG  20           HA       ARG  20   3.806   9.261  11.042
  142   1HB   ARG  20          1HB       ARG  20   4.910   9.407  13.287
  143   2HB   ARG  20          2HB       ARG  20   5.281  11.089  12.949
  144   1HG   ARG  20          1HG       ARG  20   2.999  11.701  12.997
  145   2HG   ARG  20          2HG       ARG  20   2.475  10.015  12.963
  146   1HD   ARG  20          1HD       ARG  20   2.261  10.979  15.203
  147   2HD   ARG  20          2HD       ARG  20   3.425   9.659  15.174
  148    HE   ARG  20           HE       ARG  20   4.341  12.450  15.033
  149   1HH1  ARG  20          1HH1      ARG  20   4.297   9.328  16.631
  150   2HH1  ARG  20          2HH1      ARG  20   5.553   9.752  17.759
  151   1HH2  ARG  20          1HH2      ARG  20   5.964  13.018  16.538
  152   2HH2  ARG  20          2HH2      ARG  20   6.474  11.855  17.729
  153    H    HIS  21           H        HIS  21   5.615  10.658   9.019
  154    HA   HIS  21           HA       HIS  21   3.728  12.766   8.419
  155   1HB   HIS  21          1HB       HIS  21   5.355  13.892   9.872
  156   2HB   HIS  21          2HB       HIS  21   6.659  13.427   8.794
  157    HD1  HIS  21           HD1      HIS  21   3.873  15.859   9.228
  158    HD2  HIS  21           HD2      HIS  21   6.798  14.953   6.409
  159    HE1  HIS  21           HE1      HIS  21   3.962  17.836   7.674
  160    HE2  HIS  21           HE2      HIS  21   5.909  17.368   6.145
  161    H    ALA  22           H        ALA  22   3.631  13.256   6.293
  162    HA   ALA  22           HA       ALA  22   5.612  12.153   4.454
  163   1HB   ALA  22          1HB       ALA  22   3.943  10.993   3.110
  164   2HB   ALA  22          2HB       ALA  22   3.986  10.343   4.749
  165   3HB   ALA  22          3HB       ALA  22   2.687  11.434   4.268
  166    H    LYS  23           H        LYS  23   5.388  12.984   2.272
  167    HA   LYS  23           HA       LYS  23   3.573  15.224   1.895
  168   1HB   LYS  23          1HB       LYS  23   5.550  16.178   3.049
  169   2HB   LYS  23          2HB       LYS  23   6.573  15.581   1.752
  170   1HG   LYS  23          1HG       LYS  23   5.645  17.095   0.194
  171   2HG   LYS  23          2HG       LYS  23   4.316  17.511   1.280
  172   1HD   LYS  23          1HD       LYS  23   5.954  18.476   2.859
  173   2HD   LYS  23          2HD       LYS  23   7.240  18.128   1.704
  174   1HE   LYS  23          1HE       LYS  23   4.865  19.814   0.980
  175   2HE   LYS  23          2HE       LYS  23   6.292  20.500   1.747
  176   1HZ   LYS  23          1HZ       LYS  23   7.626  19.664  -0.100
  177   2HZ   LYS  23          2HZ       LYS  23   6.233  19.062  -0.857
  178   3HZ   LYS  23          3HZ       LYS  23   6.424  20.733  -0.632
  179    H    VAL  24           H        VAL  24   2.670  14.690   0.036
  180    HA   VAL  24           HA       VAL  24   4.233  13.395  -2.062
  181    HB   VAL  24           HB       VAL  24   1.280  14.066  -2.033
  182   1HG1  VAL  24          1HG1      VAL  24   2.865  12.224  -3.819
  183   2HG1  VAL  24          2HG1      VAL  24   1.118  12.462  -3.867
  184   3HG1  VAL  24          3HG1      VAL  24   2.202  13.793  -4.277
  185   1HG2  VAL  24          1HG2      VAL  24   1.830  12.502  -0.243
  186   2HG2  VAL  24          2HG2      VAL  24   0.914  11.700  -1.521
  187   3HG2  VAL  24          3HG2      VAL  24   2.657  11.458  -1.399
  188    H    ASN  25           H        ASN  25   5.465  14.871  -3.055
  189    HA   ASN  25           HA       ASN  25   6.139  16.676  -4.230
  190   1HB   ASN  25          1HB       ASN  25   4.439  15.870  -5.830
  191   2HB   ASN  25          2HB       ASN  25   3.222  16.857  -5.029
  192   1HD2  ASN  25          2HD2      ASN  25   6.553  17.829  -5.636
  193   2HD2  ASN  25          1HD2      ASN  25   6.162  19.085  -6.761
  194    H    GLU  26           H        GLU  26   3.066  18.294  -3.950
  195    HA   GLU  26           HA       GLU  26   4.339  20.186  -2.091
  196   1HB   GLU  26          1HB       GLU  26   2.145  20.652  -4.117
  197   2HB   GLU  26          2HB       GLU  26   2.766  21.867  -3.007
  198   1HG   GLU  26          1HG       GLU  26   4.303  20.489  -5.195
  199   2HG   GLU  26          2HG       GLU  26   3.727  22.155  -5.200
  200    H    GLN  27           H        GLN  27   2.006  17.813  -2.240
  201    HA   GLN  27           HA       GLN  27   0.223  19.139  -0.327
  202   1HB   GLN  27          1HB       GLN  27  -0.807  18.090  -2.311
  203   2HB   GLN  27          2HB       GLN  27  -0.138  16.537  -1.828
  204   1HG   GLN  27          1HG       GLN  27  -1.490  16.543   0.178
  205   2HG   GLN  27          2HG       GLN  27  -2.107  18.146  -0.215
  206   1HE2  GLN  27          2HE2      GLN  27  -2.353  17.581  -3.063
  207   2HE2  GLN  27          1HE2      GLN  27  -3.721  16.532  -3.226
  208    H    ILE  28           H        ILE  28   0.482  18.766   1.760
  209    HA   ILE  28           HA       ILE  28   2.191  16.578   2.635
  210    HB   ILE  28           HB       ILE  28   0.890  18.823   4.187
  211   1HG1  ILE  28          1HG1      ILE  28   3.748  18.311   3.329
  212   2HG1  ILE  28          2HG1      ILE  28   2.687  19.589   2.745
  213   1HG2  ILE  28          1HG2      ILE  28   2.258  18.098   6.085
  214   2HG2  ILE  28          2HG2      ILE  28   1.111  16.851   5.596
  215   3HG2  ILE  28          3HG2      ILE  28   2.812  16.707   5.153
  216   1HD1  ILE  28          1HD1      ILE  28   4.284  20.487   4.304
  217   2HD1  ILE  28          2HD1      ILE  28   2.667  20.564   5.005
  218   3HD1  ILE  28          3HD1      ILE  28   3.796  19.314   5.529
  219    H    LEU  29           H        LEU  29   1.442  14.697   3.356
  220    HA   LEU  29           HA       LEU  29  -1.416  14.534   4.032
  221   1HB   LEU  29          1HB       LEU  29   0.302  12.548   2.553
  222   2HB   LEU  29          2HB       LEU  29  -1.290  12.168   3.182
  223    HG   LEU  29           HG       LEU  29  -0.686  14.267   1.094
  224   1HD1  LEU  29          1HD1      LEU  29  -0.401  11.989   0.264
  225   2HD1  LEU  29          2HD1      LEU  29  -2.013  11.573   0.844
  226   3HD1  LEU  29          3HD1      LEU  29  -1.818  12.761  -0.446
  227   1HD2  LEU  29          1HD2      LEU  29  -3.315  13.282   2.197
  228   2HD2  LEU  29          2HD2      LEU  29  -2.596  14.866   2.486
  229   3HD2  LEU  29          3HD2      LEU  29  -3.114  14.417   0.862
  230    H    GLN  30           H        GLN  30  -1.767  14.046   6.044
  231    HA   GLN  30           HA       GLN  30   0.071  12.205   7.414
  232   1HB   GLN  30          1HB       GLN  30  -1.166  13.300   9.503
  233   2HB   GLN  30          2HB       GLN  30   0.270  14.016   8.791
  234   1HG   GLN  30          1HG       GLN  30  -1.388  15.707   9.269
  235   2HG   GLN  30          2HG       GLN  30  -1.122  15.575   7.534
  236   1HE2  GLN  30          2HE2      GLN  30  -3.334  15.004  10.150
  237   2HE2  GLN  30          1HE2      GLN  30  -4.747  14.765   9.170
  238    H    GLN  31           H        GLN  31  -2.050  11.517   5.665
  239    HA   GLN  31           HA       GLN  31  -3.926  10.187   7.503
  240   1HB   GLN  31          1HB       GLN  31  -4.395  11.251   4.713
  241   2HB   GLN  31          2HB       GLN  31  -5.528  10.213   5.565
  242   1HG   GLN  31          1HG       GLN  31  -6.005  11.861   7.164
  243   2HG   GLN  31          2HG       GLN  31  -4.605  12.830   6.702
  244   1HE2  GLN  31          2HE2      GLN  31  -7.480  13.497   6.843
  245   2HE2  GLN  31          1HE2      GLN  31  -7.875  14.115   5.271
  246    H    SER  32           H        SER  32  -5.051   8.335   6.032
  247    HA   SER  32           HA       SER  32  -2.842   6.666   5.081
  248   1HB   SER  32          1HB       SER  32  -5.690   5.848   5.702
  249   2HB   SER  32          2HB       SER  32  -4.297   4.785   5.485
  250    HG   SER  32           HG       SER  32  -3.657   6.524   7.361
  251    H    PHE  33           H        PHE  33  -2.616   6.241   2.957
  252    HA   PHE  33           HA       PHE  33  -4.889   6.567   1.155
  253   1HB   PHE  33          1HB       PHE  33  -3.614   8.096  -0.327
  254   2HB   PHE  33          2HB       PHE  33  -3.964   8.814   1.241
  255    HD1  PHE  33           HD1      PHE  33  -1.363   7.610  -1.002
  256    HD2  PHE  33           HD2      PHE  33  -2.174   9.168   2.874
  257    HE1  PHE  33           HE1      PHE  33   1.027   8.108  -0.705
  258    HE2  PHE  33           HE2      PHE  33   0.215   9.668   3.176
  259    HZ   PHE  33           HZ       PHE  33   1.820   9.138   1.386
  260    H    ILE  34           H        ILE  34  -4.314   5.915  -1.103
  261    HA   ILE  34           HA       ILE  34  -2.107   3.968  -1.109
  262    HB   ILE  34           HB       ILE  34  -3.449   2.611  -2.730
  263   1HG1  ILE  34          1HG1      ILE  34  -5.733   4.361  -1.788
  264   2HG1  ILE  34          2HG1      ILE  34  -5.027   4.396  -3.400
  265   1HG2  ILE  34          1HG2      ILE  34  -4.864   1.574  -1.008
  266   2HG2  ILE  34          2HG2      ILE  34  -3.246   1.943  -0.413
  267   3HG2  ILE  34          3HG2      ILE  34  -4.605   2.975   0.029
  268   1HD1  ILE  34          1HD1      ILE  34  -5.741   2.090  -3.758
  269   2HD1  ILE  34          2HD1      ILE  34  -6.455   2.065  -2.146
  270   3HD1  ILE  34          3HD1      ILE  34  -7.101   3.146  -3.380
  271    H    LEU  35           H        LEU  35  -0.667   4.170  -2.671
  272    HA   LEU  35           HA       LEU  35  -1.281   5.993  -4.905
  273   1HB   LEU  35          1HB       LEU  35   0.374   6.939  -3.398
  274   2HB   LEU  35          2HB       LEU  35   1.336   5.477  -3.487
  275    HG   LEU  35           HG       LEU  35   1.785   5.926  -5.873
  276   1HD1  LEU  35          1HD1      LEU  35  -0.225   7.182  -6.416
  277   2HD1  LEU  35          2HD1      LEU  35   0.303   8.503  -5.374
  278   3HD1  LEU  35          3HD1      LEU  35   1.221   8.105  -6.826
  279   1HD2  LEU  35          1HD2      LEU  35   2.461   8.185  -3.994
  280   2HD2  LEU  35          2HD2      LEU  35   3.365   6.684  -4.201
  281   3HD2  LEU  35          3HD2      LEU  35   3.273   7.847  -5.524
  282    H    MET  36           H        MET  36  -0.972   5.271  -6.934
  283    HA   MET  36           HA       MET  36   0.639   2.850  -7.340
  284   1HB   MET  36          1HB       MET  36  -1.910   2.400  -7.215
  285   2HB   MET  36          2HB       MET  36  -2.004   3.241  -8.754
  286   1HG   MET  36          1HG       MET  36  -0.689   1.601  -9.837
  287   2HG   MET  36          2HG       MET  36  -0.225   0.865  -8.306
  288   1HE   MET  36          1HE       MET  36  -4.415   0.545 -10.217
  289   2HE   MET  36          2HE       MET  36  -3.047   1.392 -10.938
  290   3HE   MET  36          3HE       MET  36  -3.834   2.051  -9.505
  291    HA   PRO  37           HA       PRO  37   2.486   5.279 -10.558
  292   1HB   PRO  37          1HB       PRO  37   2.555   2.832 -12.228
  293   2HB   PRO  37          2HB       PRO  37   3.879   3.867 -11.687
  294   1HG   PRO  37          1HG       PRO  37   3.502   1.465 -10.605
  295   2HG   PRO  37          2HG       PRO  37   4.011   2.844  -9.612
  296   1HD   PRO  37          1HD       PRO  37   1.300   1.603  -9.885
  297   2HD   PRO  37          2HD       PRO  37   2.125   2.201  -8.430
  298    H    ASP  38           H        ASP  38  -0.014   5.927 -10.694
  299    HA   ASP  38           HA       ASP  38  -0.476   6.457 -13.443
  300   1HB   ASP  38          1HB       ASP  38  -1.417   4.181 -13.405
  301   2HB   ASP  38          2HB       ASP  38  -2.469   4.634 -12.066
  302    H    GLU  39           H        GLU  39  -2.083   6.179 -10.281
  303    HA   GLU  39           HA       GLU  39  -2.434   9.036 -10.189
  304   1HB   GLU  39          1HB       GLU  39  -4.875   8.934  -9.774
  305   2HB   GLU  39          2HB       GLU  39  -4.435   8.479 -11.413
  306   1HG   GLU  39          1HG       GLU  39  -4.695   6.117 -10.822
  307   2HG   GLU  39          2HG       GLU  39  -5.148   6.584  -9.182
  308    H    LEU  40           H        LEU  40  -3.637   9.634  -8.102
  309    HA   LEU  40           HA       LEU  40  -2.678   7.869  -5.951
  310   1HB   LEU  40          1HB       LEU  40  -1.438   9.942  -5.993
  311   2HB   LEU  40          2HB       LEU  40  -2.917  10.877  -6.068
  312    HG   LEU  40           HG       LEU  40  -3.486  10.098  -3.776
  313   1HD1  LEU  40          1HD1      LEU  40  -0.710   8.924  -3.839
  314   2HD1  LEU  40          2HD1      LEU  40  -1.746   9.050  -2.417
  315   3HD1  LEU  40          3HD1      LEU  40  -2.222   8.018  -3.766
  316   1HD2  LEU  40          1HD2      LEU  40  -0.822  11.480  -4.076
  317   2HD2  LEU  40          2HD2      LEU  40  -2.408  12.250  -4.117
  318   3HD2  LEU  40          3HD2      LEU  40  -1.832  11.498  -2.630
  319    H    VAL  41           H        VAL  41  -4.186   7.052  -4.641
  320    HA   VAL  41           HA       VAL  41  -6.857   8.285  -4.705
  321    HB   VAL  41           HB       VAL  41  -6.174   5.439  -3.950
  322   1HG1  VAL  41          1HG1      VAL  41  -8.587   5.065  -4.094
  323   2HG1  VAL  41          2HG1      VAL  41  -8.191   6.273  -2.872
  324   3HG1  VAL  41          3HG1      VAL  41  -8.833   6.777  -4.435
  325   1HG2  VAL  41          1HG2      VAL  41  -7.357   6.506  -6.512
  326   2HG2  VAL  41          2HG2      VAL  41  -5.741   5.824  -6.317
  327   3HG2  VAL  41          3HG2      VAL  41  -7.163   4.802  -6.096
  328    H    GLU  42           H        GLU  42  -6.903   9.659  -3.046
  329    HA   GLU  42           HA       GLU  42  -5.916   8.777  -0.432
  330   1HB   GLU  42          1HB       GLU  42  -6.728  11.331  -0.007
  331   2HB   GLU  42          2HB       GLU  42  -5.104  10.881  -0.499
  332   1HG   GLU  42          1HG       GLU  42  -5.942  12.740  -1.814
  333   2HG   GLU  42          2HG       GLU  42  -5.667  11.323  -2.824
  334    H    HIS  43           H        HIS  43  -8.644   8.587  -2.168
  335    HA   HIS  43           HA       HIS  43 -10.550   9.139  -0.056
  336   1HB   HIS  43          1HB       HIS  43 -10.974   7.756  -2.719
  337   2HB   HIS  43          2HB       HIS  43 -12.237   8.319  -1.634
  338    HD1  HIS  43           HD1      HIS  43 -10.873   9.223  -4.682
  339    HD2  HIS  43           HD2      HIS  43 -11.616  11.364  -1.191
  340    HE1  HIS  43           HE1      HIS  43 -10.975  11.637  -5.372
  341    HE2  HIS  43           HE2      HIS  43 -11.189  12.919  -3.217
  342    H    TRP  44           H        TRP  44  -8.983   7.565   1.190
  343    HA   TRP  44           HA       TRP  44 -10.036   4.829   0.926
  344   1HB   TRP  44          1HB       TRP  44  -7.533   5.280   0.465
  345   2HB   TRP  44          2HB       TRP  44  -7.396   5.517   2.203
  346    HD1  TRP  44           HD1      TRP  44  -9.522   2.778   0.521
  347    HE1  TRP  44           HE1      TRP  44  -8.624   0.488   1.256
  348    HE3  TRP  44           HE3      TRP  44  -5.420   4.331   3.148
  349    HZ2  TRP  44           HZ2      TRP  44  -6.452  -0.532   2.751
  350    HZ3  TRP  44           HZ3      TRP  44  -3.983   2.633   4.199
  351    HH2  TRP  44           HH2      TRP  44  -4.489   0.252   4.004
  352    HA   PRO  45           HA       PRO  45 -11.698   6.207   4.894
  353   1HB   PRO  45          1HB       PRO  45 -13.519   3.951   4.651
  354   2HB   PRO  45          2HB       PRO  45 -13.879   5.677   4.615
  355   1HG   PRO  45          1HG       PRO  45 -14.100   4.074   2.433
  356   2HG   PRO  45          2HG       PRO  45 -13.702   5.799   2.330
  357   1HD   PRO  45          1HD       PRO  45 -11.883   3.421   2.174
  358   2HD   PRO  45          2HD       PRO  45 -11.877   4.910   1.203
  359    H    VAL  46           H        VAL  46  -9.513   5.267   5.596
  360    HA   VAL  46           HA       VAL  46 -10.122   3.043   7.421
  361    HB   VAL  46           HB       VAL  46  -7.513   3.399   5.921
  362   1HG1  VAL  46          1HG1      VAL  46  -7.131   2.662   8.216
  363   2HG1  VAL  46          2HG1      VAL  46  -8.285   1.347   7.995
  364   3HG1  VAL  46          3HG1      VAL  46  -6.782   1.366   7.071
  365   1HG2  VAL  46          1HG2      VAL  46  -8.022   1.221   4.939
  366   2HG2  VAL  46          2HG2      VAL  46  -9.560   1.185   5.803
  367   3HG2  VAL  46          3HG2      VAL  46  -9.276   2.400   4.556
  368    HA   PRO  47           HA       PRO  47  -8.678   6.234  10.253
  369   1HB   PRO  47          1HB       PRO  47  -9.311   4.258  12.315
  370   2HB   PRO  47          2HB       PRO  47 -10.038   5.841  12.029
  371   1HG   PRO  47          1HG       PRO  47 -11.372   3.540  11.569
  372   2HG   PRO  47          2HG       PRO  47 -11.628   4.998  10.592
  373   1HD   PRO  47          1HD       PRO  47  -9.990   2.564   9.972
  374   2HD   PRO  47          2HD       PRO  47 -11.090   3.480   8.917
  375    H    SER  48           H        SER  48  -6.643   5.110   9.063
  376    HA   SER  48           HA       SER  48  -4.456   4.625   9.286
  377   1HB   SER  48          1HB       SER  48  -4.948   4.749  12.271
  378   2HB   SER  48          2HB       SER  48  -3.372   4.772  11.476
  379    HG   SER  48           HG       SER  48  -4.602   6.669  10.300
  380    H    LEU  49           H        LEU  49  -5.652   2.860  12.154
  381    HA   LEU  49           HA       LEU  49  -5.274   0.342  10.763
  382   1HB   LEU  49          1HB       LEU  49  -3.036   1.096  11.724
  383   2HB   LEU  49          2HB       LEU  49  -3.746   0.868  13.309
  384    HG   LEU  49           HG       LEU  49  -4.088  -1.520  12.811
  385   1HD1  LEU  49          1HD1      LEU  49  -3.064  -2.508  10.825
  386   2HD1  LEU  49          2HD1      LEU  49  -4.332  -1.363  10.392
  387   3HD1  LEU  49          3HD1      LEU  49  -2.638  -0.899  10.241
  388   1HD2  LEU  49          1HD2      LEU  49  -1.268  -0.545  12.374
  389   2HD2  LEU  49          2HD2      LEU  49  -2.051  -0.808  13.932
  390   3HD2  LEU  49          3HD2      LEU  49  -1.729  -2.174  12.865
  391    H    GLY  50           H        GLY  50  -5.717  -1.513  12.443
  392   1HA   GLY  50          1HA       GLY  50  -7.034  -2.358  14.177
  393   2HA   GLY  50          2HA       GLY  50  -7.592  -0.726  14.518
  394    H    GLN  51           H        GLN  51  -8.720   0.173  12.332
  395    HA   GLN  51           HA       GLN  51 -10.954  -1.666  11.922
  396   1HB   GLN  51          1HB       GLN  51 -10.669   1.302  11.463
  397   2HB   GLN  51          2HB       GLN  51 -12.095   0.384  10.995
  398   1HG   GLN  51          1HG       GLN  51 -12.466  -0.259  13.303
  399   2HG   GLN  51          2HG       GLN  51 -11.010   0.604  13.791
  400   1HE2  GLN  51          2HE2      GLN  51 -12.148   1.896  15.195
  401   2HE2  GLN  51          1HE2      GLN  51 -13.173   3.185  14.650
  402    H    LEU  52           H        LEU  52  -8.308  -1.803  10.536
  403    HA   LEU  52           HA       LEU  52  -8.827  -1.302   7.771
  404   1HB   LEU  52          1HB       LEU  52  -6.541  -1.506   8.682
  405   2HB   LEU  52          2HB       LEU  52  -6.853  -3.186   9.076
  406    HG   LEU  52           HG       LEU  52  -7.115  -3.687   6.671
  407   1HD1  LEU  52          1HD1      LEU  52  -7.862  -1.500   5.910
  408   2HD1  LEU  52          2HD1      LEU  52  -6.282  -0.815   6.290
  409   3HD1  LEU  52          3HD1      LEU  52  -6.435  -2.022   5.014
  410   1HD2  LEU  52          1HD2      LEU  52  -4.528  -2.321   7.405
  411   2HD2  LEU  52          2HD2      LEU  52  -4.954  -3.998   7.746
  412   3HD2  LEU  52          3HD2      LEU  52  -4.750  -3.462   6.078
  413    H    GLN  53           H        GLN  53 -10.190  -2.421   6.527
  414    HA   GLN  53           HA       GLN  53 -10.909  -5.157   7.323
  415   1HB   GLN  53          1HB       GLN  53 -12.866  -2.986   6.540
  416   2HB   GLN  53          2HB       GLN  53 -13.274  -4.650   6.938
  417   1HG   GLN  53          1HG       GLN  53 -12.530  -4.320   9.215
  418   2HG   GLN  53          2HG       GLN  53 -12.011  -2.680   8.831
  419   1HE2  GLN  53          2HE2      GLN  53 -13.364  -1.716  10.308
  420   2HE2  GLN  53          1HE2      GLN  53 -15.086  -1.664  10.119
  421    HA   PRO  54           HA       PRO  54 -10.458  -6.364   3.099
  422   1HB   PRO  54          1HB       PRO  54 -13.099  -7.702   3.407
  423   2HB   PRO  54          2HB       PRO  54 -11.556  -8.367   2.861
  424   1HG   PRO  54          1HG       PRO  54 -12.473  -8.903   5.297
  425   2HG   PRO  54          2HG       PRO  54 -10.746  -8.611   5.018
  426   1HD   PRO  54          1HD       PRO  54 -12.806  -6.811   6.216
  427   2HD   PRO  54          2HD       PRO  54 -11.095  -7.013   6.645
  428    H    ALA  55           H        ALA  55 -13.634  -5.115   4.086
  429    HA   ALA  55           HA       ALA  55 -14.547  -4.550   1.460
  430   1HB   ALA  55          1HB       ALA  55 -16.255  -3.191   2.533
  431   2HB   ALA  55          2HB       ALA  55 -16.058  -4.725   3.381
  432   3HB   ALA  55          3HB       ALA  55 -15.366  -3.250   4.055
  433    H    HIS  56           H        HIS  56 -12.547  -2.795   3.729
  434    HA   HIS  56           HA       HIS  56 -12.704  -0.334   2.217
  435   1HB   HIS  56          1HB       HIS  56 -11.107  -1.147   4.643
  436   2HB   HIS  56          2HB       HIS  56 -10.880   0.405   3.843
  437    HD1  HIS  56           HD1      HIS  56 -12.216  -0.453   6.787
  438    HD2  HIS  56           HD2      HIS  56 -14.009   1.251   3.445
  439    HE1  HIS  56           HE1      HIS  56 -14.271   0.710   7.644
  440    HE2  HIS  56           HE2      HIS  56 -15.333   1.761   5.612
  441    H    MET  57           H        MET  57 -10.611  -3.107   2.441
  442    HA   MET  57           HA       MET  57  -8.577  -1.831   0.787
  443   1HB   MET  57          1HB       MET  57  -8.020  -3.388   2.707
  444   2HB   MET  57          2HB       MET  57  -8.662  -4.701   1.729
  445   1HG   MET  57          1HG       MET  57  -6.982  -4.252   0.019
  446   2HG   MET  57          2HG       MET  57  -6.343  -2.927   0.990
  447   1HE   MET  57          1HE       MET  57  -3.893  -3.850   1.019
  448   2HE   MET  57          2HE       MET  57  -4.415  -5.137  -0.072
  449   3HE   MET  57          3HE       MET  57  -3.483  -5.529   1.373
  450    H    ASP  58           H        ASP  58 -11.483  -3.222   0.293
  451    HA   ASP  58           HA       ASP  58 -11.158  -5.096  -1.738
  452   1HB   ASP  58          1HB       ASP  58 -13.284  -4.734  -0.578
  453   2HB   ASP  58          2HB       ASP  58 -13.429  -3.141  -1.315
  454    H    ALA  59           H        ALA  59 -11.445  -1.580  -1.919
  455    HA   ALA  59           HA       ALA  59 -11.526  -1.323  -4.705
  456   1HB   ALA  59          1HB       ALA  59 -10.770   0.977  -4.342
  457   2HB   ALA  59          2HB       ALA  59 -12.030   0.525  -3.194
  458   3HB   ALA  59          3HB       ALA  59 -10.344   0.577  -2.677
  459    H    VAL  60           H        VAL  60  -8.830  -1.649  -2.469
  460    HA   VAL  60           HA       VAL  60  -6.755  -1.092  -4.312
  461    HB   VAL  60           HB       VAL  60  -6.608  -2.852  -1.853
  462   1HG1  VAL  60          1HG1      VAL  60  -4.668  -3.061  -3.307
  463   2HG1  VAL  60          2HG1      VAL  60  -4.467  -1.309  -3.314
  464   3HG1  VAL  60          3HG1      VAL  60  -4.244  -2.216  -1.818
  465   1HG2  VAL  60          1HG2      VAL  60  -5.897  -0.828  -0.657
  466   2HG2  VAL  60          2HG2      VAL  60  -6.228   0.129  -2.100
  467   3HG2  VAL  60          3HG2      VAL  60  -7.547  -0.694  -1.266
  468    H    LEU  61           H        LEU  61  -8.353  -4.060  -3.278
  469    HA   LEU  61           HA       LEU  61  -6.766  -5.818  -4.858
  470   1HB   LEU  61          1HB       LEU  61  -9.543  -6.196  -3.733
  471   2HB   LEU  61          2HB       LEU  61  -8.525  -7.470  -4.375
  472    HG   LEU  61           HG       LEU  61  -7.886  -5.808  -1.935
  473   1HD1  LEU  61          1HD1      LEU  61  -8.869  -8.646  -2.177
  474   2HD1  LEU  61          2HD1      LEU  61  -8.358  -7.857  -0.685
  475   3HD1  LEU  61          3HD1      LEU  61  -9.783  -7.276  -1.547
  476   1HD2  LEU  61          1HD2      LEU  61  -6.106  -7.452  -1.577
  477   2HD2  LEU  61          2HD2      LEU  61  -6.516  -8.227  -3.107
  478   3HD2  LEU  61          3HD2      LEU  61  -5.887  -6.580  -3.094
  479    H    ALA  62           H        ALA  62  -9.721  -4.019  -5.368
  480    HA   ALA  62           HA       ALA  62 -10.531  -5.249  -7.778
  481   1HB   ALA  62          1HB       ALA  62 -12.019  -3.869  -6.396
  482   2HB   ALA  62          2HB       ALA  62 -11.087  -2.438  -6.838
  483   3HB   ALA  62          3HB       ALA  62 -11.978  -3.327  -8.074
  484    H    LEU  63           H        LEU  63  -8.143  -2.840  -7.054
  485    HA   LEU  63           HA       LEU  63  -7.832  -1.909  -9.753
  486   1HB   LEU  63          1HB       LEU  63  -6.016  -1.672  -7.354
  487   2HB   LEU  63          2HB       LEU  63  -5.762  -0.852  -8.883
  488    HG   LEU  63           HG       LEU  63  -8.121  -0.425  -7.043
  489   1HD1  LEU  63          1HD1      LEU  63  -7.112   1.765  -6.630
  490   2HD1  LEU  63          2HD1      LEU  63  -6.058   0.454  -6.103
  491   3HD1  LEU  63          3HD1      LEU  63  -5.718   1.306  -7.609
  492   1HD2  LEU  63          1HD2      LEU  63  -8.667   1.433  -8.522
  493   2HD2  LEU  63          2HD2      LEU  63  -7.313   1.011  -9.570
  494   3HD2  LEU  63          3HD2      LEU  63  -8.678  -0.094  -9.403
  495    H    ASN  64           H        ASN  64  -7.369  -4.820  -8.607
  496    HA   ASN  64           HA       ASN  64  -5.827  -6.506  -8.722
  497   1HB   ASN  64          1HB       ASN  64  -5.918  -7.536 -10.849
  498   2HB   ASN  64          2HB       ASN  64  -7.432  -6.694 -10.607
  499   1HD2  ASN  64          2HD2      ASN  64  -6.162  -4.073 -11.367
  500   2HD2  ASN  64          1HD2      ASN  64  -6.007  -4.154 -13.086
  501    HA   PRO  65           HA       PRO  65  -1.857  -4.376  -9.505
  502   1HB   PRO  65          1HB       PRO  65  -0.907  -4.404  -7.002
  503   2HB   PRO  65          2HB       PRO  65  -2.045  -3.165  -7.539
  504   1HG   PRO  65          1HG       PRO  65  -2.530  -5.591  -5.874
  505   2HG   PRO  65          2HG       PRO  65  -3.240  -3.974  -5.735
  506   1HD   PRO  65          1HD       PRO  65  -4.453  -6.168  -6.942
  507   2HD   PRO  65          2HD       PRO  65  -4.911  -4.472  -7.195
  508    H    ALA  66           H        ALA  66   0.360  -5.287  -9.070
  509    HA   ALA  66           HA       ALA  66   0.274  -8.181  -9.287
  510   1HB   ALA  66          1HB       ALA  66   2.639  -8.008  -9.869
  511   2HB   ALA  66          2HB       ALA  66   1.671  -6.892 -10.834
  512   3HB   ALA  66          3HB       ALA  66   2.618  -6.289  -9.475
  513    H    VAL  67           H        VAL  67   1.652  -5.716  -7.176
  514    HA   VAL  67           HA       VAL  67   1.707  -7.654  -4.994
  515    HB   VAL  67           HB       VAL  67   3.976  -7.733  -5.929
  516   1HG1  VAL  67          1HG1      VAL  67   4.086  -5.557  -6.970
  517   2HG1  VAL  67          2HG1      VAL  67   4.061  -4.771  -5.391
  518   3HG1  VAL  67          3HG1      VAL  67   5.440  -5.766  -5.859
  519   1HG2  VAL  67          1HG2      VAL  67   3.875  -6.286  -3.286
  520   2HG2  VAL  67          2HG2      VAL  67   3.729  -8.027  -3.530
  521   3HG2  VAL  67          3HG2      VAL  67   5.246  -7.208  -3.903
  522    H    ILE  68           H        ILE  68   1.677  -6.618  -2.885
  523    HA   ILE  68           HA       ILE  68   0.958  -3.761  -3.016
  524    HB   ILE  68           HB       ILE  68  -0.361  -5.829  -1.243
  525   1HG1  ILE  68          1HG1      ILE  68  -1.477  -4.324  -3.623
  526   2HG1  ILE  68          2HG1      ILE  68  -1.011  -6.022  -3.631
  527   1HG2  ILE  68          1HG2      ILE  68  -1.884  -4.000  -0.641
  528   2HG2  ILE  68          2HG2      ILE  68  -0.218  -3.634  -0.196
  529   3HG2  ILE  68          3HG2      ILE  68  -0.933  -2.890  -1.626
  530   1HD1  ILE  68          1HD1      ILE  68  -3.414  -5.770  -3.421
  531   2HD1  ILE  68          2HD1      ILE  68  -2.734  -6.493  -1.964
  532   3HD1  ILE  68          3HD1      ILE  68  -3.201  -4.793  -1.967
  533    H    LEU  69           H        LEU  69   2.204  -2.538  -1.790
  534    HA   LEU  69           HA       LEU  69   3.678  -3.786   0.422
  535   1HB   LEU  69          1HB       LEU  69   4.156  -1.194  -1.056
  536   2HB   LEU  69          2HB       LEU  69   5.086  -1.723   0.334
  537    HG   LEU  69           HG       LEU  69   4.934  -3.188  -2.303
  538   1HD1  LEU  69          1HD1      LEU  69   7.125  -1.485  -1.126
  539   2HD1  LEU  69          2HD1      LEU  69   7.247  -2.441  -2.603
  540   3HD1  LEU  69          3HD1      LEU  69   6.127  -1.081  -2.523
  541   1HD2  LEU  69          1HD2      LEU  69   6.640  -3.667   0.130
  542   2HD2  LEU  69          2HD2      LEU  69   5.313  -4.684  -0.428
  543   3HD2  LEU  69          3HD2      LEU  69   6.772  -4.522  -1.405
  544    H    LEU  70           H        LEU  70   3.100  -3.352   2.437
  545    HA   LEU  70           HA       LEU  70   0.972  -1.371   2.823
  546   1HB   LEU  70          1HB       LEU  70   0.936  -3.942   3.486
  547   2HB   LEU  70          2HB       LEU  70   1.766  -3.355   4.911
  548    HG   LEU  70           HG       LEU  70  -0.641  -3.600   5.293
  549   1HD1  LEU  70          1HD1      LEU  70   0.247  -0.724   5.277
  550   2HD1  LEU  70          2HD1      LEU  70  -1.099  -1.386   6.203
  551   3HD1  LEU  70          3HD1      LEU  70   0.551  -1.901   6.554
  552   1HD2  LEU  70          1HD2      LEU  70  -2.237  -2.141   4.165
  553   2HD2  LEU  70          2HD2      LEU  70  -0.944  -1.508   3.146
  554   3HD2  LEU  70          3HD2      LEU  70  -1.415  -3.203   3.021
  555    H    GLY  71           H        GLY  71   1.863   0.552   3.300
  556   1HA   GLY  71          1HA       GLY  71   4.194   0.778   5.002
  557   2HA   GLY  71          2HA       GLY  71   3.251   2.105   4.328
  558    H    THR  72           H        THR  72   3.735   0.034   7.021
  559    HA   THR  72           HA       THR  72   1.211   0.736   8.287
  560    HB   THR  72           HB       THR  72   3.386  -0.846   9.623
  561    HG1  THR  72           HG1      THR  72   2.361  -1.424   7.218
  562   1HG2  THR  72          1HG2      THR  72   1.454  -2.100  10.496
  563   2HG2  THR  72          2HG2      THR  72   1.348  -0.380  10.879
  564   3HG2  THR  72          3HG2      THR  72   0.373  -1.057   9.572
  565    H    GLY  73           H        GLY  73   2.167   3.094   8.127
  566   1HA   GLY  73          1HA       GLY  73   3.084   4.925   9.165
  567   2HA   GLY  73          2HA       GLY  73   2.910   4.022  10.666
  568    H    GLU  74           H        GLU  74   4.729   3.733  11.732
  569    HA   GLU  74           HA       GLU  74   7.167   3.147  10.203
  570   1HB   GLU  74          1HB       GLU  74   6.830   5.186  12.383
  571   2HB   GLU  74          2HB       GLU  74   8.392   4.421  12.103
  572   1HG   GLU  74          1HG       GLU  74   6.807   5.973  10.063
  573   2HG   GLU  74          2HG       GLU  74   8.208   6.569  10.957
  574    H    ARG  75           H        ARG  75   5.009   1.831  11.985
  575    HA   ARG  75           HA       ARG  75   6.923   0.144  13.446
  576   1HB   ARG  75          1HB       ARG  75   4.212   1.097  14.377
  577   2HB   ARG  75          2HB       ARG  75   5.056  -0.258  15.113
  578   1HG   ARG  75          1HG       ARG  75   6.048   2.582  14.985
  579   2HG   ARG  75          2HG       ARG  75   5.353   1.785  16.397
  580   1HD   ARG  75          1HD       ARG  75   7.950   1.166  15.004
  581   2HD   ARG  75          2HD       ARG  75   7.712   1.723  16.660
  582    HE   ARG  75           HE       ARG  75   7.216  -0.982  15.633
  583   1HH1  ARG  75          1HH1      ARG  75   7.340   1.242  18.341
  584   2HH1  ARG  75          2HH1      ARG  75   7.333  -0.019  19.533
  585   1HH2  ARG  75          1HH2      ARG  75   7.150  -2.638  17.205
  586   2HH2  ARG  75          2HH2      ARG  75   7.221  -2.220  18.897
  587    H    GLN  76           H        GLN  76   6.891  -1.858  12.655
  588    HA   GLN  76           HA       GLN  76   4.840  -2.706  10.842
  589   1HB   GLN  76          1HB       GLN  76   7.328  -3.364  10.806
  590   2HB   GLN  76          2HB       GLN  76   6.925  -4.492  12.091
  591   1HG   GLN  76          1HG       GLN  76   5.467  -4.516   9.472
  592   2HG   GLN  76          2HG       GLN  76   6.998  -5.356   9.684
  593   1HE2  GLN  76          2HE2      GLN  76   6.446  -6.117  12.436
  594   2HE2  GLN  76          1HE2      GLN  76   5.267  -7.377  12.359
  595    H    GLN  77           H        GLN  77   2.909  -3.222  11.562
  596    HA   GLN  77           HA       GLN  77   2.700  -4.802  14.034
  597   1HB   GLN  77          1HB       GLN  77   0.796  -2.665  13.053
  598   2HB   GLN  77          2HB       GLN  77   0.551  -3.671  14.475
  599   1HG   GLN  77          1HG       GLN  77   2.592  -2.707  15.466
  600   2HG   GLN  77          2HG       GLN  77   2.738  -1.644  14.066
  601   1HE2  GLN  77          2HE2      GLN  77  -0.320  -2.543  15.499
  602   2HE2  GLN  77          1HE2      GLN  77  -0.696  -0.982  16.140
  603    H    PHE  78           H        PHE  78   0.935  -6.281  14.119
  604    HA   PHE  78           HA       PHE  78   0.439  -7.529  11.585
  605   1HB   PHE  78          1HB       PHE  78  -0.535  -8.199  14.367
  606   2HB   PHE  78          2HB       PHE  78  -0.843  -9.188  12.943
  607    HD1  PHE  78           HD1      PHE  78   1.059 -10.265  11.762
  608    HD2  PHE  78           HD2      PHE  78   1.534  -8.294  15.505
  609    HE1  PHE  78           HE1      PHE  78   3.201 -11.428  12.097
  610    HE2  PHE  78           HE2      PHE  78   3.677  -9.452  15.847
  611    HZ   PHE  78           HZ       PHE  78   4.513 -11.021  14.141
  612    HA   PRO  79           HA       PRO  79  -3.373  -5.280  10.948
  613   1HB   PRO  79          1HB       PRO  79  -3.680  -6.815   8.510
  614   2HB   PRO  79          2HB       PRO  79  -3.302  -5.101   8.695
  615   1HG   PRO  79          1HG       PRO  79  -1.530  -6.943   7.734
  616   2HG   PRO  79          2HG       PRO  79  -1.049  -5.452   8.564
  617   1HD   PRO  79          1HD       PRO  79  -1.206  -8.249   9.621
  618   2HD   PRO  79          2HD       PRO  79   0.008  -6.989   9.928
  619    H    SER  80           H        SER  80  -5.620  -6.005  10.101
  620    HA   SER  80           HA       SER  80  -6.672  -7.977  11.790
  621   1HB   SER  80          1HB       SER  80  -7.957  -6.984   9.241
  622   2HB   SER  80          2HB       SER  80  -8.754  -7.526  10.718
  623    HG   SER  80           HG       SER  80  -8.560  -5.162  10.331
  624    H    THR  81           H        THR  81  -7.272 -10.102  11.432
  625    HA   THR  81           HA       THR  81  -5.643 -11.571   9.649
  626    HB   THR  81           HB       THR  81  -6.425 -12.502  11.791
  627    HG1  THR  81           HG1      THR  81  -7.557 -14.447  10.396
  628   1HG2  THR  81          1HG2      THR  81  -8.716 -13.350  12.014
  629   2HG2  THR  81          2HG2      THR  81  -8.693 -11.597  11.815
  630   3HG2  THR  81          3HG2      THR  81  -9.131 -12.633  10.456
  631    H    ASP  82           H        ASP  82  -8.886 -10.332   9.440
  632    HA   ASP  82           HA       ASP  82  -9.864 -11.851   7.295
  633   1HB   ASP  82          1HB       ASP  82 -10.457  -8.964   7.992
  634   2HB   ASP  82          2HB       ASP  82 -11.418  -9.969   6.914
  635    H    VAL  83           H        VAL  83  -7.824  -9.013   7.423
  636    HA   VAL  83           HA       VAL  83  -7.904  -8.391   4.652
  637    HB   VAL  83           HB       VAL  83  -5.846  -7.669   6.749
  638   1HG1  VAL  83          1HG1      VAL  83  -6.325  -6.492   4.016
  639   2HG1  VAL  83          2HG1      VAL  83  -5.226  -5.840   5.231
  640   3HG1  VAL  83          3HG1      VAL  83  -4.917  -7.424   4.523
  641   1HG2  VAL  83          1HG2      VAL  83  -7.035  -5.526   6.854
  642   2HG2  VAL  83          2HG2      VAL  83  -8.231  -6.141   5.712
  643   3HG2  VAL  83          3HG2      VAL  83  -8.076  -6.875   7.309
  644    H    LEU  84           H        LEU  84  -5.767 -10.298   6.692
  645    HA   LEU  84           HA       LEU  84  -3.729 -10.746   4.804
  646   1HB   LEU  84          1HB       LEU  84  -4.565 -12.474   7.134
  647   2HB   LEU  84          2HB       LEU  84  -3.037 -12.576   6.283
  648    HG   LEU  84           HG       LEU  84  -3.976 -10.197   7.892
  649   1HD1  LEU  84          1HD1      LEU  84  -1.901 -12.292   8.515
  650   2HD1  LEU  84          2HD1      LEU  84  -2.244 -10.858   9.481
  651   3HD1  LEU  84          3HD1      LEU  84  -3.468 -12.115   9.304
  652   1HD2  LEU  84          1HD2      LEU  84  -1.688  -9.381   7.590
  653   2HD2  LEU  84          2HD2      LEU  84  -1.331 -10.762   6.554
  654   3HD2  LEU  84          3HD2      LEU  84  -2.517  -9.560   6.044
  655    H    ALA  85           H        ALA  85  -6.817 -12.252   5.323
  656    HA   ALA  85           HA       ALA  85  -6.260 -14.607   3.792
  657   1HB   ALA  85          1HB       ALA  85  -7.977 -14.605   5.524
  658   2HB   ALA  85          2HB       ALA  85  -8.904 -13.410   4.615
  659   3HB   ALA  85          3HB       ALA  85  -8.662 -15.028   3.956
  660    H    ALA  86           H        ALA  86  -7.375 -11.393   3.090
  661    HA   ALA  86           HA       ALA  86  -8.677 -11.992   0.630
  662   1HB   ALA  86          1HB       ALA  86  -9.212 -10.006   1.960
  663   2HB   ALA  86          2HB       ALA  86  -7.609  -9.353   1.620
  664   3HB   ALA  86          3HB       ALA  86  -8.763  -9.587   0.307
  665    H    CYS  87           H        CYS  87  -5.453 -10.728   1.435
  666    HA   CYS  87           HA       CYS  87  -4.675 -10.432  -1.294
  667   1HB   CYS  87          1HB       CYS  87  -2.380 -10.145  -0.338
  668   2HB   CYS  87          2HB       CYS  87  -3.589  -9.075   0.365
  669    HG   CYS  87           HG       CYS  87  -1.883 -11.618   1.797
  670    H    LEU  88           H        LEU  88  -4.374 -12.968   1.107
  671    HA   LEU  88           HA       LEU  88  -2.435 -14.523  -0.240
  672   1HB   LEU  88          1HB       LEU  88  -3.085 -14.655   2.195
  673   2HB   LEU  88          2HB       LEU  88  -4.533 -15.502   1.696
  674    HG   LEU  88           HG       LEU  88  -1.817 -16.567   0.973
  675   1HD1  LEU  88          1HD1      LEU  88  -1.787 -16.197   3.380
  676   2HD1  LEU  88          2HD1      LEU  88  -3.319 -17.056   3.541
  677   3HD1  LEU  88          3HD1      LEU  88  -1.876 -17.918   3.008
  678   1HD2  LEU  88          1HD2      LEU  88  -3.007 -18.708   1.001
  679   2HD2  LEU  88          2HD2      LEU  88  -4.497 -17.876   1.450
  680   3HD2  LEU  88          3HD2      LEU  88  -3.753 -17.573  -0.122
  681    H    THR  89           H        THR  89  -5.986 -14.649  -0.191
  682    HA   THR  89           HA       THR  89  -6.201 -17.013  -1.719
  683    HB   THR  89           HB       THR  89  -8.578 -16.133  -2.155
  684    HG1  THR  89           HG1      THR  89  -8.134 -14.370  -0.022
  685   1HG2  THR  89          1HG2      THR  89  -8.050 -17.778  -0.430
  686   2HG2  THR  89          2HG2      THR  89  -7.596 -16.485   0.681
  687   3HG2  THR  89          3HG2      THR  89  -9.270 -16.641   0.145
  688    H    ARG  90           H        ARG  90  -5.995 -13.621  -2.622
  689    HA   ARG  90           HA       ARG  90  -6.571 -14.146  -5.399
  690   1HB   ARG  90          1HB       ARG  90  -5.552 -11.691  -3.971
  691   2HB   ARG  90          2HB       ARG  90  -5.827 -11.755  -5.706
  692   1HG   ARG  90          1HG       ARG  90  -8.207 -12.338  -5.231
  693   2HG   ARG  90          2HG       ARG  90  -7.875 -12.034  -3.522
  694   1HD   ARG  90          1HD       ARG  90  -7.238  -9.755  -4.018
  695   2HD   ARG  90          2HD       ARG  90  -7.445 -10.047  -5.743
  696    HE   ARG  90           HE       ARG  90  -9.693 -10.154  -3.820
  697   1HH1  ARG  90          1HH1      ARG  90  -8.324  -9.268  -6.930
  698   2HH1  ARG  90          2HH1      ARG  90  -9.749  -8.413  -7.449
  699   1HH2  ARG  90          1HH2      ARG  90 -11.575  -9.012  -4.524
  700   2HH2  ARG  90          2HH2      ARG  90 -11.582  -8.288  -6.108
  701    H    GLY  91           H        GLY  91  -3.853 -14.487  -3.431
  702   1HA   GLY  91          1HA       GLY  91  -1.725 -15.205  -3.967
  703   2HA   GLY  91          2HA       GLY  91  -2.200 -15.204  -5.661
  704    H    ILE  92           H        ILE  92  -2.385 -12.463  -3.477
  705    HA   ILE  92           HA       ILE  92  -0.396 -11.078  -5.150
  706    HB   ILE  92           HB       ILE  92  -2.519  -9.850  -3.378
  707   1HG1  ILE  92          1HG1      ILE  92  -2.420 -10.078  -6.397
  708   2HG1  ILE  92          2HG1      ILE  92  -3.484 -11.001  -5.342
  709   1HG2  ILE  92          1HG2      ILE  92  -0.555  -8.441  -3.612
  710   2HG2  ILE  92          2HG2      ILE  92  -0.624  -8.604  -5.367
  711   3HG2  ILE  92          3HG2      ILE  92  -1.909  -7.755  -4.510
  712   1HD1  ILE  92          1HD1      ILE  92  -4.567  -8.927  -4.636
  713   2HD1  ILE  92          2HD1      ILE  92  -3.509  -8.015  -5.711
  714   3HD1  ILE  92          3HD1      ILE  92  -4.668  -9.162  -6.381
  715    H    GLY  93           H        GLY  93   1.492 -10.586  -4.243
  716   1HA   GLY  93          1HA       GLY  93   2.113 -11.328  -1.582
  717   2HA   GLY  93          2HA       GLY  93   3.152 -10.414  -2.665
  718    H    LEU  94           H        LEU  94   1.962 -10.266   0.266
  719    HA   LEU  94           HA       LEU  94   1.597  -7.340   0.184
  720   1HB   LEU  94          1HB       LEU  94  -0.497  -8.437   0.794
  721   2HB   LEU  94          2HB       LEU  94   0.318  -9.342   2.053
  722    HG   LEU  94           HG       LEU  94   0.783  -7.207   3.239
  723   1HD1  LEU  94          1HD1      LEU  94  -0.408  -5.189   2.561
  724   2HD1  LEU  94          2HD1      LEU  94   0.734  -5.708   1.321
  725   3HD1  LEU  94          3HD1      LEU  94  -0.991  -6.014   1.115
  726   1HD2  LEU  94          1HD2      LEU  94  -1.146  -8.570   3.839
  727   2HD2  LEU  94          2HD2      LEU  94  -1.505  -6.853   4.022
  728   3HD2  LEU  94          3HD2      LEU  94  -2.122  -7.738   2.627
  729    H    GLU  95           H        GLU  95   3.317  -6.364   1.029
  730    HA   GLU  95           HA       GLU  95   4.763  -7.721   3.212
  731   1HB   GLU  95          1HB       GLU  95   5.829  -5.678   1.254
  732   2HB   GLU  95          2HB       GLU  95   6.753  -6.460   2.530
  733   1HG   GLU  95          1HG       GLU  95   6.265  -8.647   1.410
  734   2HG   GLU  95          2HG       GLU  95   5.579  -7.725   0.070
  735    H    ALA  96           H        ALA  96   4.270  -6.871   5.118
  736    HA   ALA  96           HA       ALA  96   3.433  -4.116   5.387
  737   1HB   ALA  96          1HB       ALA  96   3.121  -4.644   7.742
  738   2HB   ALA  96          2HB       ALA  96   2.372  -5.879   6.730
  739   3HB   ALA  96          3HB       ALA  96   3.919  -6.200   7.515
  740    H    MET  97           H        MET  97   4.746  -2.464   5.779
  741    HA   MET  97           HA       MET  97   7.317  -2.862   7.091
  742   1HB   MET  97          1HB       MET  97   7.099  -1.754   4.280
  743   2HB   MET  97          2HB       MET  97   8.546  -1.679   5.273
  744   1HG   MET  97          1HG       MET  97   8.614  -4.140   5.309
  745   2HG   MET  97          2HG       MET  97   7.208  -4.172   4.247
  746   1HE   MET  97          1HE       MET  97   7.227  -3.063   1.794
  747   2HE   MET  97          2HE       MET  97   8.672  -2.390   1.040
  748   3HE   MET  97          3HE       MET  97   7.933  -1.574   2.418
  749    H    THR  98           H        THR  98   8.474  -0.466   6.728
  750    HA   THR  98           HA       THR  98   6.589   1.369   7.969
  751    HB   THR  98           HB       THR  98   8.628   2.775   8.349
  752    HG1  THR  98           HG1      THR  98  10.505   2.189   7.527
  753   1HG2  THR  98          1HG2      THR  98   7.862   1.218  10.062
  754   2HG2  THR  98          2HG2      THR  98   8.787  -0.082   9.312
  755   3HG2  THR  98          3HG2      THR  98   9.624   1.290  10.036
  756    H    ASN  99           H        ASN  99   6.400   3.584   7.224
  757    HA   ASN  99           HA       ASN  99   5.885   3.767   4.460
  758   1HB   ASN  99          1HB       ASN  99   6.099   5.861   6.619
  759   2HB   ASN  99          2HB       ASN  99   5.714   6.271   4.952
  760   1HD2  ASN  99          2HD2      ASN  99   4.139   6.524   7.418
  761   2HD2  ASN  99          1HD2      ASN  99   2.663   5.670   7.124
  762    H    ALA 100           H        ALA 100   8.571   4.898   6.440
  763    HA   ALA 100           HA       ALA 100   9.923   6.375   4.470
  764   1HB   ALA 100          1HB       ALA 100  11.112   4.880   6.802
  765   2HB   ALA 100          2HB       ALA 100  11.873   6.192   5.903
  766   3HB   ALA 100          3HB       ALA 100  10.429   6.504   6.866
  767    H    ALA 101           H        ALA 101   9.703   2.942   4.970
  768    HA   ALA 101           HA       ALA 101  11.983   2.439   3.205
  769   1HB   ALA 101          1HB       ALA 101  10.277   0.481   4.739
  770   2HB   ALA 101          2HB       ALA 101  11.750   0.104   3.844
  771   3HB   ALA 101          3HB       ALA 101  11.825   1.133   5.274
  772    H    ALA 102           H        ALA 102   8.501   1.823   3.417
  773    HA   ALA 102           HA       ALA 102   8.226   0.240   1.127
  774   1HB   ALA 102          1HB       ALA 102   6.489   0.471   2.840
  775   2HB   ALA 102          2HB       ALA 102   6.202   2.131   2.322
  776   3HB   ALA 102          3HB       ALA 102   5.857   0.793   1.226
  777    H    ALA 103           H        ALA 103   8.164   3.746   1.513
  778    HA   ALA 103           HA       ALA 103   7.295   4.436  -1.059
  779   1HB   ALA 103          1HB       ALA 103   9.155   5.973   0.750
  780   2HB   ALA 103          2HB       ALA 103   8.241   6.631  -0.606
  781   3HB   ALA 103          3HB       ALA 103   7.394   6.013   0.812
  782    H    ARG 104           H        ARG 104  10.442   3.501   0.137
  783    HA   ARG 104           HA       ARG 104  11.878   4.449  -2.160
  784   1HB   ARG 104          1HB       ARG 104  12.771   2.469  -0.056
  785   2HB   ARG 104          2HB       ARG 104  13.804   3.366  -1.161
  786   1HG   ARG 104          1HG       ARG 104  13.134   5.460  -0.099
  787   2HG   ARG 104          2HG       ARG 104  12.086   4.564   1.004
  788   1HD   ARG 104          1HD       ARG 104  14.106   5.036   2.169
  789   2HD   ARG 104          2HD       ARG 104  14.112   3.317   1.775
  790    HE   ARG 104           HE       ARG 104  15.522   5.192   0.004
  791   1HH1  ARG 104          1HH1      ARG 104  15.623   2.562   2.320
  792   2HH1  ARG 104          2HH1      ARG 104  17.296   2.210   2.028
  793   1HH2  ARG 104          1HH2      ARG 104  17.710   4.711  -0.386
  794   2HH2  ARG 104          2HH2      ARG 104  18.477   3.413   0.479
  795    H    THR 105           H        THR 105  10.860   1.264  -0.956
  796    HA   THR 105           HA       THR 105  11.815  -0.247  -3.123
  797    HB   THR 105           HB       THR 105   9.454  -0.841  -1.325
  798    HG1  THR 105           HG1      THR 105  12.014  -1.950  -0.956
  799   1HG2  THR 105          1HG2      THR 105   9.524  -2.280  -3.306
  800   2HG2  THR 105          2HG2      THR 105  11.203  -2.688  -2.957
  801   3HG2  THR 105          3HG2      THR 105   9.926  -3.189  -1.850
  802    H    TYR 106           H        TYR 106   8.800   1.487  -2.599
  803    HA   TYR 106           HA       TYR 106   7.288   0.567  -4.737
  804   1HB   TYR 106          1HB       TYR 106   6.236   1.979  -3.150
  805   2HB   TYR 106          2HB       TYR 106   7.428   3.254  -3.375
  806    HD1  TYR 106           HD1      TYR 106   4.694   1.443  -5.150
  807    HD2  TYR 106           HD2      TYR 106   6.999   5.009  -4.847
  808    HE1  TYR 106           HE1      TYR 106   3.217   2.533  -6.788
  809    HE2  TYR 106           HE2      TYR 106   5.529   6.106  -6.482
  810    HH   TYR 106           HH       TYR 106   3.994   5.523  -8.253
  811    H    ASN 107           H        ASN 107   9.588   3.283  -4.666
  812    HA   ASN 107           HA       ASN 107   9.232   4.090  -7.324
  813   1HB   ASN 107          1HB       ASN 107  11.356   4.498  -5.260
  814   2HB   ASN 107          2HB       ASN 107  11.677   4.982  -6.917
  815   1HD2  ASN 107          2HD2      ASN 107   9.778   5.584  -4.068
  816   2HD2  ASN 107          1HD2      ASN 107   9.150   7.113  -4.579
  817    H    VAL 108           H        VAL 108  11.379   1.718  -5.871
  818    HA   VAL 108           HA       VAL 108  12.939   1.192  -8.166
  819    HB   VAL 108           HB       VAL 108  12.295  -0.621  -5.831
  820   1HG1  VAL 108          1HG1      VAL 108  14.460  -0.861  -7.918
  821   2HG1  VAL 108          2HG1      VAL 108  14.292  -1.880  -6.488
  822   3HG1  VAL 108          3HG1      VAL 108  13.056  -1.916  -7.746
  823   1HG2  VAL 108          1HG2      VAL 108  14.666   1.167  -6.359
  824   2HG2  VAL 108          2HG2      VAL 108  13.405   1.437  -5.156
  825   3HG2  VAL 108          3HG2      VAL 108  14.498   0.061  -4.995
  826    H    LEU 109           H        LEU 109  10.132  -0.528  -6.806
  827    HA   LEU 109           HA       LEU 109  10.034  -2.504  -8.816
  828   1HB   LEU 109          1HB       LEU 109   7.866  -1.520  -6.965
  829   2HB   LEU 109          2HB       LEU 109   7.762  -2.971  -7.941
  830    HG   LEU 109           HG       LEU 109   9.729  -2.483  -5.701
  831   1HD1  LEU 109          1HD1      LEU 109   7.466  -2.851  -4.900
  832   2HD1  LEU 109          2HD1      LEU 109   7.332  -4.302  -5.893
  833   3HD1  LEU 109          3HD1      LEU 109   8.481  -4.250  -4.555
  834   1HD2  LEU 109          1HD2      LEU 109   9.292  -4.936  -7.402
  835   2HD2  LEU 109          2HD2      LEU 109  10.690  -3.865  -7.475
  836   3HD2  LEU 109          3HD2      LEU 109  10.380  -4.810  -6.020
  837    H    ALA 110           H        ALA 110   8.314   0.564  -8.438
  838    HA   ALA 110           HA       ALA 110   6.470   0.234 -10.520
  839   1HB   ALA 110          1HB       ALA 110   6.153   2.637 -10.411
  840   2HB   ALA 110          2HB       ALA 110   6.277   1.959  -8.788
  841   3HB   ALA 110          3HB       ALA 110   7.651   2.811  -9.495
  842    H    SER 111           H        SER 111   9.787   1.382 -10.542
  843    HA   SER 111           HA       SER 111   9.721   2.404 -13.197
  844   1HB   SER 111          1HB       SER 111  12.084   1.555 -11.507
  845   2HB   SER 111          2HB       SER 111  12.161   2.538 -12.971
  846    HG   SER 111           HG       SER 111  11.303   3.210 -10.400
  847    H    GLU 112           H        GLU 112  10.409  -0.730 -11.798
  848    HA   GLU 112           HA       GLU 112  11.540  -1.874 -14.171
  849   1HB   GLU 112          1HB       GLU 112  11.847  -2.663 -11.751
  850   2HB   GLU 112          2HB       GLU 112  10.239  -3.349 -11.872
  851   1HG   GLU 112          1HG       GLU 112  12.518  -4.090 -13.687
  852   2HG   GLU 112          2HG       GLU 112  12.114  -4.955 -12.208
  853    H    GLY 113           H        GLY 113   8.365  -1.617 -12.717
  854   1HA   GLY 113          1HA       GLY 113   6.457  -1.680 -14.304
  855   2HA   GLY 113          2HA       GLY 113   7.234  -3.090 -15.016
  856    H    ARG 114           H        ARG 114   7.876  -3.350 -11.853
  857    HA   ARG 114           HA       ARG 114   5.854  -5.284 -11.292
  858   1HB   ARG 114          1HB       ARG 114   7.741  -3.877  -9.381
  859   2HB   ARG 114          2HB       ARG 114   6.782  -5.299  -9.008
  860   1HG   ARG 114          1HG       ARG 114   9.002  -5.168 -11.037
  861   2HG   ARG 114          2HG       ARG 114   9.129  -5.837  -9.410
  862   1HD   ARG 114          1HD       ARG 114   8.709  -7.769 -10.507
  863   2HD   ARG 114          2HD       ARG 114   7.038  -7.249 -10.292
  864    HE   ARG 114           HE       ARG 114   8.337  -6.357 -12.730
  865   1HH1  ARG 114          1HH1      ARG 114   6.239  -8.712 -11.187
  866   2HH1  ARG 114          2HH1      ARG 114   5.624  -9.330 -12.691
  867   1HH2  ARG 114          1HH2      ARG 114   7.515  -7.171 -14.703
  868   2HH2  ARG 114          2HH2      ARG 114   6.366  -8.479 -14.693
  869    H    ARG 115           H        ARG 115   3.884  -4.231 -11.560
  870    HA   ARG 115           HA       ARG 115   3.338  -1.699 -10.442
  871   1HB   ARG 115          1HB       ARG 115   1.547  -3.831 -11.586
  872   2HB   ARG 115          2HB       ARG 115   0.928  -2.294 -10.984
  873   1HG   ARG 115          1HG       ARG 115   2.381  -1.105 -12.562
  874   2HG   ARG 115          2HG       ARG 115   2.954  -2.651 -13.183
  875   1HD   ARG 115          1HD       ARG 115   0.796  -3.191 -14.034
  876   2HD   ARG 115          2HD       ARG 115   0.062  -1.815 -13.207
  877    HE   ARG 115           HE       ARG 115   1.902  -0.632 -14.782
  878   1HH1  ARG 115          1HH1      ARG 115  -0.536  -3.053 -15.495
  879   2HH1  ARG 115          2HH1      ARG 115  -0.830  -2.447 -17.103
  880   1HH2  ARG 115          1HH2      ARG 115   1.548   0.132 -16.866
  881   2HH2  ARG 115          2HH2      ARG 115   0.384  -0.642 -17.901
  882    H    VAL 116           H        VAL 116   3.433  -1.358  -8.406
  883    HA   VAL 116           HA       VAL 116   2.242  -3.283  -6.542
  884    HB   VAL 116           HB       VAL 116   4.602  -3.093  -6.152
  885   1HG1  VAL 116          1HG1      VAL 116   5.695  -0.953  -5.643
  886   2HG1  VAL 116          2HG1      VAL 116   5.043  -0.995  -7.281
  887   3HG1  VAL 116          3HG1      VAL 116   4.192  -0.109  -6.017
  888   1HG2  VAL 116          1HG2      VAL 116   3.070  -1.491  -4.109
  889   2HG2  VAL 116          2HG2      VAL 116   3.263  -3.244  -4.149
  890   3HG2  VAL 116          3HG2      VAL 116   4.660  -2.208  -3.854
  891    H    ALA 117           H        ALA 117   0.662  -2.642  -5.226
  892    HA   ALA 117           HA       ALA 117  -0.305   0.090  -5.386
  893   1HB   ALA 117          1HB       ALA 117  -1.925  -1.743  -5.413
  894   2HB   ALA 117          2HB       ALA 117  -1.357  -2.276  -3.831
  895   3HB   ALA 117          3HB       ALA 117  -2.160  -0.714  -3.999
  896    H    LEU 118           H        LEU 118   0.723   1.552  -4.183
  897    HA   LEU 118           HA       LEU 118   2.095   0.722  -1.763
  898   1HB   LEU 118          1HB       LEU 118   3.190   2.235  -3.385
  899   2HB   LEU 118          2HB       LEU 118   1.945   3.433  -3.088
  900    HG   LEU 118           HG       LEU 118   2.686   3.570  -0.722
  901   1HD1  LEU 118          1HD1      LEU 118   4.829   2.593  -0.089
  902   2HD1  LEU 118          2HD1      LEU 118   3.664   1.343  -0.528
  903   3HD1  LEU 118          3HD1      LEU 118   4.937   1.797  -1.659
  904   1HD2  LEU 118          1HD2      LEU 118   4.828   4.089  -2.781
  905   2HD2  LEU 118          2HD2      LEU 118   3.494   5.168  -2.376
  906   3HD2  LEU 118          3HD2      LEU 118   4.738   4.815  -1.177
  907    H    ALA 119           H        ALA 119   0.523   0.315  -0.267
  908    HA   ALA 119           HA       ALA 119  -1.469   2.359   0.305
  909   1HB   ALA 119          1HB       ALA 119  -2.157   0.008   0.327
  910   2HB   ALA 119          2HB       ALA 119  -0.998  -0.322   1.613
  911   3HB   ALA 119          3HB       ALA 119  -2.366   0.750   1.914
  912    H    MET 120           H        MET 120  -0.405   4.066   1.206
  913    HA   MET 120           HA       MET 120   1.484   3.539   3.371
  914   1HB   MET 120          1HB       MET 120   0.902   6.012   1.753
  915   2HB   MET 120          2HB       MET 120   1.922   6.033   3.185
  916   1HG   MET 120          1HG       MET 120   3.394   4.370   2.118
  917   2HG   MET 120          2HG       MET 120   2.401   4.461   0.665
  918   1HE   MET 120          1HE       MET 120   3.357   7.429   3.078
  919   2HE   MET 120          2HE       MET 120   4.841   8.013   2.324
  920   3HE   MET 120          3HE       MET 120   4.803   6.419   3.076
  921    H    ILE 121           H        ILE 121   0.584   3.323   5.262
  922    HA   ILE 121           HA       ILE 121  -1.675   4.996   6.028
  923    HB   ILE 121           HB       ILE 121  -0.276   2.763   7.516
  924   1HG1  ILE 121          1HG1      ILE 121  -2.985   2.828   6.165
  925   2HG1  ILE 121          2HG1      ILE 121  -1.548   2.057   5.502
  926   1HG2  ILE 121          1HG2      ILE 121  -1.242   4.388   9.055
  927   2HG2  ILE 121          2HG2      ILE 121  -2.791   4.271   8.220
  928   3HG2  ILE 121          3HG2      ILE 121  -2.149   2.876   9.086
  929   1HD1  ILE 121          1HD1      ILE 121  -2.926   1.290   8.066
  930   2HD1  ILE 121          2HD1      ILE 121  -3.055   0.442   6.524
  931   3HD1  ILE 121          3HD1      ILE 121  -1.509   0.503   7.371
  932    H    VAL 122           H        VAL 122  -0.871   7.015   6.332
  933    HA   VAL 122           HA       VAL 122   1.393   7.356   8.153
  934    HB   VAL 122           HB       VAL 122  -0.126   9.474   6.614
  935   1HG1  VAL 122          1HG1      VAL 122   1.025  10.360   8.557
  936   2HG1  VAL 122          2HG1      VAL 122   2.522   9.574   8.055
  937   3HG1  VAL 122          3HG1      VAL 122   1.840  10.875   7.081
  938   1HG2  VAL 122          1HG2      VAL 122   1.760   9.478   5.054
  939   2HG2  VAL 122          2HG2      VAL 122   2.484   8.126   5.925
  940   3HG2  VAL 122          3HG2      VAL 122   0.951   7.910   5.081
  941    H    GLY 123           H        GLY 123   1.092   7.882  10.228
  942   1HA   GLY 123          1HA       GLY 123  -0.919   9.552  11.220
  943   2HA   GLY 123          2HA       GLY 123  -1.460   7.887  11.396
  944    H    GLY 124           H        GLY 124  -1.339   8.881  13.694
  945   1HA   GLY 124          1HA       GLY 124   0.411   7.478  15.233
  946   2HA   GLY 124          2HA       GLY 124   1.271   8.975  14.886
  947    H    LEU 125           H        LEU 125  -0.130   7.695  17.324
  948    HA   LEU 125           HA       LEU 125  -2.155   9.682  17.931
  949   1HB   LEU 125          1HB       LEU 125  -1.101   7.318  19.479
  950   2HB   LEU 125          2HB       LEU 125  -2.258   8.449  20.149
  951    HG   LEU 125           HG       LEU 125  -3.779   7.851  18.198
  952   1HD1  LEU 125          1HD1      LEU 125  -1.843   5.555  17.941
  953   2HD1  LEU 125          2HD1      LEU 125  -3.403   5.692  17.131
  954   3HD1  LEU 125          3HD1      LEU 125  -2.108   6.827  16.748
  955   1HD2  LEU 125          1HD2      LEU 125  -4.579   5.819  19.292
  956   2HD2  LEU 125          2HD2      LEU 125  -3.065   5.703  20.189
  957   3HD2  LEU 125          3HD2      LEU 125  -4.154   7.061  20.470
  958    H    GLU 126           H        GLU 126  -0.981  11.587  18.007
  959    HA   GLU 126           HA       GLU 126   0.278  12.073  20.561
  960   1HB   GLU 126          1HB       GLU 126   2.112  11.296  18.981
  961   2HB   GLU 126          2HB       GLU 126   1.809  12.755  18.046
  962   1HG   GLU 126          1HG       GLU 126   3.716  12.943  19.609
  963   2HG   GLU 126          2HG       GLU 126   2.452  14.142  19.884
  964    H    HIS 127           H        HIS 127   0.537  14.390  20.973
  965    HA   HIS 127           HA       HIS 127  -1.272  15.993  19.273
  966   1HB   HIS 127          1HB       HIS 127  -0.910  16.117  22.275
  967   2HB   HIS 127          2HB       HIS 127  -1.856  17.267  21.338
  968    HD1  HIS 127           HD1      HIS 127  -2.907  15.285  23.624
  969    HD2  HIS 127           HD2      HIS 127  -3.363  14.836  19.511
  970    HE1  HIS 127           HE1      HIS 127  -4.914  13.796  23.318
  971    HE2  HIS 127           HE2      HIS 127  -5.208  13.576  20.823
  972    H    HIS 128           H        HIS 128  -0.962  18.427  19.848
  973    HA   HIS 128           HA       HIS 128   0.314  20.297  19.732
  974   1HB   HIS 128          1HB       HIS 128   0.932  19.327  22.024
  975   2HB   HIS 128          2HB       HIS 128   2.419  18.773  21.266
  976    HD1  HIS 128           HD1      HIS 128   0.600  22.125  21.237
  977    HD2  HIS 128           HD2      HIS 128   4.364  20.509  21.931
  978    HE1  HIS 128           HE1      HIS 128   2.081  24.077  21.789
  979    HE2  HIS 128           HE2      HIS 128   4.280  23.044  22.454
  980    H    HIS 129           H        HIS 129   0.384  18.953  17.451
  981    HA   HIS 129           HA       HIS 129   2.905  17.947  16.658
  982   1HB   HIS 129          1HB       HIS 129   2.025  17.835  14.406
  983   2HB   HIS 129          2HB       HIS 129   0.796  17.296  15.539
  984    HD1  HIS 129           HD1      HIS 129   1.581  20.052  13.106
  985    HD2  HIS 129           HD2      HIS 129  -1.513  18.878  15.631
  986    HE1  HIS 129           HE1      HIS 129  -0.405  21.441  12.442
  987    HE2  HIS 129           HE2      HIS 129  -2.227  20.812  14.067
  988    H    HIS 130           H        HIS 130   4.677  19.024  16.413
  989    HA   HIS 130           HA       HIS 130   6.192  20.642  15.848
  990   1HB   HIS 130          1HB       HIS 130   5.480  19.356  13.754
  991   2HB   HIS 130          2HB       HIS 130   4.566  20.794  13.317
  992    HD1  HIS 130           HD1      HIS 130   5.794  22.363  11.863
  993    HD2  HIS 130           HD2      HIS 130   8.358  20.052  14.182
  994    HE1  HIS 130           HE1      HIS 130   8.120  22.988  11.135
  995    HE2  HIS 130           HE2      HIS 130   9.641  21.767  12.737
  996    H    HIS 131           H        HIS 131   5.453  22.233  17.410
  997    HA   HIS 131           HA       HIS 131   3.488  24.160  16.809
  998   1HB   HIS 131          1HB       HIS 131   4.304  25.398  18.740
  999   2HB   HIS 131          2HB       HIS 131   4.214  23.685  19.112
 1000    HD1  HIS 131           HD1      HIS 131   6.487  22.421  19.439
 1001    HD2  HIS 131           HD2      HIS 131   6.838  26.531  18.894
 1002    HE1  HIS 131           HE1      HIS 131   8.823  23.007  20.161
 1003    HE2  HIS 131           HE2      HIS 131   8.944  25.519  20.009
 1004    H    HIS 132           H        HIS 132   3.507  25.710  15.379
 1005    HA   HIS 132           HA       HIS 132   5.732  27.499  15.107
 1006   1HB   HIS 132          1HB       HIS 132   5.268  25.409  13.093
 1007   2HB   HIS 132          2HB       HIS 132   5.306  27.037  12.426
 1008    HD1  HIS 132           HD1      HIS 132   7.541  28.422  12.894
 1009    HD2  HIS 132           HD2      HIS 132   7.717  24.355  13.715
 1010    HE1  HIS 132           HE1      HIS 132   9.987  27.870  13.058
 1011    HE2  HIS 132           HE2      HIS 132  10.045  25.473  13.832
  Start of MODEL    7
    1   1H    MET   1          1HT       MET   1  -4.221  14.805 -36.358
    2   2H    MET   1          2HT       MET   1  -4.837  15.433 -37.808
    3   3H    MET   1          3HT       MET   1  -3.236  14.891 -37.735
    4    HA   MET   1           HA       MET   1  -5.682  13.255 -37.486
    5   1HB   MET   1          1HB       MET   1  -3.576  13.397 -39.646
    6   2HB   MET   1          2HB       MET   1  -4.792  12.132 -39.546
    7   1HG   MET   1          1HG       MET   1  -5.299  15.074 -39.911
    8   2HG   MET   1          2HG       MET   1  -5.446  13.821 -41.141
    9   1HE   MET   1          1HE       MET   1  -8.517  11.763 -39.873
   10   2HE   MET   1          2HE       MET   1  -6.808  11.440 -39.573
   11   3HE   MET   1          3HE       MET   1  -7.337  11.975 -41.167
   12    HA   PRO   2           HA       PRO   2  -1.979  10.476 -36.231
   13   1HB   PRO   2          1HB       PRO   2   0.416  11.688 -35.802
   14   2HB   PRO   2          2HB       PRO   2  -0.009  10.921 -37.335
   15   1HG   PRO   2          1HG       PRO   2  -0.053  13.813 -36.587
   16   2HG   PRO   2          2HG       PRO   2   0.476  13.053 -38.099
   17   1HD   PRO   2          1HD       PRO   2  -1.945  14.256 -37.813
   18   2HD   PRO   2          2HD       PRO   2  -1.665  12.895 -38.915
   19    H    LEU   3           H        LEU   3  -2.498  10.161 -34.153
   20    HA   LEU   3           HA       LEU   3  -2.891  12.457 -32.417
   21   1HB   LEU   3          1HB       LEU   3  -3.469   9.522 -32.022
   22   2HB   LEU   3          2HB       LEU   3  -3.774  10.745 -30.807
   23    HG   LEU   3           HG       LEU   3  -5.278  11.850 -32.595
   24   1HD1  LEU   3          1HD1      LEU   3  -5.107   9.052 -33.701
   25   2HD1  LEU   3          2HD1      LEU   3  -6.274  10.282 -34.186
   26   3HD1  LEU   3          3HD1      LEU   3  -4.556  10.524 -34.499
   27   1HD2  LEU   3          1HD2      LEU   3  -6.045   9.232 -31.314
   28   2HD2  LEU   3          2HD2      LEU   3  -6.107  10.822 -30.554
   29   3HD2  LEU   3          3HD2      LEU   3  -7.169  10.452 -31.913
   30    H    ASN   4           H        ASN   4  -1.471  13.119 -30.948
   31    HA   ASN   4           HA       ASN   4   0.869  11.507 -30.371
   32   1HB   ASN   4          1HB       ASN   4   1.706  13.426 -29.165
   33   2HB   ASN   4          2HB       ASN   4   1.033  13.985 -30.692
   34   1HD2  ASN   4          2HD2      ASN   4   0.764  14.032 -27.255
   35   2HD2  ASN   4          1HD2      ASN   4  -0.474  15.237 -27.152
   36    H    GLN   5           H        GLN   5   1.492  10.961 -28.173
   37    HA   GLN   5           HA       GLN   5  -0.642   9.770 -26.742
   38   1HB   GLN   5          1HB       GLN   5   1.644   8.848 -26.735
   39   2HB   GLN   5          2HB       GLN   5   2.206  10.260 -25.847
   40   1HG   GLN   5          1HG       GLN   5   0.771   9.666 -23.972
   41   2HG   GLN   5          2HG       GLN   5   0.180   8.262 -24.860
   42   1HE2  GLN   5          2HE2      GLN   5   1.539   6.500 -25.173
   43   2HE2  GLN   5          1HE2      GLN   5   2.966   6.267 -24.218
   44    H    GLU   6           H        GLU   6  -2.099  10.896 -25.656
   45    HA   GLU   6           HA       GLU   6  -1.302  13.348 -24.299
   46   1HB   GLU   6          1HB       GLU   6  -3.983  12.135 -24.911
   47   2HB   GLU   6          2HB       GLU   6  -3.809  13.477 -23.788
   48   1HG   GLU   6          1HG       GLU   6  -2.616  14.693 -25.673
   49   2HG   GLU   6          2HG       GLU   6  -3.235  13.422 -26.729
   50    H    HIS   7           H        HIS   7  -0.872  13.438 -22.249
   51    HA   HIS   7           HA       HIS   7  -2.014  11.404 -20.459
   52   1HB   HIS   7          1HB       HIS   7   0.116  11.473 -19.143
   53   2HB   HIS   7          2HB       HIS   7   0.296  10.767 -20.744
   54    HD1  HIS   7           HD1      HIS   7   1.527  13.482 -18.580
   55    HD2  HIS   7           HD2      HIS   7   1.713  12.431 -22.603
   56    HE1  HIS   7           HE1      HIS   7   3.374  14.884 -19.570
   57    HE2  HIS   7           HE2      HIS   7   3.392  14.311 -22.027
   58    HA   PRO   8           HA       PRO   8  -3.574  14.881 -18.312
   59   1HB   PRO   8          1HB       PRO   8  -3.455  13.325 -15.823
   60   2HB   PRO   8          2HB       PRO   8  -4.861  13.933 -16.701
   61   1HG   PRO   8          1HG       PRO   8  -4.260  11.317 -16.639
   62   2HG   PRO   8          2HG       PRO   8  -4.968  12.078 -18.075
   63   1HD   PRO   8          1HD       PRO   8  -2.112  11.344 -17.534
   64   2HD   PRO   8          2HD       PRO   8  -3.066  11.130 -19.018
   65    H    ASP   9           H        ASP   9  -1.424  15.904 -18.621
   66    HA   ASP   9           HA       ASP   9   0.179  17.294 -17.872
   67   1HB   ASP   9          1HB       ASP   9  -1.557  17.035 -15.466
   68   2HB   ASP   9          2HB       ASP   9   0.005  17.827 -15.287
   69    H    TYR  10           H        TYR  10   0.099  15.722 -14.746
   70    HA   TYR  10           HA       TYR  10   2.452  14.148 -15.277
   71   1HB   TYR  10          1HB       TYR  10   3.758  15.397 -13.453
   72   2HB   TYR  10          2HB       TYR  10   3.650  16.166 -15.033
   73    HD1  TYR  10           HD1      TYR  10   2.401  18.195 -15.349
   74    HD2  TYR  10           HD2      TYR  10   2.536  16.325 -11.529
   75    HE1  TYR  10           HE1      TYR  10   1.492  20.234 -14.327
   76    HE2  TYR  10           HE2      TYR  10   1.619  18.362 -10.496
   77    HH   TYR  10           HH       TYR  10   0.193  20.833 -12.262
   78    H    THR  11           H        THR  11   3.263  13.149 -13.179
   79    HA   THR  11           HA       THR  11   0.896  12.330 -11.677
   80    HB   THR  11           HB       THR  11   2.472  10.505 -10.842
   81    HG1  THR  11           HG1      THR  11   4.070  10.880 -13.089
   82   1HG2  THR  11          1HG2      THR  11   1.913  10.657 -13.807
   83   2HG2  THR  11          2HG2      THR  11   2.252   9.187 -12.894
   84   3HG2  THR  11          3HG2      THR  11   0.782  10.107 -12.571
   85    H    TYR  12           H        TYR  12   0.997  12.097  -9.360
   86    HA   TYR  12           HA       TYR  12   2.647  14.148  -8.106
   87   1HB   TYR  12          1HB       TYR  12   0.410  12.468  -6.943
   88   2HB   TYR  12          2HB       TYR  12   1.214  13.811  -6.136
   89    HD1  TYR  12           HD1      TYR  12   1.154  16.089  -7.497
   90    HD2  TYR  12           HD2      TYR  12  -1.591  12.880  -8.018
   91    HE1  TYR  12           HE1      TYR  12  -0.479  17.652  -8.462
   92    HE2  TYR  12           HE2      TYR  12  -3.233  14.435  -8.986
   93    HH   TYR  12           HH       TYR  12  -2.427  17.597  -9.947
   94    H    ALA  13           H        ALA  13   4.613  13.499  -7.541
   95    HA   ALA  13           HA       ALA  13   5.060  10.684  -6.929
   96   1HB   ALA  13          1HB       ALA  13   7.421  11.181  -7.216
   97   2HB   ALA  13          2HB       ALA  13   6.491  11.758  -8.599
   98   3HB   ALA  13          3HB       ALA  13   7.054  12.898  -7.377
   99    H    LEU  14           H        LEU  14   5.989   9.936  -5.065
  100    HA   LEU  14           HA       LEU  14   5.670  11.487  -2.684
  101   1HB   LEU  14          1HB       LEU  14   5.332   9.066  -2.673
  102   2HB   LEU  14          2HB       LEU  14   6.997   8.813  -3.157
  103    HG   LEU  14           HG       LEU  14   7.729   9.822  -0.999
  104   1HD1  LEU  14          1HD1      LEU  14   4.791   9.703  -0.338
  105   2HD1  LEU  14          2HD1      LEU  14   6.093  10.056   0.798
  106   3HD1  LEU  14          3HD1      LEU  14   5.755  11.167  -0.531
  107   1HD2  LEU  14          1HD2      LEU  14   7.580   7.402  -1.288
  108   2HD2  LEU  14          2HD2      LEU  14   7.175   7.878   0.361
  109   3HD2  LEU  14          3HD2      LEU  14   5.894   7.440  -0.768
  110    H    ARG  15           H        ARG  15   7.031  13.058  -2.166
  111    HA   ARG  15           HA       ARG  15   9.667  13.241  -3.259
  112   1HB   ARG  15          1HB       ARG  15   8.333  14.838  -1.063
  113   2HB   ARG  15          2HB       ARG  15   9.866  15.248  -1.821
  114   1HG   ARG  15          1HG       ARG  15   8.730  15.510  -3.972
  115   2HG   ARG  15          2HG       ARG  15   7.195  15.104  -3.203
  116   1HD   ARG  15          1HD       ARG  15   7.432  17.513  -3.444
  117   2HD   ARG  15          2HD       ARG  15   7.411  17.052  -1.743
  118    HE   ARG  15           HE       ARG  15  10.070  17.240  -2.796
  119   1HH1  ARG  15          1HH1      ARG  15   7.403  19.081  -1.476
  120   2HH1  ARG  15          2HH1      ARG  15   8.400  20.413  -0.975
  121   1HH2  ARG  15          1HH2      ARG  15  11.398  18.958  -2.074
  122   2HH2  ARG  15          2HH2      ARG  15  10.677  20.332  -1.285
  123    H    ALA  16           H        ALA  16   8.387  12.729   0.010
  124    HA   ALA  16           HA       ALA  16  10.348  10.836   0.723
  125   1HB   ALA  16          1HB       ALA  16  11.619  12.111   2.371
  126   2HB   ALA  16          2HB       ALA  16  11.836  12.780   0.753
  127   3HB   ALA  16          3HB       ALA  16  10.765  13.583   1.901
  128    H    ALA  17           H        ALA  17   9.673   9.712   2.450
  129    HA   ALA  17           HA       ALA  17   7.492  10.845   4.075
  130   1HB   ALA  17          1HB       ALA  17   8.164   7.945   3.555
  131   2HB   ALA  17          2HB       ALA  17   6.834   8.534   4.552
  132   3HB   ALA  17          3HB       ALA  17   6.840   8.846   2.816
  133    H    ASP  18           H        ASP  18   7.801  11.034   6.239
  134    HA   ASP  18           HA       ASP  18  10.426  10.144   7.232
  135   1HB   ASP  18          1HB       ASP  18  10.367  12.098   8.749
  136   2HB   ASP  18          2HB       ASP  18  10.342  12.557   7.053
  137    H    GLY  19           H        GLY  19   7.762   8.781   7.319
  138   1HA   GLY  19          1HA       GLY  19   7.535   7.049   9.030
  139   2HA   GLY  19          2HA       GLY  19   7.801   8.303  10.230
  140    H    ARG  20           H        ARG  20   6.101   9.353  11.060
  141    HA   ARG  20           HA       ARG  20   3.450   8.440  10.342
  142   1HB   ARG  20          1HB       ARG  20   2.711   9.566  12.307
  143   2HB   ARG  20          2HB       ARG  20   4.261   8.842  12.711
  144   1HG   ARG  20          1HG       ARG  20   5.314  11.067  12.232
  145   2HG   ARG  20          2HG       ARG  20   3.684  11.730  12.108
  146   1HD   ARG  20          1HD       ARG  20   3.252  10.905  14.423
  147   2HD   ARG  20          2HD       ARG  20   4.951  10.438  14.521
  148    HE   ARG  20           HE       ARG  20   3.862  13.092  14.714
  149   1HH1  ARG  20          1HH1      ARG  20   6.728  11.213  13.975
  150   2HH1  ARG  20          2HH1      ARG  20   7.817  12.549  14.224
  151   1HH2  ARG  20          1HH2      ARG  20   5.278  14.829  15.059
  152   2HH2  ARG  20          2HH2      ARG  20   6.993  14.595  14.882
  153    H    HIS  21           H        HIS  21   5.247  10.327   8.691
  154    HA   HIS  21           HA       HIS  21   3.139  12.149   7.871
  155   1HB   HIS  21          1HB       HIS  21   4.323  13.440   9.551
  156   2HB   HIS  21          2HB       HIS  21   5.868  13.071   8.804
  157    HD1  HIS  21           HD1      HIS  21   6.631  14.545   6.915
  158    HD2  HIS  21           HD2      HIS  21   2.742  15.351   8.148
  159    HE1  HIS  21           HE1      HIS  21   5.997  16.709   5.794
  160    HE2  HIS  21           HE2      HIS  21   3.742  17.296   6.768
  161    H    ALA  22           H        ALA  22   3.334  12.781   5.721
  162    HA   ALA  22           HA       ALA  22   5.635  11.756   4.222
  163   1HB   ALA  22          1HB       ALA  22   2.761  11.164   3.522
  164   2HB   ALA  22          2HB       ALA  22   4.169  10.745   2.544
  165   3HB   ALA  22          3HB       ALA  22   3.945  10.005   4.128
  166    H    LYS  23           H        LYS  23   5.701  12.588   1.984
  167    HA   LYS  23           HA       LYS  23   4.188  15.070   1.570
  168   1HB   LYS  23          1HB       LYS  23   7.178  14.781   1.191
  169   2HB   LYS  23          2HB       LYS  23   6.233  16.186   0.730
  170   1HG   LYS  23          1HG       LYS  23   5.629  16.508   3.107
  171   2HG   LYS  23          2HG       LYS  23   6.689  15.163   3.522
  172   1HD   LYS  23          1HD       LYS  23   7.535  17.717   2.156
  173   2HD   LYS  23          2HD       LYS  23   7.791  17.327   3.856
  174   1HE   LYS  23          1HE       LYS  23   8.937  15.845   1.490
  175   2HE   LYS  23          2HE       LYS  23   9.814  16.939   2.560
  176   1HZ   LYS  23          1HZ       LYS  23  10.312  14.805   3.324
  177   2HZ   LYS  23          2HZ       LYS  23   9.135  15.363   4.403
  178   3HZ   LYS  23          3HZ       LYS  23   8.715  14.265   3.181
  179    H    VAL  24           H        VAL  24   2.985  14.475  -0.154
  180    HA   VAL  24           HA       VAL  24   4.370  13.216  -2.435
  181    HB   VAL  24           HB       VAL  24   1.393  13.271  -1.885
  182   1HG1  VAL  24          1HG1      VAL  24   3.005  11.743  -3.924
  183   2HG1  VAL  24          2HG1      VAL  24   1.268  11.587  -3.658
  184   3HG1  VAL  24          3HG1      VAL  24   1.937  13.109  -4.251
  185   1HG2  VAL  24          1HG2      VAL  24   3.376  11.035  -1.479
  186   2HG2  VAL  24          2HG2      VAL  24   2.527  11.920  -0.212
  187   3HG2  VAL  24          3HG2      VAL  24   1.624  10.893  -1.326
  188    H    ASN  25           H        ASN  25   4.955  14.710  -3.872
  189    HA   ASN  25           HA       ASN  25   5.058  16.596  -5.118
  190   1HB   ASN  25          1HB       ASN  25   3.020  15.602  -6.146
  191   2HB   ASN  25          2HB       ASN  25   2.033  16.523  -5.015
  192   1HD2  ASN  25          2HD2      ASN  25   4.069  16.668  -7.831
  193   2HD2  ASN  25          1HD2      ASN  25   3.648  18.288  -8.285
  194    H    GLU  26           H        GLU  26   2.048  17.746  -3.690
  195    HA   GLU  26           HA       GLU  26   3.530  19.170  -1.613
  196   1HB   GLU  26          1HB       GLU  26   2.382  21.288  -2.060
  197   2HB   GLU  26          2HB       GLU  26   3.391  20.803  -3.414
  198   1HG   GLU  26          1HG       GLU  26   1.573  20.306  -4.759
  199   2HG   GLU  26          2HG       GLU  26   0.477  20.149  -3.386
  200    H    GLN  27           H        GLN  27   1.343  17.030  -2.201
  201    HA   GLN  27           HA       GLN  27  -0.797  18.077  -0.529
  202   1HB   GLN  27          1HB       GLN  27  -0.527  15.548  -2.157
  203   2HB   GLN  27          2HB       GLN  27  -1.869  15.831  -1.059
  204   1HG   GLN  27          1HG       GLN  27  -2.795  16.522  -3.015
  205   2HG   GLN  27          2HG       GLN  27  -2.127  18.043  -2.435
  206   1HE2  GLN  27          2HE2      GLN  27  -2.785  17.294  -5.128
  207   2HE2  GLN  27          1HE2      GLN  27  -1.326  17.416  -6.050
  208    H    ILE  28           H        ILE  28  -0.243  18.047   1.545
  209    HA   ILE  28           HA       ILE  28   1.269  15.850   2.663
  210    HB   ILE  28           HB       ILE  28   0.024  18.229   4.061
  211   1HG1  ILE  28          1HG1      ILE  28   2.890  17.756   3.200
  212   2HG1  ILE  28          2HG1      ILE  28   1.758  18.831   2.388
  213   1HG2  ILE  28          1HG2      ILE  28   0.396  16.348   5.568
  214   2HG2  ILE  28          2HG2      ILE  28   2.069  16.227   5.024
  215   3HG2  ILE  28          3HG2      ILE  28   1.530  17.654   5.910
  216   1HD1  ILE  28          1HD1      ILE  28   1.631  20.212   4.391
  217   2HD1  ILE  28          2HD1      ILE  28   2.752  19.128   5.212
  218   3HD1  ILE  28          3HD1      ILE  28   3.290  20.059   3.815
  219    H    LEU  29           H        LEU  29  -0.103  14.123   2.346
  220    HA   LEU  29           HA       LEU  29  -2.779  14.142   3.407
  221   1HB   LEU  29          1HB       LEU  29  -1.121  11.873   2.294
  222   2HB   LEU  29          2HB       LEU  29  -2.833  11.793   2.668
  223    HG   LEU  29           HG       LEU  29  -1.609  13.609   0.586
  224   1HD1  LEU  29          1HD1      LEU  29  -3.158  11.047   0.255
  225   2HD1  LEU  29          2HD1      LEU  29  -2.640  12.118  -1.046
  226   3HD1  LEU  29          3HD1      LEU  29  -1.439  11.272  -0.069
  227   1HD2  LEU  29          1HD2      LEU  29  -4.489  12.991   1.232
  228   2HD2  LEU  29          2HD2      LEU  29  -3.654  14.509   1.563
  229   3HD2  LEU  29          3HD2      LEU  29  -3.920  13.994  -0.102
  230    H    GLN  30           H        GLN  30  -3.386  13.537   5.367
  231    HA   GLN  30           HA       GLN  30  -1.325  12.425   7.151
  232   1HB   GLN  30          1HB       GLN  30  -3.555  14.383   7.707
  233   2HB   GLN  30          2HB       GLN  30  -2.578  13.635   8.966
  234   1HG   GLN  30          1HG       GLN  30  -0.679  14.797   8.377
  235   2HG   GLN  30          2HG       GLN  30  -1.233  15.073   6.728
  236   1HE2  GLN  30          2HE2      GLN  30  -2.623  16.751   6.302
  237   2HE2  GLN  30          1HE2      GLN  30  -2.909  18.038   7.425
  238    H    GLN  31           H        GLN  31  -3.101  10.898   5.534
  239    HA   GLN  31           HA       GLN  31  -4.133   9.184   7.616
  240   1HB   GLN  31          1HB       GLN  31  -6.339   8.883   6.603
  241   2HB   GLN  31          2HB       GLN  31  -6.111  10.549   7.106
  242   1HG   GLN  31          1HG       GLN  31  -5.621   9.695   4.279
  243   2HG   GLN  31          2HG       GLN  31  -7.238  10.092   4.857
  244   1HE2  GLN  31          2HE2      GLN  31  -6.254  12.142   6.679
  245   2HE2  GLN  31          1HE2      GLN  31  -5.819  13.501   5.694
  246    H    SER  32           H        SER  32  -5.340   7.259   6.114
  247    HA   SER  32           HA       SER  32  -3.129   6.099   4.731
  248   1HB   SER  32          1HB       SER  32  -6.007   5.167   4.873
  249   2HB   SER  32          2HB       SER  32  -4.622   4.195   4.371
  250    HG   SER  32           HG       SER  32  -5.394   5.034   6.924
  251    H    PHE  33           H        PHE  33  -2.746   5.932   2.580
  252    HA   PHE  33           HA       PHE  33  -4.850   6.442   0.655
  253   1HB   PHE  33          1HB       PHE  33  -3.644   8.182  -0.555
  254   2HB   PHE  33          2HB       PHE  33  -3.968   8.708   1.091
  255    HD1  PHE  33           HD1      PHE  33  -1.423   7.897  -1.360
  256    HD2  PHE  33           HD2      PHE  33  -2.131   8.839   2.731
  257    HE1  PHE  33           HE1      PHE  33   0.961   8.424  -1.071
  258    HE2  PHE  33           HE2      PHE  33   0.251   9.367   3.025
  259    HZ   PHE  33           HZ       PHE  33   1.802   9.160   1.124
  260    H    ILE  34           H        ILE  34  -4.160   5.899  -1.555
  261    HA   ILE  34           HA       ILE  34  -1.977   3.914  -1.497
  262    HB   ILE  34           HB       ILE  34  -4.281   3.949  -3.444
  263   1HG1  ILE  34          1HG1      ILE  34  -3.999   2.256  -0.949
  264   2HG1  ILE  34          2HG1      ILE  34  -5.083   3.635  -1.103
  265   1HG2  ILE  34          1HG2      ILE  34  -2.266   1.827  -2.721
  266   2HG2  ILE  34          2HG2      ILE  34  -3.600   1.628  -3.857
  267   3HG2  ILE  34          3HG2      ILE  34  -2.305   2.771  -4.211
  268   1HD1  ILE  34          1HD1      ILE  34  -6.303   2.489  -2.869
  269   2HD1  ILE  34          2HD1      ILE  34  -5.208   1.112  -2.736
  270   3HD1  ILE  34          3HD1      ILE  34  -6.265   1.533  -1.388
  271    H    LEU  35           H        LEU  35  -0.225   4.530  -2.544
  272    HA   LEU  35           HA       LEU  35  -0.464   6.415  -4.793
  273   1HB   LEU  35          1HB       LEU  35   0.985   7.162  -2.981
  274   2HB   LEU  35          2HB       LEU  35   1.899   5.670  -3.062
  275    HG   LEU  35           HG       LEU  35   2.664   6.293  -5.336
  276   1HD1  LEU  35          1HD1      LEU  35   1.270   8.901  -4.746
  277   2HD1  LEU  35          2HD1      LEU  35   2.329   8.582  -6.121
  278   3HD1  LEU  35          3HD1      LEU  35   0.796   7.724  -5.970
  279   1HD2  LEU  35          1HD2      LEU  35   4.042   6.787  -3.392
  280   2HD2  LEU  35          2HD2      LEU  35   4.208   8.050  -4.613
  281   3HD2  LEU  35          3HD2      LEU  35   3.216   8.331  -3.182
  282    H    MET  36           H        MET  36  -0.252   5.603  -6.786
  283    HA   MET  36           HA       MET  36   1.383   3.183  -7.146
  284   1HB   MET  36          1HB       MET  36  -1.355   3.652  -8.348
  285   2HB   MET  36          2HB       MET  36  -0.308   2.287  -8.701
  286   1HG   MET  36          1HG       MET  36  -0.483   1.543  -6.391
  287   2HG   MET  36          2HG       MET  36  -1.512   2.925  -6.019
  288   1HE   MET  36          1HE       MET  36  -2.737  -0.455  -8.917
  289   2HE   MET  36          2HE       MET  36  -1.188  -0.409  -8.074
  290   3HE   MET  36          3HE       MET  36  -1.549   0.784  -9.322
  291    HA   PRO  37           HA       PRO  37   2.732   5.331 -10.900
  292   1HB   PRO  37          1HB       PRO  37   3.402   2.713 -12.008
  293   2HB   PRO  37          2HB       PRO  37   4.485   4.023 -11.533
  294   1HG   PRO  37          1HG       PRO  37   4.338   1.676 -10.183
  295   2HG   PRO  37          2HG       PRO  37   4.743   3.215  -9.401
  296   1HD   PRO  37          1HD       PRO  37   2.135   1.741  -9.451
  297   2HD   PRO  37          2HD       PRO  37   2.922   2.594  -8.105
  298    H    ASP  38           H        ASP  38   0.037   4.826 -10.590
  299    HA   ASP  38           HA       ASP  38  -0.890   4.014 -13.229
  300   1HB   ASP  38          1HB       ASP  38  -0.836   1.959 -11.758
  301   2HB   ASP  38          2HB       ASP  38  -1.971   2.766 -10.685
  302    H    GLU  39           H        GLU  39  -1.939   4.811  -9.928
  303    HA   GLU  39           HA       GLU  39  -2.915   7.369 -10.736
  304   1HB   GLU  39          1HB       GLU  39  -5.238   7.074 -10.094
  305   2HB   GLU  39          2HB       GLU  39  -4.835   5.967 -11.396
  306   1HG   GLU  39          1HG       GLU  39  -4.678   4.131  -9.832
  307   2HG   GLU  39          2HG       GLU  39  -4.975   5.227  -8.483
  308    H    LEU  40           H        LEU  40  -4.083   8.404  -8.755
  309    HA   LEU  40           HA       LEU  40  -2.720   7.488  -6.308
  310   1HB   LEU  40          1HB       LEU  40  -1.877   9.645  -7.069
  311   2HB   LEU  40          2HB       LEU  40  -3.507  10.287  -7.129
  312    HG   LEU  40           HG       LEU  40  -3.682  10.058  -4.679
  313   1HD1  LEU  40          1HD1      LEU  40  -1.691   9.567  -3.358
  314   2HD1  LEU  40          2HD1      LEU  40  -2.140   8.195  -4.371
  315   3HD1  LEU  40          3HD1      LEU  40  -0.788   9.228  -4.834
  316   1HD2  LEU  40          1HD2      LEU  40  -2.939  12.168  -5.651
  317   2HD2  LEU  40          2HD2      LEU  40  -2.145  11.870  -4.104
  318   3HD2  LEU  40          3HD2      LEU  40  -1.268  11.607  -5.612
  319    H    VAL  41           H        VAL  41  -4.100   6.536  -4.980
  320    HA   VAL  41           HA       VAL  41  -6.908   7.403  -4.962
  321    HB   VAL  41           HB       VAL  41  -5.743   4.980  -3.586
  322   1HG1  VAL  41          1HG1      VAL  41  -8.574   5.694  -4.327
  323   2HG1  VAL  41          2HG1      VAL  41  -8.058   4.190  -3.566
  324   3HG1  VAL  41          3HG1      VAL  41  -7.883   5.719  -2.704
  325   1HG2  VAL  41          1HG2      VAL  41  -5.328   4.780  -5.973
  326   2HG2  VAL  41          2HG2      VAL  41  -6.584   3.652  -5.466
  327   3HG2  VAL  41          3HG2      VAL  41  -7.021   5.137  -6.313
  328    H    GLU  42           H        GLU  42  -6.624   9.302  -3.742
  329    HA   GLU  42           HA       GLU  42  -5.504   8.965  -1.065
  330   1HB   GLU  42          1HB       GLU  42  -5.802  11.554  -1.065
  331   2HB   GLU  42          2HB       GLU  42  -4.479  10.818  -1.955
  332   1HG   GLU  42          1HG       GLU  42  -5.438  12.540  -3.291
  333   2HG   GLU  42          2HG       GLU  42  -5.832  10.985  -4.018
  334    H    HIS  43           H        HIS  43  -8.490   8.973  -2.573
  335    HA   HIS  43           HA       HIS  43  -9.890   9.900  -0.184
  336   1HB   HIS  43          1HB       HIS  43 -10.685   9.401  -3.002
  337   2HB   HIS  43          2HB       HIS  43 -11.912   9.123  -1.769
  338    HD1  HIS  43           HD1      HIS  43  -9.838  11.851  -3.314
  339    HD2  HIS  43           HD2      HIS  43 -12.913  11.418  -0.541
  340    HE1  HIS  43           HE1      HIS  43 -10.730  14.173  -2.911
  341    HE2  HIS  43           HE2      HIS  43 -12.629  13.887  -1.277
  342    H    TRP  44           H        TRP  44  -8.356   7.713   0.240
  343    HA   TRP  44           HA       TRP  44 -10.404   5.709   0.895
  344   1HB   TRP  44          1HB       TRP  44  -8.879   4.951  -0.990
  345   2HB   TRP  44          2HB       TRP  44  -7.540   5.044   0.146
  346    HD1  TRP  44           HD1      TRP  44 -10.924   3.170  -0.173
  347    HE1  TRP  44           HE1      TRP  44 -10.629   0.820   0.844
  348    HE3  TRP  44           HE3      TRP  44  -6.109   3.610   1.500
  349    HZ2  TRP  44           HZ2      TRP  44  -8.618  -0.647   2.176
  350    HZ3  TRP  44           HZ3      TRP  44  -5.074   1.686   2.634
  351    HH2  TRP  44           HH2      TRP  44  -6.305  -0.397   2.965
  352    HA   PRO  45           HA       PRO  45  -7.873   7.399   4.369
  353   1HB   PRO  45          1HB       PRO  45  -9.924   8.669   5.702
  354   2HB   PRO  45          2HB       PRO  45  -8.904   9.413   4.471
  355   1HG   PRO  45          1HG       PRO  45 -11.700   8.761   4.320
  356   2HG   PRO  45          2HG       PRO  45 -10.694   9.578   3.115
  357   1HD   PRO  45          1HD       PRO  45 -11.569   6.777   3.232
  358   2HD   PRO  45          2HD       PRO  45 -10.946   7.705   1.855
  359    H    VAL  46           H        VAL  46  -7.681   5.184   5.060
  360    HA   VAL  46           HA       VAL  46  -9.533   4.233   7.058
  361    HB   VAL  46           HB       VAL  46  -6.705   3.319   6.458
  362   1HG1  VAL  46          1HG1      VAL  46  -7.318   1.282   7.672
  363   2HG1  VAL  46          2HG1      VAL  46  -7.419   2.703   8.710
  364   3HG1  VAL  46          3HG1      VAL  46  -8.890   1.981   8.056
  365   1HG2  VAL  46          1HG2      VAL  46  -8.155   3.024   4.535
  366   2HG2  VAL  46          2HG2      VAL  46  -7.786   1.459   5.264
  367   3HG2  VAL  46          3HG2      VAL  46  -9.356   2.211   5.539
  368    HA   PRO  47           HA       PRO  47  -8.125   7.264   9.973
  369   1HB   PRO  47          1HB       PRO  47  -9.185   5.990  12.205
  370   2HB   PRO  47          2HB       PRO  47 -10.051   7.116  11.157
  371   1HG   PRO  47          1HG       PRO  47 -10.077   4.133  11.170
  372   2HG   PRO  47          2HG       PRO  47 -11.407   5.267  10.873
  373   1HD   PRO  47          1HD       PRO  47 -10.208   3.957   8.867
  374   2HD   PRO  47          2HD       PRO  47 -10.774   5.630   8.674
  375    H    SER  48           H        SER  48  -7.909   3.899  11.163
  376    HA   SER  48           HA       SER  48  -5.082   4.155  11.602
  377   1HB   SER  48          1HB       SER  48  -6.930   3.868  13.987
  378   2HB   SER  48          2HB       SER  48  -5.174   3.722  14.036
  379    HG   SER  48           HG       SER  48  -5.741   6.014  12.835
  380    H    LEU  49           H        LEU  49  -4.391   2.101  12.990
  381    HA   LEU  49           HA       LEU  49  -5.469  -0.152  11.495
  382   1HB   LEU  49          1HB       LEU  49  -3.044   0.125  13.270
  383   2HB   LEU  49          2HB       LEU  49  -3.493  -1.348  12.431
  384    HG   LEU  49           HG       LEU  49  -2.837   1.262  11.065
  385   1HD1  LEU  49          1HD1      LEU  49  -1.175  -1.228  11.382
  386   2HD1  LEU  49          2HD1      LEU  49  -0.749   0.191  10.428
  387   3HD1  LEU  49          3HD1      LEU  49  -0.885   0.317  12.181
  388   1HD2  LEU  49          1HD2      LEU  49  -4.362  -0.131   9.786
  389   2HD2  LEU  49          2HD2      LEU  49  -2.762  -0.123   9.042
  390   3HD2  LEU  49          3HD2      LEU  49  -3.290  -1.517   9.986
  391    H    GLY  50           H        GLY  50  -6.845   1.138  13.819
  392   1HA   GLY  50          1HA       GLY  50  -6.892  -0.857  15.880
  393   2HA   GLY  50          2HA       GLY  50  -8.025   0.475  15.691
  394    H    GLN  51           H        GLN  51  -8.159  -0.635  12.776
  395    HA   GLN  51           HA       GLN  51  -9.818  -2.988  13.231
  396   1HB   GLN  51          1HB       GLN  51 -10.761  -0.398  12.030
  397   2HB   GLN  51          2HB       GLN  51 -11.503  -1.924  11.570
  398   1HG   GLN  51          1HG       GLN  51 -11.297  -0.938  14.404
  399   2HG   GLN  51          2HG       GLN  51 -12.698  -0.683  13.363
  400   1HE2  GLN  51          2HE2      GLN  51 -12.400  -2.166  15.888
  401   2HE2  GLN  51          1HE2      GLN  51 -12.946  -3.777  15.548
  402    H    LEU  52           H        LEU  52  -9.306  -0.777  10.501
  403    HA   LEU  52           HA       LEU  52  -8.829  -1.130   8.328
  404   1HB   LEU  52          1HB       LEU  52  -6.582  -1.556   9.191
  405   2HB   LEU  52          2HB       LEU  52  -6.980  -3.246   9.429
  406    HG   LEU  52           HG       LEU  52  -7.188  -3.590   7.037
  407   1HD1  LEU  52          1HD1      LEU  52  -8.101  -1.434   6.395
  408   2HD1  LEU  52          2HD1      LEU  52  -6.569  -0.648   6.784
  409   3HD1  LEU  52          3HD1      LEU  52  -6.657  -1.795   5.447
  410   1HD2  LEU  52          1HD2      LEU  52  -4.868  -3.199   6.376
  411   2HD2  LEU  52          2HD2      LEU  52  -4.662  -2.098   7.738
  412   3HD2  LEU  52          3HD2      LEU  52  -4.970  -3.809   8.027
  413    H    GLN  53           H        GLN  53 -10.809  -1.779   7.672
  414    HA   GLN  53           HA       GLN  53 -11.662  -4.520   8.006
  415   1HB   GLN  53          1HB       GLN  53 -12.993  -2.225   6.561
  416   2HB   GLN  53          2HB       GLN  53 -13.744  -3.756   6.984
  417   1HG   GLN  53          1HG       GLN  53 -13.642  -3.257   9.306
  418   2HG   GLN  53          2HG       GLN  53 -12.634  -1.838   9.012
  419   1HE2  GLN  53          2HE2      GLN  53 -15.834  -3.164   8.850
  420   2HE2  GLN  53          1HE2      GLN  53 -16.665  -1.671   8.592
  421    HA   PRO  54           HA       PRO  54 -10.126  -5.905   3.983
  422   1HB   PRO  54          1HB       PRO  54 -12.099  -8.042   4.619
  423   2HB   PRO  54          2HB       PRO  54 -10.412  -8.186   4.112
  424   1HG   PRO  54          1HG       PRO  54 -11.112  -8.645   6.639
  425   2HG   PRO  54          2HG       PRO  54  -9.598  -7.804   6.250
  426   1HD   PRO  54          1HD       PRO  54 -12.191  -6.687   7.240
  427   2HD   PRO  54          2HD       PRO  54 -10.529  -6.217   7.652
  428    H    ALA  55           H        ALA  55 -13.437  -5.573   5.113
  429    HA   ALA  55           HA       ALA  55 -14.636  -5.642   2.516
  430   1HB   ALA  55          1HB       ALA  55 -16.649  -4.867   3.634
  431   2HB   ALA  55          2HB       ALA  55 -15.900  -6.176   4.546
  432   3HB   ALA  55          3HB       ALA  55 -15.723  -4.509   5.091
  433    H    HIS  56           H        HIS  56 -12.747  -3.349   4.112
  434    HA   HIS  56           HA       HIS  56 -13.827  -1.162   2.469
  435   1HB   HIS  56          1HB       HIS  56 -13.243  -0.916   5.012
  436   2HB   HIS  56          2HB       HIS  56 -11.582  -0.825   4.438
  437    HD1  HIS  56           HD1      HIS  56 -14.897   0.942   3.949
  438    HD2  HIS  56           HD2      HIS  56 -10.814   1.649   3.571
  439    HE1  HIS  56           HE1      HIS  56 -14.678   3.382   3.373
  440    HE2  HIS  56           HE2      HIS  56 -12.203   3.822   3.339
  441    H    MET  57           H        MET  57 -11.333  -3.454   2.698
  442    HA   MET  57           HA       MET  57  -9.490  -2.071   0.941
  443   1HB   MET  57          1HB       MET  57  -9.524  -4.917   1.969
  444   2HB   MET  57          2HB       MET  57  -8.231  -4.216   1.004
  445   1HG   MET  57          1HG       MET  57  -7.775  -2.602   2.760
  446   2HG   MET  57          2HG       MET  57  -9.093  -3.263   3.725
  447   1HE   MET  57          1HE       MET  57  -6.559  -5.275   1.487
  448   2HE   MET  57          2HE       MET  57  -5.282  -5.637   2.648
  449   3HE   MET  57          3HE       MET  57  -5.565  -3.973   2.139
  450    H    ASP  58           H        ASP  58 -12.389  -3.310   0.422
  451    HA   ASP  58           HA       ASP  58 -12.144  -5.132  -1.680
  452   1HB   ASP  58          1HB       ASP  58 -14.483  -4.618  -2.091
  453   2HB   ASP  58          2HB       ASP  58 -14.198  -4.773  -0.373
  454    H    ALA  59           H        ALA  59 -12.168  -1.628  -1.567
  455    HA   ALA  59           HA       ALA  59 -12.342  -1.078  -4.306
  456   1HB   ALA  59          1HB       ALA  59 -12.519   0.636  -2.564
  457   2HB   ALA  59          2HB       ALA  59 -10.805   0.438  -2.197
  458   3HB   ALA  59          3HB       ALA  59 -11.304   1.064  -3.769
  459    H    VAL  60           H        VAL  60  -9.594  -1.924  -2.276
  460    HA   VAL  60           HA       VAL  60  -7.589  -1.490  -4.245
  461    HB   VAL  60           HB       VAL  60  -7.428  -3.350  -1.865
  462   1HG1  VAL  60          1HG1      VAL  60  -5.612  -3.616  -3.457
  463   2HG1  VAL  60          2HG1      VAL  60  -5.297  -1.880  -3.413
  464   3HG1  VAL  60          3HG1      VAL  60  -5.027  -2.861  -1.974
  465   1HG2  VAL  60          1HG2      VAL  60  -6.853  -0.391  -1.996
  466   2HG2  VAL  60          2HG2      VAL  60  -8.173  -1.159  -1.116
  467   3HG2  VAL  60          3HG2      VAL  60  -6.503  -1.444  -0.626
  468    H    LEU  61           H        LEU  61  -9.443  -4.290  -3.166
  469    HA   LEU  61           HA       LEU  61  -8.099  -6.201  -4.774
  470   1HB   LEU  61          1HB       LEU  61 -10.907  -6.305  -3.670
  471   2HB   LEU  61          2HB       LEU  61  -9.978  -7.671  -4.256
  472    HG   LEU  61           HG       LEU  61  -9.337  -6.012  -1.815
  473   1HD1  LEU  61          1HD1      LEU  61 -10.318  -8.849  -2.081
  474   2HD1  LEU  61          2HD1      LEU  61  -9.888  -8.036  -0.577
  475   3HD1  LEU  61          3HD1      LEU  61 -11.268  -7.473  -1.520
  476   1HD2  LEU  61          1HD2      LEU  61  -7.948  -8.439  -2.945
  477   2HD2  LEU  61          2HD2      LEU  61  -7.305  -6.798  -2.898
  478   3HD2  LEU  61          3HD2      LEU  61  -7.589  -7.677  -1.396
  479    H    ALA  62           H        ALA  62 -10.688  -3.962  -5.356
  480    HA   ALA  62           HA       ALA  62 -11.634  -5.144  -7.769
  481   1HB   ALA  62          1HB       ALA  62 -12.820  -3.042  -8.107
  482   2HB   ALA  62          2HB       ALA  62 -13.008  -3.608  -6.447
  483   3HB   ALA  62          3HB       ALA  62 -11.887  -2.295  -6.810
  484    H    LEU  63           H        LEU  63  -9.369  -2.497  -7.049
  485    HA   LEU  63           HA       LEU  63  -8.755  -1.938  -9.770
  486   1HB   LEU  63          1HB       LEU  63  -7.129  -1.394  -7.279
  487   2HB   LEU  63          2HB       LEU  63  -6.837  -0.689  -8.857
  488    HG   LEU  63           HG       LEU  63  -9.298  -0.238  -7.165
  489   1HD1  LEU  63          1HD1      LEU  63  -7.300   0.834  -6.255
  490   2HD1  LEU  63          2HD1      LEU  63  -6.994   1.592  -7.818
  491   3HD1  LEU  63          3HD1      LEU  63  -8.435   2.022  -6.895
  492   1HD2  LEU  63          1HD2      LEU  63  -9.870   1.452  -8.834
  493   2HD2  LEU  63          2HD2      LEU  63  -8.470   0.980  -9.796
  494   3HD2  LEU  63          3HD2      LEU  63  -9.794  -0.158  -9.551
  495    H    ASN  64           H        ASN  64  -7.366  -3.997  -7.305
  496    HA   ASN  64           HA       ASN  64  -5.923  -5.732  -7.338
  497   1HB   ASN  64          1HB       ASN  64  -7.803  -6.626  -8.698
  498   2HB   ASN  64          2HB       ASN  64  -6.943  -6.129 -10.153
  499   1HD2  ASN  64          2HD2      ASN  64  -5.204  -7.312 -10.855
  500   2HD2  ASN  64          1HD2      ASN  64  -4.757  -8.833 -10.170
  501    HA   PRO  65           HA       PRO  65  -2.421  -3.808  -9.565
  502   1HB   PRO  65          1HB       PRO  65  -0.778  -3.639  -7.451
  503   2HB   PRO  65          2HB       PRO  65  -2.043  -2.437  -7.733
  504   1HG   PRO  65          1HG       PRO  65  -2.022  -4.756  -5.845
  505   2HG   PRO  65          2HG       PRO  65  -2.610  -3.104  -5.583
  506   1HD   PRO  65          1HD       PRO  65  -4.231  -5.239  -6.191
  507   2HD   PRO  65          2HD       PRO  65  -4.638  -3.548  -6.541
  508    H    ALA  66           H        ALA  66  -0.107  -4.644  -9.622
  509    HA   ALA  66           HA       ALA  66  -0.147  -7.513  -9.809
  510   1HB   ALA  66          1HB       ALA  66   2.135  -7.281 -10.667
  511   2HB   ALA  66          2HB       ALA  66   1.034  -6.167 -11.480
  512   3HB   ALA  66          3HB       ALA  66   2.128  -5.572 -10.233
  513    H    VAL  67           H        VAL  67   1.266  -5.083  -7.703
  514    HA   VAL  67           HA       VAL  67   1.559  -7.099  -5.628
  515    HB   VAL  67           HB       VAL  67   3.748  -7.175  -6.719
  516   1HG1  VAL  67          1HG1      VAL  67   3.909  -4.224  -6.139
  517   2HG1  VAL  67          2HG1      VAL  67   5.234  -5.227  -6.731
  518   3HG1  VAL  67          3HG1      VAL  67   3.800  -4.981  -7.728
  519   1HG2  VAL  67          1HG2      VAL  67   3.849  -5.777  -4.050
  520   2HG2  VAL  67          2HG2      VAL  67   3.679  -7.513  -4.318
  521   3HG2  VAL  67          3HG2      VAL  67   5.169  -6.689  -4.782
  522    H    ILE  68           H        ILE  68   1.596  -6.176  -3.500
  523    HA   ILE  68           HA       ILE  68   0.948  -3.306  -3.469
  524    HB   ILE  68           HB       ILE  68  -1.126  -4.509  -3.215
  525   1HG1  ILE  68          1HG1      ILE  68  -0.212  -3.445  -0.532
  526   2HG1  ILE  68          2HG1      ILE  68  -0.794  -2.460  -1.869
  527   1HG2  ILE  68          1HG2      ILE  68   0.180  -5.938  -0.908
  528   2HG2  ILE  68          2HG2      ILE  68  -1.519  -6.065  -1.368
  529   3HG2  ILE  68          3HG2      ILE  68  -0.264  -6.644  -2.462
  530   1HD1  ILE  68          1HD1      ILE  68  -2.515  -2.777  -0.190
  531   2HD1  ILE  68          2HD1      ILE  68  -2.977  -3.540  -1.712
  532   3HD1  ILE  68          3HD1      ILE  68  -2.389  -4.526  -0.373
  533    H    LEU  69           H        LEU  69   1.895  -2.093  -1.970
  534    HA   LEU  69           HA       LEU  69   3.541  -3.432   0.077
  535   1HB   LEU  69          1HB       LEU  69   3.852  -0.649  -1.067
  536   2HB   LEU  69          2HB       LEU  69   4.901  -1.399   0.119
  537    HG   LEU  69           HG       LEU  69   4.576  -2.275  -2.752
  538   1HD1  LEU  69          1HD1      LEU  69   6.887  -1.476  -2.980
  539   2HD1  LEU  69          2HD1      LEU  69   5.770  -0.177  -2.556
  540   3HD1  LEU  69          3HD1      LEU  69   6.826  -0.867  -1.325
  541   1HD2  LEU  69          1HD2      LEU  69   6.419  -3.286  -0.590
  542   2HD2  LEU  69          2HD2      LEU  69   5.050  -4.159  -1.279
  543   3HD2  LEU  69          3HD2      LEU  69   6.447  -3.777  -2.284
  544    H    LEU  70           H        LEU  70   2.991  -3.091   2.155
  545    HA   LEU  70           HA       LEU  70   0.964  -1.024   2.685
  546   1HB   LEU  70          1HB       LEU  70   0.318  -3.374   3.151
  547   2HB   LEU  70          2HB       LEU  70   1.636  -3.484   4.301
  548    HG   LEU  70           HG       LEU  70   0.565  -1.712   5.662
  549   1HD1  LEU  70          1HD1      LEU  70  -0.664  -0.587   3.880
  550   2HD1  LEU  70          2HD1      LEU  70  -1.696  -2.004   3.689
  551   3HD1  LEU  70          3HD1      LEU  70  -1.743  -1.073   5.186
  552   1HD2  LEU  70          1HD2      LEU  70  -1.180  -4.097   5.060
  553   2HD2  LEU  70          2HD2      LEU  70   0.182  -4.062   6.179
  554   3HD2  LEU  70          3HD2      LEU  70  -1.260  -3.102   6.513
  555    H    GLY  71           H        GLY  71   1.789   0.756   3.537
  556   1HA   GLY  71          1HA       GLY  71   4.111   0.507   5.346
  557   2HA   GLY  71          2HA       GLY  71   3.704   1.952   4.427
  558    H    THR  72           H        THR  72   3.401   0.359   7.389
  559    HA   THR  72           HA       THR  72   0.983   1.801   8.139
  560    HB   THR  72           HB       THR  72   1.122   0.464  10.237
  561    HG1  THR  72           HG1      THR  72   3.246  -0.032  10.470
  562   1HG2  THR  72          1HG2      THR  72   1.263  -1.124   7.667
  563   2HG2  THR  72          2HG2      THR  72   0.583  -1.695   9.190
  564   3HG2  THR  72          3HG2      THR  72  -0.176  -0.353   8.333
  565    H    GLY  73           H        GLY  73   2.198   3.874   7.951
  566   1HA   GLY  73          1HA       GLY  73   3.211   5.701   8.908
  567   2HA   GLY  73          2HA       GLY  73   2.710   5.004  10.441
  568    H    GLU  74           H        GLU  74   4.456   5.300  11.698
  569    HA   GLU  74           HA       GLU  74   6.993   4.134  10.766
  570   1HB   GLU  74          1HB       GLU  74   6.894   6.584  11.561
  571   2HB   GLU  74          2HB       GLU  74   6.663   5.925  13.174
  572   1HG   GLU  74          1HG       GLU  74   8.966   6.427  12.928
  573   2HG   GLU  74          2HG       GLU  74   8.800   4.673  12.891
  574    H    ARG  75           H        ARG  75   4.534   2.864  11.804
  575    HA   ARG  75           HA       ARG  75   5.693   1.407  14.087
  576   1HB   ARG  75          1HB       ARG  75   2.814   2.249  13.677
  577   2HB   ARG  75          2HB       ARG  75   3.341   1.118  14.910
  578   1HG   ARG  75          1HG       ARG  75   4.322   3.954  14.730
  579   2HG   ARG  75          2HG       ARG  75   2.934   3.451  15.698
  580   1HD   ARG  75          1HD       ARG  75   5.812   2.635  16.015
  581   2HD   ARG  75          2HD       ARG  75   4.801   3.516  17.160
  582    HE   ARG  75           HE       ARG  75   4.988   0.688  16.854
  583   1HH1  ARG  75          1HH1      ARG  75   2.767   3.263  17.737
  584   2HH1  ARG  75          2HH1      ARG  75   1.731   2.231  18.668
  585   1HH2  ARG  75          1HH2      ARG  75   3.640  -0.664  18.093
  586   2HH2  ARG  75          2HH2      ARG  75   2.222  -0.014  18.861
  587    H    GLN  76           H        GLN  76   6.347  -0.396  12.891
  588    HA   GLN  76           HA       GLN  76   4.757  -1.472  10.787
  589   1HB   GLN  76          1HB       GLN  76   7.222  -1.784  10.951
  590   2HB   GLN  76          2HB       GLN  76   6.965  -2.844  12.332
  591   1HG   GLN  76          1HG       GLN  76   5.647  -4.348  10.895
  592   2HG   GLN  76          2HG       GLN  76   6.000  -3.308   9.519
  593   1HE2  GLN  76          2HE2      GLN  76   8.730  -2.775  10.488
  594   2HE2  GLN  76          1HE2      GLN  76   9.636  -4.213  10.151
  595    H    GLN  77           H        GLN  77   2.747  -2.052  11.363
  596    HA   GLN  77           HA       GLN  77   2.375  -3.799  13.685
  597   1HB   GLN  77          1HB       GLN  77   0.333  -2.413  11.932
  598   2HB   GLN  77          2HB       GLN  77  -0.031  -3.370  13.358
  599   1HG   GLN  77          1HG       GLN  77   1.628  -0.863  13.398
  600   2HG   GLN  77          2HG       GLN  77  -0.108  -0.906  13.692
  601   1HE2  GLN  77          2HE2      GLN  77  -0.005  -0.180  15.765
  602   2HE2  GLN  77          1HE2      GLN  77   0.672  -1.102  17.063
  603    H    PHE  78           H        PHE  78   1.415  -5.825  13.491
  604    HA   PHE  78           HA       PHE  78   1.658  -7.032  10.854
  605   1HB   PHE  78          1HB       PHE  78   1.077  -8.286  13.548
  606   2HB   PHE  78          2HB       PHE  78   1.338  -9.173  12.049
  607    HD1  PHE  78           HD1      PHE  78   3.568  -9.038  10.928
  608    HD2  PHE  78           HD2      PHE  78   2.888  -7.535  14.849
  609    HE1  PHE  78           HE1      PHE  78   5.993  -9.050  11.350
  610    HE2  PHE  78           HE2      PHE  78   5.307  -7.545  15.278
  611    HZ   PHE  78           HZ       PHE  78   6.865  -8.301  13.527
  612    HA   PRO  79           HA       PRO  79  -2.644  -6.193  10.171
  613   1HB   PRO  79          1HB       PRO  79  -2.292  -7.996   7.861
  614   2HB   PRO  79          2HB       PRO  79  -2.785  -6.301   7.901
  615   1HG   PRO  79          1HG       PRO  79  -0.365  -7.030   7.016
  616   2HG   PRO  79          2HG       PRO  79  -0.609  -5.529   7.930
  617   1HD   PRO  79          1HD       PRO  79   0.484  -8.158   8.859
  618   2HD   PRO  79          2HD       PRO  79   1.028  -6.512   9.246
  619    H    SER  80           H        SER  80  -4.623  -7.263  10.204
  620    HA   SER  80           HA       SER  80  -4.785  -9.629  11.688
  621   1HB   SER  80          1HB       SER  80  -6.938  -8.433   9.929
  622   2HB   SER  80          2HB       SER  80  -7.169  -9.469  11.340
  623    HG   SER  80           HG       SER  80  -7.347  -7.036  11.552
  624    H    THR  81           H        THR  81  -5.644 -11.700  11.065
  625    HA   THR  81           HA       THR  81  -4.322 -12.792   8.843
  626    HB   THR  81           HB       THR  81  -6.667 -14.088  10.224
  627    HG1  THR  81           HG1      THR  81  -4.792 -14.907  11.610
  628   1HG2  THR  81          1HG2      THR  81  -4.112 -15.196   9.044
  629   2HG2  THR  81          2HG2      THR  81  -5.397 -16.141   9.796
  630   3HG2  THR  81          3HG2      THR  81  -5.707 -15.269   8.294
  631    H    ASP  82           H        ASP  82  -7.584 -11.594   9.283
  632    HA   ASP  82           HA       ASP  82  -8.824 -12.586   6.994
  633   1HB   ASP  82          1HB       ASP  82  -9.200  -9.877   8.300
  634   2HB   ASP  82          2HB       ASP  82 -10.307 -10.607   7.144
  635    H    VAL  83           H        VAL  83  -6.795  -9.742   7.443
  636    HA   VAL  83           HA       VAL  83  -7.009  -8.735   4.802
  637    HB   VAL  83           HB       VAL  83  -4.786  -8.342   6.819
  638   1HG1  VAL  83          1HG1      VAL  83  -5.498  -6.738   4.366
  639   2HG1  VAL  83          2HG1      VAL  83  -4.274  -6.301   5.557
  640   3HG1  VAL  83          3HG1      VAL  83  -4.068  -7.750   4.574
  641   1HG2  VAL  83          1HG2      VAL  83  -7.230  -6.664   6.263
  642   2HG2  VAL  83          2HG2      VAL  83  -6.957  -7.658   7.695
  643   3HG2  VAL  83          3HG2      VAL  83  -5.931  -6.258   7.385
  644    H    LEU  84           H        LEU  84  -4.673 -10.831   6.432
  645    HA   LEU  84           HA       LEU  84  -2.865 -11.133   4.306
  646   1HB   LEU  84          1HB       LEU  84  -3.549 -13.117   6.478
  647   2HB   LEU  84          2HB       LEU  84  -2.107 -13.145   5.484
  648    HG   LEU  84           HG       LEU  84  -2.812 -10.975   7.463
  649   1HD1  LEU  84          1HD1      LEU  84  -2.255 -13.075   8.564
  650   2HD1  LEU  84          2HD1      LEU  84  -0.769 -13.186   7.621
  651   3HD1  LEU  84          3HD1      LEU  84  -0.976 -11.882   8.791
  652   1HD2  LEU  84          1HD2      LEU  84  -0.323 -11.428   5.818
  653   2HD2  LEU  84          2HD2      LEU  84  -1.500 -10.135   5.591
  654   3HD2  LEU  84          3HD2      LEU  84  -0.525 -10.190   7.059
  655    H    ALA  85           H        ALA  85  -5.654 -13.086   5.291
  656    HA   ALA  85           HA       ALA  85  -5.443 -15.050   3.298
  657   1HB   ALA  85          1HB       ALA  85  -7.749 -15.606   3.834
  658   2HB   ALA  85          2HB       ALA  85  -6.827 -15.302   5.307
  659   3HB   ALA  85          3HB       ALA  85  -7.933 -14.075   4.692
  660    H    ALA  86           H        ALA  86  -7.148 -11.947   3.352
  661    HA   ALA  86           HA       ALA  86  -8.545 -12.197   0.947
  662   1HB   ALA  86          1HB       ALA  86  -8.963 -10.417   2.568
  663   2HB   ALA  86          2HB       ALA  86  -7.406  -9.690   2.175
  664   3HB   ALA  86          3HB       ALA  86  -8.677  -9.762   0.955
  665    H    CYS  87           H        CYS  87  -5.292 -10.909   1.561
  666    HA   CYS  87           HA       CYS  87  -4.754 -10.144  -1.099
  667   1HB   CYS  87          1HB       CYS  87  -2.782 -10.949   1.049
  668   2HB   CYS  87          2HB       CYS  87  -2.419 -10.007  -0.394
  669    HG   CYS  87           HG       CYS  87  -4.325  -9.026   2.272
  670    H    LEU  88           H        LEU  88  -4.192 -13.153   0.663
  671    HA   LEU  88           HA       LEU  88  -2.714 -14.422  -1.411
  672   1HB   LEU  88          1HB       LEU  88  -4.252 -15.612   0.895
  673   2HB   LEU  88          2HB       LEU  88  -3.135 -16.493  -0.130
  674    HG   LEU  88           HG       LEU  88  -2.401 -14.189   1.686
  675   1HD1  LEU  88          1HD1      LEU  88  -2.988 -16.216   2.914
  676   2HD1  LEU  88          2HD1      LEU  88  -1.851 -17.143   1.935
  677   3HD1  LEU  88          3HD1      LEU  88  -1.260 -15.881   3.016
  678   1HD2  LEU  88          1HD2      LEU  88  -0.674 -15.991  -0.011
  679   2HD2  LEU  88          2HD2      LEU  88  -0.987 -14.279  -0.298
  680   3HD2  LEU  88          3HD2      LEU  88  -0.089 -14.784   1.135
  681    H    THR  89           H        THR  89  -6.121 -14.197  -0.631
  682    HA   THR  89           HA       THR  89  -6.941 -16.229  -2.480
  683    HB   THR  89           HB       THR  89  -8.634 -14.022  -1.287
  684    HG1  THR  89           HG1      THR  89  -7.788 -15.102   0.439
  685   1HG2  THR  89          1HG2      THR  89  -9.364 -16.764  -2.330
  686   2HG2  THR  89          2HG2      THR  89 -10.479 -15.603  -1.609
  687   3HG2  THR  89          3HG2      THR  89  -9.691 -15.236  -3.144
  688    H    ARG  90           H        ARG  90  -6.391 -12.785  -2.598
  689    HA   ARG  90           HA       ARG  90  -7.654 -12.457  -5.168
  690   1HB   ARG  90          1HB       ARG  90  -7.287 -10.702  -3.252
  691   2HB   ARG  90          2HB       ARG  90  -5.718 -10.482  -4.017
  692   1HG   ARG  90          1HG       ARG  90  -7.329  -8.847  -4.819
  693   2HG   ARG  90          2HG       ARG  90  -6.814  -9.923  -6.122
  694   1HD   ARG  90          1HD       ARG  90  -8.843 -11.227  -5.887
  695   2HD   ARG  90          2HD       ARG  90  -9.348 -10.241  -4.518
  696    HE   ARG  90           HE       ARG  90  -9.079  -8.419  -6.487
  697   1HH1  ARG  90          1HH1      ARG  90 -10.730 -11.497  -6.328
  698   2HH1  ARG  90          2HH1      ARG  90 -11.992 -11.033  -7.425
  699   1HH2  ARG  90          1HH2      ARG  90 -10.750  -7.779  -7.901
  700   2HH2  ARG  90          2HH2      ARG  90 -12.016  -8.903  -8.307
  701    H    GLY  91           H        GLY  91  -4.582 -13.373  -3.966
  702   1HA   GLY  91          1HA       GLY  91  -2.892 -14.401  -5.208
  703   2HA   GLY  91          2HA       GLY  91  -3.647 -13.808  -6.680
  704    H    ILE  92           H        ILE  92  -2.818 -11.816  -3.900
  705    HA   ILE  92           HA       ILE  92  -0.800 -10.472  -5.584
  706    HB   ILE  92           HB       ILE  92  -2.622  -9.122  -3.580
  707   1HG1  ILE  92          1HG1      ILE  92  -2.729  -9.040  -6.606
  708   2HG1  ILE  92          2HG1      ILE  92  -3.844  -9.946  -5.586
  709   1HG2  ILE  92          1HG2      ILE  92  -0.462  -8.027  -3.851
  710   2HG2  ILE  92          2HG2      ILE  92  -0.691  -7.985  -5.599
  711   3HG2  ILE  92          3HG2      ILE  92  -1.754  -7.050  -4.546
  712   1HD1  ILE  92          1HD1      ILE  92  -4.828  -7.859  -6.331
  713   2HD1  ILE  92          2HD1      ILE  92  -4.609  -7.858  -4.580
  714   3HD1  ILE  92          3HD1      ILE  92  -3.496  -6.957  -5.608
  715    H    GLY  93           H        GLY  93   1.178 -10.324  -4.715
  716   1HA   GLY  93          1HA       GLY  93   1.740 -11.341  -2.104
  717   2HA   GLY  93          2HA       GLY  93   2.887 -10.560  -3.185
  718    H    LEU  94           H        LEU  94   1.922 -10.327  -0.206
  719    HA   LEU  94           HA       LEU  94   1.551  -7.409  -0.194
  720   1HB   LEU  94          1HB       LEU  94  -0.323  -8.587   0.784
  721   2HB   LEU  94          2HB       LEU  94   0.747  -9.496   1.832
  722    HG   LEU  94           HG       LEU  94   1.367  -7.361   2.967
  723   1HD1  LEU  94          1HD1      LEU  94   0.842  -5.815   1.166
  724   2HD1  LEU  94          2HD1      LEU  94  -0.869  -6.224   1.297
  725   3HD1  LEU  94          3HD1      LEU  94  -0.052  -5.403   2.629
  726   1HD2  LEU  94          1HD2      LEU  94  -0.728  -7.155   4.216
  727   2HD2  LEU  94          2HD2      LEU  94  -1.567  -8.060   2.956
  728   3HD2  LEU  94          3HD2      LEU  94  -0.312  -8.844   3.916
  729    H    GLU  95           H        GLU  95   3.177  -6.225   0.509
  730    HA   GLU  95           HA       GLU  95   5.149  -7.428   2.336
  731   1HB   GLU  95          1HB       GLU  95   5.337  -5.068   0.461
  732   2HB   GLU  95          2HB       GLU  95   6.560  -5.432   1.669
  733   1HG   GLU  95          1HG       GLU  95   5.731  -7.281  -0.553
  734   2HG   GLU  95          2HG       GLU  95   7.143  -6.225  -0.584
  735    H    ALA  96           H        ALA  96   4.989  -6.847   4.409
  736    HA   ALA  96           HA       ALA  96   3.469  -4.418   5.068
  737   1HB   ALA  96          1HB       ALA  96   4.177  -6.767   6.829
  738   2HB   ALA  96          2HB       ALA  96   3.174  -5.390   7.287
  739   3HB   ALA  96          3HB       ALA  96   2.624  -6.503   6.035
  740    H    MET  97           H        MET  97   4.658  -2.680   5.457
  741    HA   MET  97           HA       MET  97   7.050  -2.894   7.123
  742   1HB   MET  97          1HB       MET  97   7.028  -1.584   4.391
  743   2HB   MET  97          2HB       MET  97   8.341  -1.458   5.552
  744   1HG   MET  97          1HG       MET  97   8.749  -3.840   5.388
  745   2HG   MET  97          2HG       MET  97   7.382  -4.017   4.288
  746   1HE   MET  97          1HE       MET  97  10.280  -5.123   3.640
  747   2HE   MET  97          2HE       MET  97  10.458  -4.639   1.953
  748   3HE   MET  97          3HE       MET  97   8.915  -5.271   2.531
  749    H    THR  98           H        THR  98   7.945  -0.372   7.106
  750    HA   THR  98           HA       THR  98   5.693   1.229   8.043
  751    HB   THR  98           HB       THR  98   7.552   2.819   8.739
  752    HG1  THR  98           HG1      THR  98   9.656   2.041   8.636
  753   1HG2  THR  98          1HG2      THR  98   7.666   0.005   9.836
  754   2HG2  THR  98          2HG2      THR  98   8.256   1.453  10.651
  755   3HG2  THR  98          3HG2      THR  98   6.531   1.261  10.332
  756    H    ASN  99           H        ASN  99   5.891   3.666   7.426
  757    HA   ASN  99           HA       ASN  99   5.569   3.906   4.642
  758   1HB   ASN  99          1HB       ASN  99   5.891   5.936   6.837
  759   2HB   ASN  99          2HB       ASN  99   5.791   6.436   5.152
  760   1HD2  ASN  99          2HD2      ASN  99   3.972   7.001   7.330
  761   2HD2  ASN  99          1HD2      ASN  99   2.432   6.364   6.852
  762    H    ALA 100           H        ALA 100   8.344   4.492   6.719
  763    HA   ALA 100           HA       ALA 100   9.925   5.733   4.696
  764   1HB   ALA 100          1HB       ALA 100  11.778   5.460   6.269
  765   2HB   ALA 100          2HB       ALA 100  10.351   6.128   7.061
  766   3HB   ALA 100          3HB       ALA 100  10.768   4.428   7.281
  767    H    ALA 101           H        ALA 101   9.691   2.447   5.999
  768    HA   ALA 101           HA       ALA 101  11.808   1.395   4.414
  769   1HB   ALA 101          1HB       ALA 101   9.544  -0.053   5.785
  770   2HB   ALA 101          2HB       ALA 101  11.008  -0.795   5.141
  771   3HB   ALA 101          3HB       ALA 101  11.113   0.328   6.495
  772    H    ALA 102           H        ALA 102   8.286   1.471   4.066
  773    HA   ALA 102           HA       ALA 102   8.139  -0.144   1.760
  774   1HB   ALA 102          1HB       ALA 102   6.200   0.353   3.174
  775   2HB   ALA 102          2HB       ALA 102   6.247   2.034   2.641
  776   3HB   ALA 102          3HB       ALA 102   5.894   0.750   1.483
  777    H    ALA 103           H        ALA 103   8.690   3.305   2.204
  778    HA   ALA 103           HA       ALA 103   8.392   4.098  -0.483
  779   1HB   ALA 103          1HB       ALA 103  10.199   5.291   1.620
  780   2HB   ALA 103          2HB       ALA 103   9.673   6.074   0.131
  781   3HB   ALA 103          3HB       ALA 103   8.496   5.687   1.387
  782    H    ARG 104           H        ARG 104  11.133   2.836   1.326
  783    HA   ARG 104           HA       ARG 104  13.091   3.095  -0.683
  784   1HB   ARG 104          1HB       ARG 104  13.794   2.690   1.559
  785   2HB   ARG 104          2HB       ARG 104  12.812   1.239   1.677
  786   1HG   ARG 104          1HG       ARG 104  14.268   0.110   0.083
  787   2HG   ARG 104          2HG       ARG 104  15.244   1.574  -0.064
  788   1HD   ARG 104          1HD       ARG 104  14.772   0.195   2.567
  789   2HD   ARG 104          2HD       ARG 104  16.114  -0.226   1.504
  790    HE   ARG 104           HE       ARG 104  17.018   1.960   1.837
  791   1HH1  ARG 104          1HH1      ARG 104  14.274   1.224   3.888
  792   2HH1  ARG 104          2HH1      ARG 104  14.678   2.409   5.094
  793   1HH2  ARG 104          1HH2      ARG 104  17.587   3.485   3.425
  794   2HH2  ARG 104          2HH2      ARG 104  16.579   3.706   4.827
  795    H    THR 105           H        THR 105  10.981   0.385   0.212
  796    HA   THR 105           HA       THR 105  11.857  -1.376  -1.813
  797    HB   THR 105           HB       THR 105   9.132  -1.361  -0.502
  798    HG1  THR 105           HG1      THR 105  10.069  -2.326   1.244
  799   1HG2  THR 105          1HG2      THR 105  10.852  -3.609  -1.562
  800   2HG2  THR 105          2HG2      THR 105   9.271  -3.787  -0.803
  801   3HG2  THR 105          3HG2      THR 105   9.416  -2.955  -2.351
  802    H    TYR 106           H        TYR 106   9.319   1.060  -1.678
  803    HA   TYR 106           HA       TYR 106   7.998   0.420  -4.074
  804   1HB   TYR 106          1HB       TYR 106   7.021   1.896  -2.385
  805   2HB   TYR 106          2HB       TYR 106   8.276   3.093  -2.683
  806    HD1  TYR 106           HD1      TYR 106   7.937   4.766  -4.276
  807    HD2  TYR 106           HD2      TYR 106   5.475   1.298  -4.358
  808    HE1  TYR 106           HE1      TYR 106   6.527   5.817  -5.995
  809    HE2  TYR 106           HE2      TYR 106   4.058   2.339  -6.076
  810    HH   TYR 106           HH       TYR 106   4.966   5.155  -7.756
  811    H    ASN 107           H        ASN 107  10.793   2.449  -3.388
  812    HA   ASN 107           HA       ASN 107  11.080   3.732  -5.836
  813   1HB   ASN 107          1HB       ASN 107  12.456   4.364  -3.962
  814   2HB   ASN 107          2HB       ASN 107  13.185   2.765  -3.891
  815   1HD2  ASN 107          2HD2      ASN 107  13.034   5.770  -5.656
  816   2HD2  ASN 107          1HD2      ASN 107  14.491   5.542  -6.561
  817    H    VAL 108           H        VAL 108  12.215   0.534  -4.838
  818    HA   VAL 108           HA       VAL 108  13.605  -0.072  -7.224
  819    HB   VAL 108           HB       VAL 108  12.344  -1.989  -5.253
  820   1HG1  VAL 108          1HG1      VAL 108  13.999  -3.598  -6.092
  821   2HG1  VAL 108          2HG1      VAL 108  12.888  -3.076  -7.358
  822   3HG1  VAL 108          3HG1      VAL 108  14.522  -2.420  -7.296
  823   1HG2  VAL 108          1HG2      VAL 108  15.130  -0.833  -5.349
  824   2HG2  VAL 108          2HG2      VAL 108  13.890  -0.478  -4.146
  825   3HG2  VAL 108          3HG2      VAL 108  14.584  -2.096  -4.245
  826    H    LEU 109           H        LEU 109  10.356  -0.978  -6.093
  827    HA   LEU 109           HA       LEU 109   9.666  -2.489  -8.367
  828   1HB   LEU 109          1HB       LEU 109   7.865  -1.072  -6.402
  829   2HB   LEU 109          2HB       LEU 109   7.351  -2.300  -7.543
  830    HG   LEU 109           HG       LEU 109   9.265  -2.710  -5.242
  831   1HD1  LEU 109          1HD1      LEU 109   6.940  -2.439  -4.544
  832   2HD1  LEU 109          2HD1      LEU 109   6.451  -3.698  -5.680
  833   3HD1  LEU 109          3HD1      LEU 109   7.492  -4.098  -4.313
  834   1HD2  LEU 109          1HD2      LEU 109   8.189  -4.676  -7.258
  835   2HD2  LEU 109          2HD2      LEU 109   9.857  -4.112  -7.142
  836   3HD2  LEU 109          3HD2      LEU 109   9.160  -5.078  -5.841
  837    H    ALA 110           H        ALA 110   9.228   0.922  -7.587
  838    HA   ALA 110           HA       ALA 110   7.590   1.561  -9.810
  839   1HB   ALA 110          1HB       ALA 110   7.758   3.005  -7.838
  840   2HB   ALA 110          2HB       ALA 110   9.435   3.368  -8.249
  841   3HB   ALA 110          3HB       ALA 110   8.133   3.883  -9.322
  842    H    SER 111           H        SER 111  11.035   1.235  -9.381
  843    HA   SER 111           HA       SER 111  11.752   2.506 -11.842
  844   1HB   SER 111          1HB       SER 111  13.324   0.595 -10.098
  845   2HB   SER 111          2HB       SER 111  13.988   1.553 -11.422
  846    HG   SER 111           HG       SER 111  12.925   2.450  -8.949
  847    H    GLU 112           H        GLU 112  11.030  -0.784 -10.818
  848    HA   GLU 112           HA       GLU 112  11.758  -2.072 -13.219
  849   1HB   GLU 112          1HB       GLU 112   9.842  -2.800 -11.007
  850   2HB   GLU 112          2HB       GLU 112  10.229  -3.862 -12.339
  851   1HG   GLU 112          1HG       GLU 112  12.613  -3.770 -11.655
  852   2HG   GLU 112          2HG       GLU 112  12.111  -2.844 -10.240
  853    H    GLY 113           H        GLY 113   9.067  -0.151 -12.277
  854   1HA   GLY 113          1HA       GLY 113   7.366   0.691 -13.614
  855   2HA   GLY 113          2HA       GLY 113   7.912  -0.357 -14.918
  856    H    ARG 114           H        ARG 114   7.366  -1.753 -11.820
  857    HA   ARG 114           HA       ARG 114   5.201  -3.328 -12.937
  858   1HB   ARG 114          1HB       ARG 114   6.626  -3.525 -10.275
  859   2HB   ARG 114          2HB       ARG 114   5.389  -4.644 -10.838
  860   1HG   ARG 114          1HG       ARG 114   6.837  -5.193 -12.773
  861   2HG   ARG 114          2HG       ARG 114   8.090  -4.165 -12.080
  862   1HD   ARG 114          1HD       ARG 114   8.505  -6.498 -11.546
  863   2HD   ARG 114          2HD       ARG 114   8.149  -5.579 -10.085
  864    HE   ARG 114           HE       ARG 114   6.329  -6.905  -9.745
  865   1HH1  ARG 114          1HH1      ARG 114   7.286  -7.211 -13.107
  866   2HH1  ARG 114          2HH1      ARG 114   6.145  -8.477 -13.446
  867   1HH2  ARG 114          1HH2      ARG 114   4.828  -8.582 -10.202
  868   2HH2  ARG 114          2HH2      ARG 114   4.763  -9.244 -11.812
  869    H    ARG 115           H        ARG 115   3.114  -3.275 -12.301
  870    HA   ARG 115           HA       ARG 115   2.158  -0.874 -11.142
  871   1HB   ARG 115          1HB       ARG 115   1.005  -2.413 -12.857
  872   2HB   ARG 115          2HB       ARG 115   0.514  -3.373 -11.470
  873   1HG   ARG 115          1HG       ARG 115  -0.653  -1.455 -10.534
  874   2HG   ARG 115          2HG       ARG 115  -0.138  -0.465 -11.902
  875   1HD   ARG 115          1HD       ARG 115  -1.322  -2.058 -13.408
  876   2HD   ARG 115          2HD       ARG 115  -1.940  -2.879 -11.976
  877    HE   ARG 115           HE       ARG 115  -2.532  -0.051 -12.602
  878   1HH1  ARG 115          1HH1      ARG 115  -3.535  -3.242 -11.543
  879   2HH1  ARG 115          2HH1      ARG 115  -5.168  -2.752 -11.193
  880   1HH2  ARG 115          1HH2      ARG 115  -4.666   0.599 -12.156
  881   2HH2  ARG 115          2HH2      ARG 115  -5.808  -0.558 -11.543
  882    H    VAL 116           H        VAL 116   3.063  -0.714  -9.124
  883    HA   VAL 116           HA       VAL 116   2.224  -2.671  -7.114
  884    HB   VAL 116           HB       VAL 116   4.610  -2.383  -7.152
  885   1HG1  VAL 116          1HG1      VAL 116   4.736  -0.225  -8.255
  886   2HG1  VAL 116          2HG1      VAL 116   4.102   0.569  -6.815
  887   3HG1  VAL 116          3HG1      VAL 116   5.683  -0.213  -6.767
  888   1HG2  VAL 116          1HG2      VAL 116   3.610  -2.645  -4.950
  889   2HG2  VAL 116          2HG2      VAL 116   5.042  -1.618  -4.867
  890   3HG2  VAL 116          3HG2      VAL 116   3.433  -0.896  -4.808
  891    H    ALA 117           H        ALA 117   0.957  -2.108  -5.443
  892    HA   ALA 117           HA       ALA 117  -0.090   0.631  -5.404
  893   1HB   ALA 117          1HB       ALA 117  -1.739  -1.174  -5.575
  894   2HB   ALA 117          2HB       ALA 117  -1.143  -1.861  -4.066
  895   3HB   ALA 117          3HB       ALA 117  -1.920  -0.278  -4.066
  896    H    LEU 118           H        LEU 118   1.185   1.883  -4.157
  897    HA   LEU 118           HA       LEU 118   2.313   0.822  -1.700
  898   1HB   LEU 118          1HB       LEU 118   3.672   2.284  -3.126
  899   2HB   LEU 118          2HB       LEU 118   2.497   3.570  -2.937
  900    HG   LEU 118           HG       LEU 118   2.999   3.630  -0.508
  901   1HD1  LEU 118          1HD1      LEU 118   3.774   1.344  -0.229
  902   2HD1  LEU 118          2HD1      LEU 118   5.179   1.683  -1.240
  903   3HD1  LEU 118          3HD1      LEU 118   4.997   2.492   0.317
  904   1HD2  LEU 118          1HD2      LEU 118   5.176   4.715  -0.730
  905   2HD2  LEU 118          2HD2      LEU 118   5.377   3.991  -2.326
  906   3HD2  LEU 118          3HD2      LEU 118   4.095   5.170  -2.047
  907    H    ALA 119           H        ALA 119   0.640   0.499  -0.306
  908    HA   ALA 119           HA       ALA 119  -1.293   2.605   0.180
  909   1HB   ALA 119          1HB       ALA 119  -0.936  -0.057   1.558
  910   2HB   ALA 119          2HB       ALA 119  -2.298   1.044   1.762
  911   3HB   ALA 119          3HB       ALA 119  -2.021   0.266   0.206
  912    H    MET 120           H        MET 120  -0.306   4.307   1.112
  913    HA   MET 120           HA       MET 120   1.480   3.840   3.377
  914   1HB   MET 120          1HB       MET 120   0.860   6.349   1.811
  915   2HB   MET 120          2HB       MET 120   1.938   6.292   3.198
  916   1HG   MET 120          1HG       MET 120   3.360   4.685   1.986
  917   2HG   MET 120          2HG       MET 120   2.304   4.850   0.584
  918   1HE   MET 120          1HE       MET 120   4.805   8.315   2.320
  919   2HE   MET 120          2HE       MET 120   4.833   6.674   2.969
  920   3HE   MET 120          3HE       MET 120   3.373   7.654   3.110
  921    H    ILE 121           H        ILE 121   0.559   3.686   5.259
  922    HA   ILE 121           HA       ILE 121  -1.938   5.094   5.800
  923    HB   ILE 121           HB       ILE 121  -0.436   3.046   7.443
  924   1HG1  ILE 121          1HG1      ILE 121  -2.971   2.783   5.805
  925   2HG1  ILE 121          2HG1      ILE 121  -1.388   2.180   5.325
  926   1HG2  ILE 121          1HG2      ILE 121  -1.739   4.523   8.867
  927   2HG2  ILE 121          2HG2      ILE 121  -3.171   4.247   7.873
  928   3HG2  ILE 121          3HG2      ILE 121  -2.473   2.921   8.805
  929   1HD1  ILE 121          1HD1      ILE 121  -1.388   0.663   7.229
  930   2HD1  ILE 121          2HD1      ILE 121  -2.969   1.273   7.717
  931   3HD1  ILE 121          3HD1      ILE 121  -2.793   0.404   6.193
  932    H    VAL 122           H        VAL 122  -1.487   7.190   6.254
  933    HA   VAL 122           HA       VAL 122   0.707   7.827   8.046
  934    HB   VAL 122           HB       VAL 122  -1.344   9.675   6.807
  935   1HG1  VAL 122          1HG1      VAL 122   1.273  10.279   8.181
  936   2HG1  VAL 122          2HG1      VAL 122   0.228  11.457   7.389
  937   3HG1  VAL 122          3HG1      VAL 122  -0.339  10.602   8.823
  938   1HG2  VAL 122          1HG2      VAL 122   0.431  10.278   5.231
  939   2HG2  VAL 122          2HG2      VAL 122   1.481   9.055   5.946
  940   3HG2  VAL 122          3HG2      VAL 122   0.009   8.572   5.105
  941    H    GLY 123           H        GLY 123   0.267   7.187  10.055
  942   1HA   GLY 123          1HA       GLY 123  -2.106   8.360  11.340
  943   2HA   GLY 123          2HA       GLY 123  -1.706   6.665  11.594
  944    H    GLY 124           H        GLY 124  -0.811   9.962  12.255
  945   1HA   GLY 124          1HA       GLY 124   1.074   8.962  14.305
  946   2HA   GLY 124          2HA       GLY 124   1.411  10.392  13.339
  947    H    LEU 125           H        LEU 125  -1.566   9.330  14.939
  948    HA   LEU 125           HA       LEU 125  -1.943  12.016  15.946
  949   1HB   LEU 125          1HB       LEU 125  -4.148  11.319  16.603
  950   2HB   LEU 125          2HB       LEU 125  -3.836  10.800  14.961
  951    HG   LEU 125           HG       LEU 125  -3.576   8.941  17.324
  952   1HD1  LEU 125          1HD1      LEU 125  -5.810   8.124  16.742
  953   2HD1  LEU 125          2HD1      LEU 125  -5.848   9.808  17.264
  954   3HD1  LEU 125          3HD1      LEU 125  -5.966   9.413  15.549
  955   1HD2  LEU 125          1HD2      LEU 125  -3.834   7.204  15.626
  956   2HD2  LEU 125          2HD2      LEU 125  -3.951   8.438  14.371
  957   3HD2  LEU 125          3HD2      LEU 125  -2.447   8.233  15.268
  958    H    GLU 126           H        GLU 126  -0.207   9.498  17.011
  959    HA   GLU 126           HA       GLU 126  -0.752   9.334  19.756
  960   1HB   GLU 126          1HB       GLU 126   0.865   7.952  18.310
  961   2HB   GLU 126          2HB       GLU 126   2.012   9.256  18.551
  962   1HG   GLU 126          1HG       GLU 126   0.726   7.849  20.861
  963   2HG   GLU 126          2HG       GLU 126   2.165   7.214  20.070
  964    H    HIS 127           H        HIS 127   1.311  11.540  17.898
  965    HA   HIS 127           HA       HIS 127   0.792  13.562  19.948
  966   1HB   HIS 127          1HB       HIS 127   3.475  12.849  18.810
  967   2HB   HIS 127          2HB       HIS 127   3.140  14.509  19.288
  968    HD1  HIS 127           HD1      HIS 127   1.823  14.369  21.898
  969    HD2  HIS 127           HD2      HIS 127   4.785  11.647  20.831
  970    HE1  HIS 127           HE1      HIS 127   2.727  13.459  24.064
  971    HE2  HIS 127           HE2      HIS 127   4.375  11.679  23.386
  972    H    HIS 128           H        HIS 128  -0.872  14.182  18.591
  973    HA   HIS 128           HA       HIS 128  -0.108  16.012  16.479
  974   1HB   HIS 128          1HB       HIS 128  -0.269  13.832  15.308
  975   2HB   HIS 128          2HB       HIS 128  -1.906  13.633  15.913
  976    HD1  HIS 128           HD1      HIS 128  -0.094  16.345  13.901
  977    HD2  HIS 128           HD2      HIS 128  -3.675  14.224  13.994
  978    HE1  HIS 128           HE1      HIS 128  -1.413  17.137  11.906
  979    HE2  HIS 128           HE2      HIS 128  -3.601  15.877  12.010
  980    H    HIS 129           H        HIS 129  -0.952  16.953  18.627
  981    HA   HIS 129           HA       HIS 129  -2.544  17.870  19.957
  982   1HB   HIS 129          1HB       HIS 129  -3.831  18.331  17.260
  983   2HB   HIS 129          2HB       HIS 129  -4.290  19.153  18.748
  984    HD1  HIS 129           HD1      HIS 129  -2.101  20.443  19.916
  985    HD2  HIS 129           HD2      HIS 129  -2.016  19.727  15.823
  986    HE1  HIS 129           HE1      HIS 129  -0.387  22.032  18.990
  987    HE2  HIS 129           HE2      HIS 129  -0.214  21.444  16.548
  988    H    HIS 130           H        HIS 130  -5.341  17.464  18.120
  989    HA   HIS 130           HA       HIS 130  -7.159  16.102  18.219
  990   1HB   HIS 130          1HB       HIS 130  -5.369  14.466  17.467
  991   2HB   HIS 130          2HB       HIS 130  -5.251  13.946  19.141
  992    HD1  HIS 130           HD1      HIS 130  -6.499  11.888  19.554
  993    HD2  HIS 130           HD2      HIS 130  -8.298  14.197  16.598
  994    HE1  HIS 130           HE1      HIS 130  -8.486  10.557  18.768
  995    HE2  HIS 130           HE2      HIS 130  -9.524  11.936  16.934
  996    H    HIS 131           H        HIS 131  -6.033  17.492  20.678
  997    HA   HIS 131           HA       HIS 131  -7.217  15.824  22.781
  998   1HB   HIS 131          1HB       HIS 131  -4.934  16.528  23.245
  999   2HB   HIS 131          2HB       HIS 131  -5.361  18.209  22.961
 1000    HD1  HIS 131           HD1      HIS 131  -5.082  19.275  25.185
 1001    HD2  HIS 131           HD2      HIS 131  -7.184  15.691  25.421
 1002    HE1  HIS 131           HE1      HIS 131  -5.848  19.091  27.573
 1003    HE2  HIS 131           HE2      HIS 131  -7.228  16.988  27.663
 1004    H    HIS 132           H        HIS 132  -9.374  16.302  22.203
 1005    HA   HIS 132           HA       HIS 132 -10.464  18.384  23.752
 1006   1HB   HIS 132          1HB       HIS 132  -9.707  19.712  21.741
 1007   2HB   HIS 132          2HB       HIS 132 -10.844  18.779  20.774
 1008    HD1  HIS 132           HD1      HIS 132 -13.104  19.776  20.554
 1009    HD2  HIS 132           HD2      HIS 132 -11.106  21.155  23.932
 1010    HE1  HIS 132           HE1      HIS 132 -14.615  21.513  21.580
 1011    HE2  HIS 132           HE2      HIS 132 -13.439  22.245  23.690
  Start of MODEL    8
    1   1H    MET   1          1HT       MET   1   9.440   8.989 -18.711
    2   2H    MET   1          2HT       MET   1  10.843   8.052 -18.529
    3   3H    MET   1          3HT       MET   1   9.335   7.296 -18.695
    4    HA   MET   1           HA       MET   1  10.595   7.162 -20.735
    5   1HB   MET   1          1HB       MET   1   8.219   9.032 -20.874
    6   2HB   MET   1          2HB       MET   1   8.908   8.181 -22.249
    7   1HG   MET   1          1HG       MET   1   7.632   6.917 -19.835
    8   2HG   MET   1          2HG       MET   1   6.927   7.052 -21.445
    9   1HE   MET   1          1HE       MET   1   7.670   3.212 -21.101
   10   2HE   MET   1          2HE       MET   1   6.434   4.436 -21.397
   11   3HE   MET   1          3HE       MET   1   7.177   4.300 -19.803
   12    HA   PRO   2           HA       PRO   2  13.124  10.853 -21.134
   13   1HB   PRO   2          1HB       PRO   2  15.005   9.278 -22.612
   14   2HB   PRO   2          2HB       PRO   2  15.131   9.839 -20.945
   15   1HG   PRO   2          1HG       PRO   2  14.858   7.198 -21.699
   16   2HG   PRO   2          2HG       PRO   2  14.447   7.841 -20.100
   17   1HD   PRO   2          1HD       PRO   2  12.656   7.211 -22.409
   18   2HD   PRO   2          2HD       PRO   2  12.378   6.980 -20.670
   19    H    LEU   3           H        LEU   3  12.556  12.297 -22.646
   20    HA   LEU   3           HA       LEU   3  12.719  11.456 -25.463
   21   1HB   LEU   3          1HB       LEU   3  10.432  12.112 -24.653
   22   2HB   LEU   3          2HB       LEU   3  11.057  13.723 -24.359
   23    HG   LEU   3           HG       LEU   3  11.528  13.988 -26.756
   24   1HD1  LEU   3          1HD1      LEU   3  11.955  11.649 -27.303
   25   2HD1  LEU   3          2HD1      LEU   3  10.254  11.269 -27.033
   26   3HD1  LEU   3          3HD1      LEU   3  10.721  12.335 -28.359
   27   1HD2  LEU   3          1HD2      LEU   3   9.363  14.694 -25.857
   28   2HD2  LEU   3          2HD2      LEU   3   9.219  14.124 -27.521
   29   3HD2  LEU   3          3HD2      LEU   3   8.706  13.091 -26.187
   30    H    ASN   4           H        ASN   4  14.180  13.159 -23.075
   31    HA   ASN   4           HA       ASN   4  15.836  14.612 -24.990
   32   1HB   ASN   4          1HB       ASN   4  14.209  16.259 -24.081
   33   2HB   ASN   4          2HB       ASN   4  14.740  15.863 -22.451
   34   1HD2  ASN   4          2HD2      ASN   4  15.508  17.497 -25.399
   35   2HD2  ASN   4          1HD2      ASN   4  16.876  18.373 -24.799
   36    H    GLN   5           H        GLN   5  17.532  13.236 -24.695
   37    HA   GLN   5           HA       GLN   5  19.090  11.905 -23.721
   38   1HB   GLN   5          1HB       GLN   5  18.955  14.074 -21.621
   39   2HB   GLN   5          2HB       GLN   5  20.094  12.741 -21.541
   40   1HG   GLN   5          1HG       GLN   5  21.244  14.599 -22.437
   41   2HG   GLN   5          2HG       GLN   5  20.976  13.470 -23.762
   42   1HE2  GLN   5          2HE2      GLN   5  20.096  16.537 -22.379
   43   2HE2  GLN   5          1HE2      GLN   5  19.306  17.167 -23.784
   44    H    GLU   6           H        GLU   6  18.116  12.750 -20.520
   45    HA   GLU   6           HA       GLU   6  16.187  10.560 -20.369
   46   1HB   GLU   6          1HB       GLU   6  18.484  11.025 -18.453
   47   2HB   GLU   6          2HB       GLU   6  17.094  10.016 -18.073
   48   1HG   GLU   6          1HG       GLU   6  17.639   8.576 -19.983
   49   2HG   GLU   6          2HG       GLU   6  19.056   9.572 -20.311
   50    H    HIS   7           H        HIS   7  14.344  11.211 -19.321
   51    HA   HIS   7           HA       HIS   7  14.459  13.705 -17.818
   52   1HB   HIS   7          1HB       HIS   7  14.168  14.338 -20.210
   53   2HB   HIS   7          2HB       HIS   7  12.669  13.417 -20.240
   54    HD1  HIS   7           HD1      HIS   7  10.589  14.566 -19.405
   55    HD2  HIS   7           HD2      HIS   7  14.069  16.681 -18.540
   56    HE1  HIS   7           HE1      HIS   7   9.831  16.795 -18.515
   57    HE2  HIS   7           HE2      HIS   7  11.948  18.091 -18.071
   58    HA   PRO   8           HA       PRO   8  10.998  11.488 -15.970
   59   1HB   PRO   8          1HB       PRO   8  12.220  10.785 -13.639
   60   2HB   PRO   8          2HB       PRO   8  12.228   9.761 -15.077
   61   1HG   PRO   8          1HG       PRO   8  14.438  11.181 -13.842
   62   2HG   PRO   8          2HG       PRO   8  14.478   9.998 -15.158
   63   1HD   PRO   8          1HD       PRO   8  14.543  12.937 -15.287
   64   2HD   PRO   8          2HD       PRO   8  14.994  11.744 -16.524
   65    H    ASP   9           H        ASP   9   9.753  13.265 -15.427
   66    HA   ASP   9           HA       ASP   9  10.819  15.462 -13.963
   67   1HB   ASP   9          1HB       ASP   9   8.681  16.460 -14.077
   68   2HB   ASP   9          2HB       ASP   9   8.844  15.559 -15.577
   69    H    TYR  10           H        TYR  10  10.850  15.874 -11.848
   70    HA   TYR  10           HA       TYR  10  10.143  13.634 -10.118
   71   1HB   TYR  10          1HB       TYR  10  12.466  14.789 -10.205
   72   2HB   TYR  10          2HB       TYR  10  11.702  16.057  -9.254
   73    HD1  TYR  10           HD1      TYR  10  11.594  15.854  -6.917
   74    HD2  TYR  10           HD2      TYR  10  12.330  12.393  -9.284
   75    HE1  TYR  10           HE1      TYR  10  12.036  14.554  -4.875
   76    HE2  TYR  10           HE2      TYR  10  12.772  11.088  -7.251
   77    HH   TYR  10           HH       TYR  10  13.439  11.423  -4.964
   78    H    THR  11           H        THR  11   7.870  14.120 -10.192
   79    HA   THR  11           HA       THR  11   7.146  16.383  -8.455
   80    HB   THR  11           HB       THR  11   4.808  16.026  -9.451
   81    HG1  THR  11           HG1      THR  11   6.133  14.978 -11.716
   82   1HG2  THR  11          1HG2      THR  11   6.199  17.962  -9.973
   83   2HG2  THR  11          2HG2      THR  11   7.032  17.041 -11.224
   84   3HG2  THR  11          3HG2      THR  11   5.319  17.420 -11.402
   85    H    TYR  12           H        TYR  12   5.343  13.478  -9.380
   86    HA   TYR  12           HA       TYR  12   4.435  13.130  -6.691
   87   1HB   TYR  12          1HB       TYR  12   3.983  11.634  -9.252
   88   2HB   TYR  12          2HB       TYR  12   3.450  10.960  -7.714
   89    HD1  TYR  12           HD1      TYR  12   1.478  11.719  -6.672
   90    HD2  TYR  12           HD2      TYR  12   3.064  13.871  -9.984
   91    HE1  TYR  12           HE1      TYR  12  -0.583  13.055  -6.782
   92    HE2  TYR  12           HE2      TYR  12   1.006  15.212 -10.103
   93    HH   TYR  12           HH       TYR  12  -1.388  15.137  -7.626
   94    H    ALA  13           H        ALA  13   6.443  12.879  -5.643
   95    HA   ALA  13           HA       ALA  13   7.106  10.070  -5.343
   96   1HB   ALA  13          1HB       ALA  13   9.239  12.148  -5.851
   97   2HB   ALA  13          2HB       ALA  13   9.515  10.456  -5.438
   98   3HB   ALA  13          3HB       ALA  13   8.761  10.878  -6.976
   99    H    LEU  14           H        LEU  14   8.548   9.820  -3.353
  100    HA   LEU  14           HA       LEU  14   7.429  11.426  -1.248
  101   1HB   LEU  14          1HB       LEU  14   9.380   9.129  -1.248
  102   2HB   LEU  14          2HB       LEU  14   8.965   9.999   0.213
  103    HG   LEU  14           HG       LEU  14   7.657   8.020   0.184
  104   1HD1  LEU  14          1HD1      LEU  14   5.953  10.343  -0.692
  105   2HD1  LEU  14          2HD1      LEU  14   5.363   8.886   0.110
  106   3HD1  LEU  14          3HD1      LEU  14   6.465   9.973   0.955
  107   1HD2  LEU  14          1HD2      LEU  14   6.163   7.417  -1.663
  108   2HD2  LEU  14          2HD2      LEU  14   6.780   8.780  -2.598
  109   3HD2  LEU  14          3HD2      LEU  14   7.852   7.446  -2.168
  110    H    ARG  15           H        ARG  15   8.197  13.479  -1.542
  111    HA   ARG  15           HA       ARG  15  11.015  14.004  -1.835
  112   1HB   ARG  15          1HB       ARG  15   8.778  15.957  -1.251
  113   2HB   ARG  15          2HB       ARG  15  10.381  16.348  -1.860
  114   1HG   ARG  15          1HG       ARG  15   9.888  15.081  -3.910
  115   2HG   ARG  15          2HG       ARG  15   8.264  14.764  -3.303
  116   1HD   ARG  15          1HD       ARG  15   8.078  16.594  -4.790
  117   2HD   ARG  15          2HD       ARG  15   7.961  17.263  -3.162
  118    HE   ARG  15           HE       ARG  15  10.593  17.506  -3.705
  119   1HH1  ARG  15          1HH1      ARG  15   7.703  18.451  -5.452
  120   2HH1  ARG  15          2HH1      ARG  15   8.478  19.763  -6.280
  121   1HH2  ARG  15          1HH2      ARG  15  11.607  19.236  -4.762
  122   2HH2  ARG  15          2HH2      ARG  15  10.712  20.219  -5.887
  123    H    ALA  16           H        ALA  16   8.813  13.571   0.715
  124    HA   ALA  16           HA       ALA  16  10.955  13.741   2.633
  125   1HB   ALA  16          1HB       ALA  16  10.147  16.044   2.674
  126   2HB   ALA  16          2HB       ALA  16   8.505  15.472   2.969
  127   3HB   ALA  16          3HB       ALA  16   9.761  15.218   4.185
  128    H    ALA  17           H        ALA  17  10.763  12.016   3.890
  129    HA   ALA  17           HA       ALA  17   8.139  10.696   4.030
  130   1HB   ALA  17          1HB       ALA  17  10.883   9.454   4.214
  131   2HB   ALA  17          2HB       ALA  17   9.347   8.592   4.290
  132   3HB   ALA  17          3HB       ALA  17   9.825   9.413   2.804
  133    H    ASP  18           H        ASP  18   7.233  10.434   5.949
  134    HA   ASP  18           HA       ASP  18   8.889  10.697   8.360
  135   1HB   ASP  18          1HB       ASP  18   6.339  12.172   7.713
  136   2HB   ASP  18          2HB       ASP  18   6.891  11.948   9.367
  137    H    GLY  19           H        GLY  19   7.803   9.856  10.303
  138   1HA   GLY  19          1HA       GLY  19   6.326   7.444   9.707
  139   2HA   GLY  19          2HA       GLY  19   6.857   7.982  11.295
  140    H    ARG  20           H        ARG  20   5.524  10.666  10.377
  141    HA   ARG  20           HA       ARG  20   2.747   9.860  10.927
  142   1HB   ARG  20          1HB       ARG  20   4.302  12.125  12.171
  143   2HB   ARG  20          2HB       ARG  20   2.552  11.995  12.261
  144   1HG   ARG  20          1HG       ARG  20   2.760   9.876  13.445
  145   2HG   ARG  20          2HG       ARG  20   4.518   9.982  13.332
  146   1HD   ARG  20          1HD       ARG  20   3.635  10.708  15.527
  147   2HD   ARG  20          2HD       ARG  20   4.542  11.965  14.687
  148    HE   ARG  20           HE       ARG  20   1.757  12.148  14.127
  149   1HH1  ARG  20          1HH1      ARG  20   4.126  12.816  16.622
  150   2HH1  ARG  20          2HH1      ARG  20   3.231  14.151  17.289
  151   1HH2  ARG  20          1HH2      ARG  20   0.600  13.924  14.979
  152   2HH2  ARG  20          2HH2      ARG  20   1.242  14.790  16.345
  153    H    HIS  21           H        HIS  21   4.735  11.247   8.725
  154    HA   HIS  21           HA       HIS  21   2.558  12.807   7.556
  155   1HB   HIS  21          1HB       HIS  21   5.357  13.905   7.949
  156   2HB   HIS  21          2HB       HIS  21   4.103  14.672   6.985
  157    HD1  HIS  21           HD1      HIS  21   5.621  14.984  10.140
  158    HD2  HIS  21           HD2      HIS  21   1.671  15.108   8.824
  159    HE1  HIS  21           HE1      HIS  21   4.341  16.183  11.940
  160    HE2  HIS  21           HE2      HIS  21   1.946  16.208  11.155
  161    H    ALA  22           H        ALA  22   3.054  13.368   5.247
  162    HA   ALA  22           HA       ALA  22   5.180  11.907   3.963
  163   1HB   ALA  22          1HB       ALA  22   3.746  10.544   2.542
  164   2HB   ALA  22          2HB       ALA  22   3.488  10.147   4.242
  165   3HB   ALA  22          3HB       ALA  22   2.316  11.146   3.383
  166    H    LYS  23           H        LYS  23   5.929  13.343   2.537
  167    HA   LYS  23           HA       LYS  23   4.062  15.237   1.323
  168   1HB   LYS  23          1HB       LYS  23   7.078  15.151   1.357
  169   2HB   LYS  23          2HB       LYS  23   6.152  16.317   0.423
  170   1HG   LYS  23          1HG       LYS  23   5.105  17.082   2.551
  171   2HG   LYS  23          2HG       LYS  23   6.223  16.023   3.415
  172   1HD   LYS  23          1HD       LYS  23   8.111  17.223   2.363
  173   2HD   LYS  23          2HD       LYS  23   6.957  18.322   1.605
  174   1HE   LYS  23          1HE       LYS  23   7.403  17.934   4.561
  175   2HE   LYS  23          2HE       LYS  23   7.883  19.333   3.601
  176   1HZ   LYS  23          1HZ       LYS  23   5.882  19.856   4.749
  177   2HZ   LYS  23          2HZ       LYS  23   5.491  19.681   3.108
  178   3HZ   LYS  23          3HZ       LYS  23   5.120  18.443   4.210
  179    H    VAL  24           H        VAL  24   3.016  14.076  -0.207
  180    HA   VAL  24           HA       VAL  24   4.592  12.719  -2.264
  181    HB   VAL  24           HB       VAL  24   1.582  12.911  -2.023
  182   1HG1  VAL  24          1HG1      VAL  24   3.332  11.069  -3.653
  183   2HG1  VAL  24          2HG1      VAL  24   1.571  11.012  -3.567
  184   3HG1  VAL  24          3HG1      VAL  24   2.374  12.412  -4.279
  185   1HG2  VAL  24          1HG2      VAL  24   2.499  11.779  -0.072
  186   2HG2  VAL  24          2HG2      VAL  24   1.666  10.631  -1.122
  187   3HG2  VAL  24          3HG2      VAL  24   3.428  10.703  -1.118
  188    H    ASN  25           H        ASN  25   5.415  14.118  -3.670
  189    HA   ASN  25           HA       ASN  25   5.569  15.664  -5.328
  190   1HB   ASN  25          1HB       ASN  25   3.539  14.736  -6.300
  191   2HB   ASN  25          2HB       ASN  25   2.543  15.672  -5.196
  192   1HD2  ASN  25          2HD2      ASN  25   1.452  16.793  -6.747
  193   2HD2  ASN  25          1HD2      ASN  25   2.190  17.990  -7.755
  194    H    GLU  26           H        GLU  26   2.697  16.924  -3.699
  195    HA   GLU  26           HA       GLU  26   4.235  19.053  -2.442
  196   1HB   GLU  26          1HB       GLU  26   3.688  19.799  -4.776
  197   2HB   GLU  26          2HB       GLU  26   1.986  19.652  -4.376
  198   1HG   GLU  26          1HG       GLU  26   2.261  21.368  -2.643
  199   2HG   GLU  26          2HG       GLU  26   3.960  21.528  -3.096
  200    H    GLN  27           H        GLN  27   2.215  16.699  -1.991
  201    HA   GLN  27           HA       GLN  27   0.190  18.213  -0.483
  202   1HB   GLN  27          1HB       GLN  27  -0.112  15.507  -1.803
  203   2HB   GLN  27          2HB       GLN  27  -1.373  16.400  -0.962
  204   1HG   GLN  27          1HG       GLN  27  -1.396  18.093  -2.640
  205   2HG   GLN  27          2HG       GLN  27   0.038  17.422  -3.412
  206   1HE2  GLN  27          2HE2      GLN  27  -2.580  17.956  -4.540
  207   2HE2  GLN  27          1HE2      GLN  27  -3.160  16.438  -5.144
  208    H    ILE  28           H        ILE  28   0.073  17.811   1.636
  209    HA   ILE  28           HA       ILE  28   1.766  15.727   2.760
  210    HB   ILE  28           HB       ILE  28   0.142  17.830   4.208
  211   1HG1  ILE  28          1HG1      ILE  28   3.099  17.781   3.550
  212   2HG1  ILE  28          2HG1      ILE  28   1.901  18.811   2.773
  213   1HG2  ILE  28          1HG2      ILE  28   0.623  15.877   5.583
  214   2HG2  ILE  28          2HG2      ILE  28   2.335  15.995   5.175
  215   3HG2  ILE  28          3HG2      ILE  28   1.567  17.265   6.127
  216   1HD1  ILE  28          1HD1      ILE  28   2.674  18.885   5.679
  217   2HD1  ILE  28          2HD1      ILE  28   3.167  20.035   4.437
  218   3HD1  ILE  28          3HD1      ILE  28   1.471  19.916   4.905
  219    H    LEU  29           H        LEU  29   0.728  13.831   2.449
  220    HA   LEU  29           HA       LEU  29  -2.052  13.587   3.320
  221   1HB   LEU  29          1HB       LEU  29  -0.255  11.570   1.964
  222   2HB   LEU  29          2HB       LEU  29  -1.966  11.363   2.293
  223    HG   LEU  29           HG       LEU  29  -0.799  13.450   0.444
  224   1HD1  LEU  29          1HD1      LEU  29  -1.764  12.105  -1.350
  225   2HD1  LEU  29          2HD1      LEU  29  -0.537  11.205  -0.458
  226   3HD1  LEU  29          3HD1      LEU  29  -2.248  10.882  -0.176
  227   1HD2  LEU  29          1HD2      LEU  29  -3.655  12.664   1.006
  228   2HD2  LEU  29          2HD2      LEU  29  -2.878  14.179   1.469
  229   3HD2  LEU  29          3HD2      LEU  29  -3.126  13.799  -0.236
  230    H    GLN  30           H        GLN  30  -2.032  13.550   5.498
  231    HA   GLN  30           HA       GLN  30  -0.107  11.774   6.835
  232   1HB   GLN  30          1HB       GLN  30  -0.439  13.186   8.825
  233   2HB   GLN  30          2HB       GLN  30   0.146  14.107   7.448
  234   1HG   GLN  30          1HG       GLN  30  -2.138  14.911   7.033
  235   2HG   GLN  30          2HG       GLN  30  -2.694  14.016   8.447
  236   1HE2  GLN  30          2HE2      GLN  30  -2.802  16.871   7.924
  237   2HE2  GLN  30          1HE2      GLN  30  -1.939  17.632   9.212
  238    H    GLN  31           H        GLN  31  -2.625  10.905   5.678
  239    HA   GLN  31           HA       GLN  31  -3.855   9.847   8.134
  240   1HB   GLN  31          1HB       GLN  31  -5.246  10.520   5.531
  241   2HB   GLN  31          2HB       GLN  31  -6.001   9.699   6.890
  242   1HG   GLN  31          1HG       GLN  31  -5.740  11.650   8.272
  243   2HG   GLN  31          2HG       GLN  31  -4.830  12.468   7.003
  244   1HE2  GLN  31          2HE2      GLN  31  -5.906  13.245   5.196
  245   2HE2  GLN  31          1HE2      GLN  31  -7.626  13.432   5.160
  246    H    SER  32           H        SER  32  -4.943   8.818   5.026
  247    HA   SER  32           HA       SER  32  -3.072   6.630   4.807
  248   1HB   SER  32          1HB       SER  32  -6.027   6.075   5.209
  249   2HB   SER  32          2HB       SER  32  -4.776   4.876   4.882
  250    HG   SER  32           HG       SER  32  -4.032   6.325   6.989
  251    H    PHE  33           H        PHE  33  -2.872   5.980   2.700
  252    HA   PHE  33           HA       PHE  33  -4.907   6.605   0.759
  253   1HB   PHE  33          1HB       PHE  33  -3.520   8.098  -0.604
  254   2HB   PHE  33          2HB       PHE  33  -3.805   8.791   0.987
  255    HD1  PHE  33           HD1      PHE  33  -1.336   7.630  -1.369
  256    HD2  PHE  33           HD2      PHE  33  -1.976   8.761   2.684
  257    HE1  PHE  33           HE1      PHE  33   1.086   7.926  -1.074
  258    HE2  PHE  33           HE2      PHE  33   0.447   9.061   2.986
  259    HZ   PHE  33           HZ       PHE  33   1.982   8.643   1.104
  260    H    ILE  34           H        ILE  34  -4.373   5.840  -1.374
  261    HA   ILE  34           HA       ILE  34  -2.334   3.708  -1.330
  262    HB   ILE  34           HB       ILE  34  -4.727   3.872  -3.168
  263   1HG1  ILE  34          1HG1      ILE  34  -4.445   2.129  -0.716
  264   2HG1  ILE  34          2HG1      ILE  34  -5.354   3.636  -0.736
  265   1HG2  ILE  34          1HG2      ILE  34  -2.838   1.615  -2.526
  266   2HG2  ILE  34          2HG2      ILE  34  -4.234   1.511  -3.597
  267   3HG2  ILE  34          3HG2      ILE  34  -2.873   2.551  -4.020
  268   1HD1  ILE  34          1HD1      ILE  34  -6.811   1.704  -0.978
  269   2HD1  ILE  34          2HD1      ILE  34  -6.852   2.717  -2.419
  270   3HD1  ILE  34          3HD1      ILE  34  -5.933   1.213  -2.426
  271    H    LEU  35           H        LEU  35  -0.566   4.307  -2.402
  272    HA   LEU  35           HA       LEU  35  -0.850   6.170  -4.661
  273   1HB   LEU  35          1HB       LEU  35   0.601   6.942  -2.852
  274   2HB   LEU  35          2HB       LEU  35   1.560   5.480  -2.974
  275    HG   LEU  35           HG       LEU  35   2.274   6.148  -5.240
  276   1HD1  LEU  35          1HD1      LEU  35   0.759   8.687  -4.653
  277   2HD1  LEU  35          2HD1      LEU  35   1.828   8.419  -6.028
  278   3HD1  LEU  35          3HD1      LEU  35   0.342   7.484  -5.873
  279   1HD2  LEU  35          1HD2      LEU  35   2.754   8.220  -3.103
  280   2HD2  LEU  35          2HD2      LEU  35   3.651   6.716  -3.317
  281   3HD2  LEU  35          3HD2      LEU  35   3.742   7.979  -4.544
  282    H    MET  36           H        MET  36  -0.763   5.310  -6.604
  283    HA   MET  36           HA       MET  36   1.042   3.032  -7.059
  284   1HB   MET  36          1HB       MET  36  -1.721   3.444  -8.228
  285   2HB   MET  36          2HB       MET  36  -0.590   2.209  -8.762
  286   1HG   MET  36          1HG       MET  36  -0.599   1.371  -6.375
  287   2HG   MET  36          2HG       MET  36  -1.978   2.436  -6.114
  288   1HE   MET  36          1HE       MET  36  -0.574  -0.596  -8.144
  289   2HE   MET  36          2HE       MET  36  -1.123   0.487  -9.423
  290   3HE   MET  36          3HE       MET  36  -1.957  -1.042  -9.146
  291    HA   PRO  37           HA       PRO  37   2.875   5.210 -10.441
  292   1HB   PRO  37          1HB       PRO  37   1.975   3.035 -12.267
  293   2HB   PRO  37          2HB       PRO  37   3.590   3.713 -12.032
  294   1HG   PRO  37          1HG       PRO  37   2.956   1.333 -11.020
  295   2HG   PRO  37          2HG       PRO  37   3.979   2.464 -10.113
  296   1HD   PRO  37          1HD       PRO  37   1.102   1.776  -9.722
  297   2HD   PRO  37          2HD       PRO  37   2.347   2.153  -8.515
  298    H    ASP  38           H        ASP  38   1.753   6.986 -10.892
  299    HA   ASP  38           HA       ASP  38   0.692   8.428 -12.283
  300   1HB   ASP  38          1HB       ASP  38   1.120   6.906 -14.148
  301   2HB   ASP  38          2HB       ASP  38  -0.318   5.978 -13.738
  302    H    GLU  39           H        GLU  39  -0.871   6.136 -10.351
  303    HA   GLU  39           HA       GLU  39  -3.300   7.788 -10.426
  304   1HB   GLU  39          1HB       GLU  39  -3.682   5.614 -11.584
  305   2HB   GLU  39          2HB       GLU  39  -3.310   4.789 -10.076
  306   1HG   GLU  39          1HG       GLU  39  -5.224   5.653  -9.011
  307   2HG   GLU  39          2HG       GLU  39  -5.494   6.835 -10.289
  308    H    LEU  40           H        LEU  40  -4.073   8.433  -8.519
  309    HA   LEU  40           HA       LEU  40  -2.864   7.290  -6.093
  310   1HB   LEU  40          1HB       LEU  40  -1.856   9.443  -6.508
  311   2HB   LEU  40          2HB       LEU  40  -3.426  10.184  -6.739
  312    HG   LEU  40           HG       LEU  40  -3.944   9.761  -4.347
  313   1HD1  LEU  40          1HD1      LEU  40  -1.065   8.877  -4.222
  314   2HD1  LEU  40          2HD1      LEU  40  -2.120   9.148  -2.835
  315   3HD1  LEU  40          3HD1      LEU  40  -2.481   7.853  -3.977
  316   1HD2  LEU  40          1HD2      LEU  40  -3.063  11.917  -5.075
  317   2HD2  LEU  40          2HD2      LEU  40  -2.484  11.504  -3.461
  318   3HD2  LEU  40          3HD2      LEU  40  -1.416  11.326  -4.853
  319    H    VAL  41           H        VAL  41  -4.263   6.583  -4.638
  320    HA   VAL  41           HA       VAL  41  -7.043   7.552  -4.746
  321    HB   VAL  41           HB       VAL  41  -5.998   5.137  -3.253
  322   1HG1  VAL  41          1HG1      VAL  41  -8.065   6.067  -2.357
  323   2HG1  VAL  41          2HG1      VAL  41  -8.802   5.985  -3.957
  324   3HG1  VAL  41          3HG1      VAL  41  -8.353   4.501  -3.116
  325   1HG2  VAL  41          1HG2      VAL  41  -5.681   4.809  -5.646
  326   2HG2  VAL  41          2HG2      VAL  41  -6.980   3.779  -5.047
  327   3HG2  VAL  41          3HG2      VAL  41  -7.363   5.249  -5.943
  328    H    GLU  42           H        GLU  42  -7.067   9.353  -3.546
  329    HA   GLU  42           HA       GLU  42  -5.377   9.610  -1.208
  330   1HB   GLU  42          1HB       GLU  42  -5.512  11.461  -2.760
  331   2HB   GLU  42          2HB       GLU  42  -7.260  11.518  -2.607
  332   1HG   GLU  42          1HG       GLU  42  -5.797  11.853  -0.089
  333   2HG   GLU  42          2HG       GLU  42  -5.524  13.120  -1.284
  334    H    HIS  43           H        HIS  43  -8.772   9.191  -1.961
  335    HA   HIS  43           HA       HIS  43  -9.502   9.614   0.827
  336   1HB   HIS  43          1HB       HIS  43 -11.242   8.972  -1.560
  337   2HB   HIS  43          2HB       HIS  43 -11.832   9.294   0.065
  338    HD1  HIS  43           HD1      HIS  43 -11.247  11.798   0.983
  339    HD2  HIS  43           HD2      HIS  43 -10.992  11.173  -3.120
  340    HE1  HIS  43           HE1      HIS  43 -11.324  14.085  -0.059
  341    HE2  HIS  43           HE2      HIS  43 -11.126  13.688  -2.541
  342    H    TRP  44           H        TRP  44  -8.285   7.788   1.606
  343    HA   TRP  44           HA       TRP  44 -10.032   5.446   1.676
  344   1HB   TRP  44          1HB       TRP  44  -8.149   4.964   0.086
  345   2HB   TRP  44          2HB       TRP  44  -7.022   5.210   1.415
  346    HD1  TRP  44           HD1      TRP  44 -10.171   2.985   0.854
  347    HE1  TRP  44           HE1      TRP  44  -9.656   0.640   1.791
  348    HE3  TRP  44           HE3      TRP  44  -5.429   3.824   2.563
  349    HZ2  TRP  44           HZ2      TRP  44  -7.520  -0.672   3.079
  350    HZ3  TRP  44           HZ3      TRP  44  -4.216   1.970   3.632
  351    HH2  TRP  44           HH2      TRP  44  -5.242  -0.231   3.886
  352    HA   PRO  45           HA       PRO  45  -8.963   7.168   5.757
  353   1HB   PRO  45          1HB       PRO  45 -11.625   6.336   6.573
  354   2HB   PRO  45          2HB       PRO  45 -10.957   7.965   6.446
  355   1HG   PRO  45          1HG       PRO  45 -12.878   7.023   4.772
  356   2HG   PRO  45          2HG       PRO  45 -11.683   8.239   4.288
  357   1HD   PRO  45          1HD       PRO  45 -11.718   5.294   3.739
  358   2HD   PRO  45          2HD       PRO  45 -11.283   6.637   2.659
  359    H    VAL  46           H        VAL  46  -7.715   5.951   6.984
  360    HA   VAL  46           HA       VAL  46  -8.946   3.648   8.325
  361    HB   VAL  46           HB       VAL  46  -6.049   3.762   7.436
  362   1HG1  VAL  46          1HG1      VAL  46  -7.558   1.598   8.904
  363   2HG1  VAL  46          2HG1      VAL  46  -5.895   1.486   8.327
  364   3HG1  VAL  46          3HG1      VAL  46  -6.313   2.645   9.587
  365   1HG2  VAL  46          1HG2      VAL  46  -7.530   3.285   5.564
  366   2HG2  VAL  46          2HG2      VAL  46  -6.610   1.849   6.009
  367   3HG2  VAL  46          3HG2      VAL  46  -8.302   1.995   6.486
  368    HA   PRO  47           HA       PRO  47  -7.880   6.677  11.514
  369   1HB   PRO  47          1HB       PRO  47  -9.233   4.713  13.258
  370   2HB   PRO  47          2HB       PRO  47  -9.576   6.429  13.016
  371   1HG   PRO  47          1HG       PRO  47 -11.189   4.530  12.031
  372   2HG   PRO  47          2HG       PRO  47 -10.889   6.042  11.155
  373   1HD   PRO  47          1HD       PRO  47  -9.738   3.317  10.685
  374   2HD   PRO  47          2HD       PRO  47 -10.272   4.534   9.507
  375    H    SER  48           H        SER  48  -8.010   3.391  12.847
  376    HA   SER  48           HA       SER  48  -5.149   3.189  13.086
  377   1HB   SER  48          1HB       SER  48  -6.824   3.311  15.614
  378   2HB   SER  48          2HB       SER  48  -5.088   3.015  15.525
  379    HG   SER  48           HG       SER  48  -5.461   5.237  14.217
  380    H    LEU  49           H        LEU  49  -5.825   1.429  11.695
  381    HA   LEU  49           HA       LEU  49  -6.607  -0.628  11.132
  382   1HB   LEU  49          1HB       LEU  49  -6.041  -1.232  14.040
  383   2HB   LEU  49          2HB       LEU  49  -6.212  -2.412  12.756
  384    HG   LEU  49           HG       LEU  49  -3.991  -0.389  13.054
  385   1HD1  LEU  49          1HD1      LEU  49  -3.787  -2.274  14.558
  386   2HD1  LEU  49          2HD1      LEU  49  -4.016  -3.398  13.218
  387   3HD1  LEU  49          3HD1      LEU  49  -2.578  -2.379  13.278
  388   1HD2  LEU  49          1HD2      LEU  49  -4.415  -2.434  10.877
  389   2HD2  LEU  49          2HD2      LEU  49  -4.571  -0.687  10.695
  390   3HD2  LEU  49          3HD2      LEU  49  -3.000  -1.398  11.072
  391    H    GLY  50           H        GLY  50  -8.024  -2.509  12.929
  392   1HA   GLY  50          1HA       GLY  50 -10.085  -2.833  13.944
  393   2HA   GLY  50          2HA       GLY  50 -10.317  -1.091  13.964
  394    H    GLN  51           H        GLN  51 -10.557  -0.168  11.640
  395    HA   GLN  51           HA       GLN  51 -12.797  -1.534  10.431
  396   1HB   GLN  51          1HB       GLN  51 -11.412   1.050   9.695
  397   2HB   GLN  51          2HB       GLN  51 -12.869   0.443   8.924
  398   1HG   GLN  51          1HG       GLN  51 -14.039   0.565  11.083
  399   2HG   GLN  51          2HG       GLN  51 -12.582   1.242  11.812
  400   1HE2  GLN  51          2HE2      GLN  51 -15.257   2.390  11.547
  401   2HE2  GLN  51          1HE2      GLN  51 -15.052   3.872  10.677
  402    H    LEU  52           H        LEU  52  -9.663  -2.115  10.241
  403    HA   LEU  52           HA       LEU  52  -9.308  -2.294   7.396
  404   1HB   LEU  52          1HB       LEU  52  -7.395  -1.961   8.923
  405   2HB   LEU  52          2HB       LEU  52  -7.696  -3.537   9.630
  406    HG   LEU  52           HG       LEU  52  -7.204  -4.598   7.455
  407   1HD1  LEU  52          1HD1      LEU  52  -6.231  -3.290   5.650
  408   2HD1  LEU  52          2HD1      LEU  52  -7.865  -2.728   6.011
  409   3HD1  LEU  52          3HD1      LEU  52  -6.469  -1.808   6.576
  410   1HD2  LEU  52          1HD2      LEU  52  -5.426  -4.371   9.083
  411   2HD2  LEU  52          2HD2      LEU  52  -4.787  -4.146   7.456
  412   3HD2  LEU  52          3HD2      LEU  52  -5.063  -2.748   8.494
  413    H    GLN  53           H        GLN  53 -10.985  -3.502   6.658
  414    HA   GLN  53           HA       GLN  53 -10.927  -6.365   7.311
  415   1HB   GLN  53          1HB       GLN  53 -13.411  -4.667   6.925
  416   2HB   GLN  53          2HB       GLN  53 -13.391  -6.410   7.163
  417   1HG   GLN  53          1HG       GLN  53 -12.484  -6.132   9.386
  418   2HG   GLN  53          2HG       GLN  53 -12.381  -4.388   9.152
  419   1HE2  GLN  53          2HE2      GLN  53 -14.946  -4.272   7.752
  420   2HE2  GLN  53          1HE2      GLN  53 -16.163  -4.461   8.968
  421    HA   PRO  54           HA       PRO  54 -10.774  -7.307   2.993
  422   1HB   PRO  54          1HB       PRO  54 -13.427  -8.653   3.277
  423   2HB   PRO  54          2HB       PRO  54 -11.932  -9.251   2.545
  424   1HG   PRO  54          1HG       PRO  54 -12.661 -10.078   4.958
  425   2HG   PRO  54          2HG       PRO  54 -10.961  -9.723   4.599
  426   1HD   PRO  54          1HD       PRO  54 -12.943  -8.131   6.160
  427   2HD   PRO  54          2HD       PRO  54 -11.196  -8.322   6.412
  428    H    ALA  55           H        ALA  55 -14.022  -6.319   4.076
  429    HA   ALA  55           HA       ALA  55 -14.870  -5.406   1.521
  430   1HB   ALA  55          1HB       ALA  55 -16.748  -4.413   2.699
  431   2HB   ALA  55          2HB       ALA  55 -16.439  -6.045   3.292
  432   3HB   ALA  55          3HB       ALA  55 -15.928  -4.650   4.241
  433    H    HIS  56           H        HIS  56 -12.899  -4.005   3.966
  434    HA   HIS  56           HA       HIS  56 -13.281  -1.290   2.946
  435   1HB   HIS  56          1HB       HIS  56 -13.081  -1.878   5.439
  436   2HB   HIS  56          2HB       HIS  56 -11.373  -2.138   5.124
  437    HD1  HIS  56           HD1      HIS  56 -13.969   0.561   5.303
  438    HD2  HIS  56           HD2      HIS  56  -9.848   0.186   4.831
  439    HE1  HIS  56           HE1      HIS  56 -13.036   2.884   5.571
  440    HE2  HIS  56           HE2      HIS  56 -10.537   2.602   5.467
  441    H    MET  57           H        MET  57 -11.131  -3.966   2.774
  442    HA   MET  57           HA       MET  57  -8.988  -2.449   1.506
  443   1HB   MET  57          1HB       MET  57  -8.640  -4.417   3.109
  444   2HB   MET  57          2HB       MET  57  -9.212  -5.450   1.809
  445   1HG   MET  57          1HG       MET  57  -6.835  -5.493   1.808
  446   2HG   MET  57          2HG       MET  57  -7.368  -4.595   0.389
  447   1HE   MET  57          1HE       MET  57  -4.778  -3.764   0.227
  448   2HE   MET  57          2HE       MET  57  -4.394  -4.603   1.730
  449   3HE   MET  57          3HE       MET  57  -3.964  -2.904   1.535
  450    H    ASP  58           H        ASP  58 -11.900  -3.525   0.655
  451    HA   ASP  58           HA       ASP  58 -11.730  -5.048  -1.633
  452   1HB   ASP  58          1HB       ASP  58 -13.836  -4.538  -0.510
  453   2HB   ASP  58          2HB       ASP  58 -13.699  -2.848  -0.979
  454    H    ALA  59           H        ALA  59 -11.392  -1.549  -1.292
  455    HA   ALA  59           HA       ALA  59 -11.451  -0.809  -3.970
  456   1HB   ALA  59          1HB       ALA  59  -9.770   0.401  -1.775
  457   2HB   ALA  59          2HB       ALA  59 -10.207   1.174  -3.300
  458   3HB   ALA  59          3HB       ALA  59 -11.457   0.792  -2.115
  459    H    VAL  60           H        VAL  60  -8.710  -1.892  -1.996
  460    HA   VAL  60           HA       VAL  60  -6.753  -1.577  -4.025
  461    HB   VAL  60           HB       VAL  60  -6.640  -3.483  -1.683
  462   1HG1  VAL  60          1HG1      VAL  60  -4.904  -3.843  -3.349
  463   2HG1  VAL  60          2HG1      VAL  60  -4.460  -2.137  -3.273
  464   3HG1  VAL  60          3HG1      VAL  60  -4.220  -3.173  -1.867
  465   1HG2  VAL  60          1HG2      VAL  60  -5.550  -1.669  -0.446
  466   2HG2  VAL  60          2HG2      VAL  60  -5.868  -0.571  -1.791
  467   3HG2  VAL  60          3HG2      VAL  60  -7.211  -1.264  -0.883
  468    H    LEU  61           H        LEU  61  -8.707  -4.307  -2.918
  469    HA   LEU  61           HA       LEU  61  -7.587  -6.271  -4.598
  470   1HB   LEU  61          1HB       LEU  61 -10.403  -6.087  -3.519
  471   2HB   LEU  61          2HB       LEU  61  -9.661  -7.527  -4.187
  472    HG   LEU  61           HG       LEU  61  -8.748  -6.105  -1.683
  473   1HD1  LEU  61          1HD1      LEU  61  -9.658  -8.047  -0.508
  474   2HD1  LEU  61          2HD1      LEU  61 -10.915  -7.179  -1.387
  475   3HD1  LEU  61          3HD1      LEU  61 -10.268  -8.686  -2.033
  476   1HD2  LEU  61          1HD2      LEU  61  -6.922  -7.231  -2.846
  477   2HD2  LEU  61          2HD2      LEU  61  -7.339  -8.080  -1.357
  478   3HD2  LEU  61          3HD2      LEU  61  -7.870  -8.717  -2.913
  479    H    ALA  62           H        ALA  62 -10.210  -3.969  -5.041
  480    HA   ALA  62           HA       ALA  62 -11.094  -4.947  -7.550
  481   1HB   ALA  62          1HB       ALA  62 -11.401  -2.188  -6.375
  482   2HB   ALA  62          2HB       ALA  62 -12.336  -2.864  -7.707
  483   3HB   ALA  62          3HB       ALA  62 -12.482  -3.551  -6.090
  484    H    LEU  63           H        LEU  63  -8.480  -2.868  -6.599
  485    HA   LEU  63           HA       LEU  63  -8.037  -1.762  -9.211
  486   1HB   LEU  63          1HB       LEU  63  -6.247  -1.919  -6.786
  487   2HB   LEU  63          2HB       LEU  63  -5.843  -1.054  -8.256
  488    HG   LEU  63           HG       LEU  63  -8.163  -0.421  -6.430
  489   1HD1  LEU  63          1HD1      LEU  63  -6.892   1.592  -5.887
  490   2HD1  LEU  63          2HD1      LEU  63  -6.011   0.135  -5.435
  491   3HD1  LEU  63          3HD1      LEU  63  -5.557   1.024  -6.888
  492   1HD2  LEU  63          1HD2      LEU  63  -8.429   1.572  -7.817
  493   2HD2  LEU  63          2HD2      LEU  63  -7.150   1.000  -8.888
  494   3HD2  LEU  63          3HD2      LEU  63  -8.659   0.097  -8.757
  495    H    ASN  64           H        ASN  64  -7.171  -4.660  -7.572
  496    HA   ASN  64           HA       ASN  64  -5.832  -6.428  -8.025
  497   1HB   ASN  64          1HB       ASN  64  -6.658  -5.642 -10.815
  498   2HB   ASN  64          2HB       ASN  64  -5.709  -7.083 -10.480
  499   1HD2  ASN  64          2HD2      ASN  64  -8.808  -5.607 -10.343
  500   2HD2  ASN  64          1HD2      ASN  64  -9.681  -6.995  -9.800
  501    HA   PRO  65           HA       PRO  65  -2.003  -4.073  -9.041
  502   1HB   PRO  65          1HB       PRO  65  -0.856  -4.124  -6.619
  503   2HB   PRO  65          2HB       PRO  65  -2.059  -2.902  -7.046
  504   1HG   PRO  65          1HG       PRO  65  -2.372  -5.378  -5.408
  505   2HG   PRO  65          2HG       PRO  65  -3.084  -3.774  -5.164
  506   1HD   PRO  65          1HD       PRO  65  -4.389  -5.929  -6.311
  507   2HD   PRO  65          2HD       PRO  65  -4.848  -4.231  -6.531
  508    H    ALA  66           H        ALA  66   0.233  -4.904  -8.904
  509    HA   ALA  66           HA       ALA  66   0.234  -7.806  -9.081
  510   1HB   ALA  66          1HB       ALA  66   2.462  -7.553 -10.038
  511   2HB   ALA  66          2HB       ALA  66   1.306  -6.501 -10.855
  512   3HB   ALA  66          3HB       ALA  66   2.433  -5.826  -9.677
  513    H    VAL  67           H        VAL  67   1.369  -5.258  -7.021
  514    HA   VAL  67           HA       VAL  67   1.890  -7.174  -4.929
  515    HB   VAL  67           HB       VAL  67   4.076  -7.147  -6.012
  516   1HG1  VAL  67          1HG1      VAL  67   5.423  -5.094  -6.119
  517   2HG1  VAL  67          2HG1      VAL  67   3.977  -5.002  -7.125
  518   3HG1  VAL  67          3HG1      VAL  67   4.025  -4.165  -5.574
  519   1HG2  VAL  67          1HG2      VAL  67   4.041  -7.376  -3.598
  520   2HG2  VAL  67          2HG2      VAL  67   5.463  -6.465  -4.105
  521   3HG2  VAL  67          3HG2      VAL  67   4.078  -5.622  -3.410
  522    H    ILE  68           H        ILE  68   1.596  -6.275  -2.900
  523    HA   ILE  68           HA       ILE  68   0.866  -3.417  -2.880
  524    HB   ILE  68           HB       ILE  68  -0.048  -5.553  -0.940
  525   1HG1  ILE  68          1HG1      ILE  68  -1.602  -4.281  -3.205
  526   2HG1  ILE  68          2HG1      ILE  68  -0.911  -5.899  -3.259
  527   1HG2  ILE  68          1HG2      ILE  68  -0.945  -2.701  -1.368
  528   2HG2  ILE  68          2HG2      ILE  68  -1.701  -3.853  -0.266
  529   3HG2  ILE  68          3HG2      ILE  68  -0.044  -3.322   0.016
  530   1HD1  ILE  68          1HD1      ILE  68  -3.016  -4.953  -1.330
  531   2HD1  ILE  68          2HD1      ILE  68  -3.288  -5.952  -2.757
  532   3HD1  ILE  68          3HD1      ILE  68  -2.338  -6.579  -1.409
  533    H    LEU  69           H        LEU  69   1.951  -2.071  -1.586
  534    HA   LEU  69           HA       LEU  69   3.772  -3.233   0.419
  535   1HB   LEU  69          1HB       LEU  69   3.910  -0.581  -1.020
  536   2HB   LEU  69          2HB       LEU  69   4.969  -1.041   0.297
  537    HG   LEU  69           HG       LEU  69   4.818  -2.385  -2.403
  538   1HD1  LEU  69          1HD1      LEU  69   5.878  -0.191  -2.475
  539   2HD1  LEU  69          2HD1      LEU  69   6.941  -0.651  -1.145
  540   3HD1  LEU  69          3HD1      LEU  69   7.068  -1.473  -2.699
  541   1HD2  LEU  69          1HD2      LEU  69   6.636  -2.926  -0.056
  542   2HD2  LEU  69          2HD2      LEU  69   5.333  -3.975  -0.616
  543   3HD2  LEU  69          3HD2      LEU  69   6.735  -3.685  -1.645
  544    H    LEU  70           H        LEU  70   3.164  -2.976   2.451
  545    HA   LEU  70           HA       LEU  70   1.174  -0.901   3.071
  546   1HB   LEU  70          1HB       LEU  70   1.060  -3.549   3.596
  547   2HB   LEU  70          2HB       LEU  70   1.871  -3.003   5.049
  548    HG   LEU  70           HG       LEU  70  -0.511  -3.164   5.442
  549   1HD1  LEU  70          1HD1      LEU  70  -0.991  -0.873   6.187
  550   2HD1  LEU  70          2HD1      LEU  70   0.637  -1.394   6.624
  551   3HD1  LEU  70          3HD1      LEU  70   0.398  -0.297   5.265
  552   1HD2  LEU  70          1HD2      LEU  70  -1.297  -2.916   3.161
  553   2HD2  LEU  70          2HD2      LEU  70  -2.104  -1.761   4.220
  554   3HD2  LEU  70          3HD2      LEU  70  -0.806  -1.222   3.156
  555    H    GLY  71           H        GLY  71   2.009   0.892   3.933
  556   1HA   GLY  71          1HA       GLY  71   4.413   0.618   5.638
  557   2HA   GLY  71          2HA       GLY  71   4.105   2.010   4.607
  558    H    THR  72           H        THR  72   3.622   0.613   7.684
  559    HA   THR  72           HA       THR  72   1.452   2.421   8.367
  560    HB   THR  72           HB       THR  72   1.600   1.309  10.630
  561    HG1  THR  72           HG1      THR  72   3.539   0.394  10.814
  562   1HG2  THR  72          1HG2      THR  72   1.207  -0.507   8.249
  563   2HG2  THR  72          2HG2      THR  72   0.578  -0.776   9.874
  564   3HG2  THR  72          3HG2      THR  72  -0.002   0.588   8.919
  565    H    GLY  73           H        GLY  73   3.001   4.214   7.845
  566   1HA   GLY  73          1HA       GLY  73   4.433   5.914   8.441
  567   2HA   GLY  73          2HA       GLY  73   3.599   5.772   9.976
  568    H    GLU  74           H        GLU  74   4.803   5.461  11.672
  569    HA   GLU  74           HA       GLU  74   7.579   4.539  11.342
  570   1HB   GLU  74          1HB       GLU  74   7.189   6.819  12.289
  571   2HB   GLU  74          2HB       GLU  74   6.311   6.084  13.620
  572   1HG   GLU  74          1HG       GLU  74   8.487   4.770  14.035
  573   2HG   GLU  74          2HG       GLU  74   9.236   6.000  13.018
  574    H    ARG  75           H        ARG  75   4.561   3.571  12.414
  575    HA   ARG  75           HA       ARG  75   5.598   1.974  14.657
  576   1HB   ARG  75          1HB       ARG  75   3.746   3.803  14.874
  577   2HB   ARG  75          2HB       ARG  75   2.699   2.584  14.169
  578   1HG   ARG  75          1HG       ARG  75   3.007   1.130  16.016
  579   2HG   ARG  75          2HG       ARG  75   4.318   2.128  16.661
  580   1HD   ARG  75          1HD       ARG  75   2.613   4.008  16.794
  581   2HD   ARG  75          2HD       ARG  75   1.386   2.780  16.497
  582    HE   ARG  75           HE       ARG  75   1.755   1.906  18.626
  583   1HH1  ARG  75          1HH1      ARG  75   4.019   4.480  17.935
  584   2HH1  ARG  75          2HH1      ARG  75   4.374   4.798  19.604
  585   1HH2  ARG  75          1HH2      ARG  75   2.227   2.327  20.843
  586   2HH2  ARG  75          2HH2      ARG  75   3.382   3.564  21.239
  587    H    GLN  76           H        GLN  76   5.960  -0.070  14.057
  588    HA   GLN  76           HA       GLN  76   4.923  -1.200  11.681
  589   1HB   GLN  76          1HB       GLN  76   7.077  -1.873  12.642
  590   2HB   GLN  76          2HB       GLN  76   6.250  -2.552  14.038
  591   1HG   GLN  76          1HG       GLN  76   5.135  -4.172  12.567
  592   2HG   GLN  76          2HG       GLN  76   6.020  -3.508  11.192
  593   1HE2  GLN  76          2HE2      GLN  76   6.242  -5.356  14.125
  594   2HE2  GLN  76          1HE2      GLN  76   7.812  -6.019  13.834
  595    H    GLN  77           H        GLN  77   2.831  -1.652  11.432
  596    HA   GLN  77           HA       GLN  77   1.462  -3.112  13.597
  597   1HB   GLN  77          1HB       GLN  77   0.212  -1.373  11.456
  598   2HB   GLN  77          2HB       GLN  77  -0.648  -2.210  12.741
  599   1HG   GLN  77          1HG       GLN  77   0.514  -0.835  14.403
  600   2HG   GLN  77          2HG       GLN  77   1.351   0.013  13.104
  601   1HE2  GLN  77          2HE2      GLN  77  -1.649  -0.435  14.774
  602   2HE2  GLN  77          1HE2      GLN  77  -2.479   0.913  14.069
  603    H    PHE  78           H        PHE  78  -0.036  -4.775  12.908
  604    HA   PHE  78           HA       PHE  78   0.806  -5.987  10.364
  605   1HB   PHE  78          1HB       PHE  78  -0.214  -7.326  12.880
  606   2HB   PHE  78          2HB       PHE  78   0.190  -8.160  11.384
  607    HD1  PHE  78           HD1      PHE  78   2.541  -8.243  10.615
  608    HD2  PHE  78           HD2      PHE  78   1.462  -6.661  14.416
  609    HE1  PHE  78           HE1      PHE  78   4.875  -8.458  11.366
  610    HE2  PHE  78           HE2      PHE  78   3.794  -6.874  15.171
  611    HZ   PHE  78           HZ       PHE  78   5.501  -7.774  13.644
  612    HA   PRO  79           HA       PRO  79  -3.374  -5.539   8.951
  613   1HB   PRO  79          1HB       PRO  79  -2.818  -7.779   7.136
  614   2HB   PRO  79          2HB       PRO  79  -3.175  -6.093   6.754
  615   1HG   PRO  79          1HG       PRO  79  -0.723  -7.152   6.399
  616   2HG   PRO  79          2HG       PRO  79  -0.965  -5.459   6.868
  617   1HD   PRO  79          1HD       PRO  79  -0.204  -7.808   8.566
  618   2HD   PRO  79          2HD       PRO  79   0.420  -6.144   8.602
  619    H    SER  80           H        SER  80  -5.347  -6.587   9.117
  620    HA   SER  80           HA       SER  80  -5.567  -8.608  11.055
  621   1HB   SER  80          1HB       SER  80  -7.359  -6.985  10.666
  622   2HB   SER  80          2HB       SER  80  -7.615  -7.630   9.046
  623    HG   SER  80           HG       SER  80  -8.991  -8.381  10.939
  624    H    THR  81           H        THR  81  -5.826 -10.772  10.927
  625    HA   THR  81           HA       THR  81  -4.839 -12.183   8.719
  626    HB   THR  81           HB       THR  81  -4.742 -13.123  10.962
  627    HG1  THR  81           HG1      THR  81  -4.757 -14.976   9.961
  628   1HG2  THR  81          1HG2      THR  81  -6.739 -13.985  12.084
  629   2HG2  THR  81          2HG2      THR  81  -6.848 -12.242  11.834
  630   3HG2  THR  81          3HG2      THR  81  -7.748 -13.341  10.790
  631    H    ASP  82           H        ASP  82  -8.021 -11.073   9.493
  632    HA   ASP  82           HA       ASP  82  -9.478 -12.896   7.869
  633   1HB   ASP  82          1HB       ASP  82 -10.367 -11.425   9.767
  634   2HB   ASP  82          2HB       ASP  82 -10.362 -10.106   8.600
  635    H    VAL  83           H        VAL  83  -7.838  -9.874   7.323
  636    HA   VAL  83           HA       VAL  83  -8.933  -9.439   4.695
  637    HB   VAL  83           HB       VAL  83  -6.462  -8.189   5.910
  638   1HG1  VAL  83          1HG1      VAL  83  -8.284  -7.236   3.705
  639   2HG1  VAL  83          2HG1      VAL  83  -6.888  -6.369   4.344
  640   3HG1  VAL  83          3HG1      VAL  83  -6.663  -7.898   3.495
  641   1HG2  VAL  83          1HG2      VAL  83  -7.915  -6.334   6.593
  642   2HG2  VAL  83          2HG2      VAL  83  -9.323  -7.248   6.051
  643   3HG2  VAL  83          3HG2      VAL  83  -8.350  -7.842   7.396
  644    H    LEU  84           H        LEU  84  -6.141 -10.972   6.112
  645    HA   LEU  84           HA       LEU  84  -4.466 -11.128   3.878
  646   1HB   LEU  84          1HB       LEU  84  -4.743 -13.068   6.175
  647   2HB   LEU  84          2HB       LEU  84  -3.403 -13.027   5.045
  648    HG   LEU  84           HG       LEU  84  -4.134 -10.837   6.994
  649   1HD1  LEU  84          1HD1      LEU  84  -1.816 -12.769   6.963
  650   2HD1  LEU  84          2HD1      LEU  84  -2.060 -11.457   8.119
  651   3HD1  LEU  84          3HD1      LEU  84  -3.188 -12.812   8.072
  652   1HD2  LEU  84          1HD2      LEU  84  -3.168  -9.952   4.925
  653   2HD2  LEU  84          2HD2      LEU  84  -2.054  -9.781   6.283
  654   3HD2  LEU  84          3HD2      LEU  84  -1.803 -11.056   5.093
  655    H    ALA  85           H        ALA  85  -7.133 -13.169   4.919
  656    HA   ALA  85           HA       ALA  85  -6.769 -15.314   3.164
  657   1HB   ALA  85          1HB       ALA  85  -9.358 -14.172   4.209
  658   2HB   ALA  85          2HB       ALA  85  -9.149 -15.772   3.495
  659   3HB   ALA  85          3HB       ALA  85  -8.352 -15.371   5.018
  660    H    ALA  86           H        ALA  86  -8.475 -12.248   2.732
  661    HA   ALA  86           HA       ALA  86  -9.562 -12.812   0.191
  662   1HB   ALA  86          1HB       ALA  86  -9.952 -10.407   0.029
  663   2HB   ALA  86          2HB       ALA  86 -10.402 -11.018   1.621
  664   3HB   ALA  86          3HB       ALA  86  -8.890 -10.135   1.410
  665    H    CYS  87           H        CYS  87  -6.570 -11.168   1.180
  666    HA   CYS  87           HA       CYS  87  -5.735 -10.504  -1.446
  667   1HB   CYS  87          1HB       CYS  87  -4.884  -9.490   0.718
  668   2HB   CYS  87          2HB       CYS  87  -3.934 -10.955   0.939
  669    HG   CYS  87           HG       CYS  87  -2.199 -10.553  -1.095
  670    H    LEU  88           H        LEU  88  -5.248 -13.298   0.624
  671    HA   LEU  88           HA       LEU  88  -3.303 -14.621  -0.925
  672   1HB   LEU  88          1HB       LEU  88  -3.962 -15.151   1.442
  673   2HB   LEU  88          2HB       LEU  88  -5.428 -15.878   0.819
  674    HG   LEU  88           HG       LEU  88  -2.743 -16.880  -0.087
  675   1HD1  LEU  88          1HD1      LEU  88  -2.682 -16.853   2.358
  676   2HD1  LEU  88          2HD1      LEU  88  -4.212 -17.730   2.408
  677   3HD1  LEU  88          3HD1      LEU  88  -2.775 -18.501   1.735
  678   1HD2  LEU  88          1HD2      LEU  88  -4.732 -17.668  -1.275
  679   2HD2  LEU  88          2HD2      LEU  88  -3.981 -18.976  -0.362
  680   3HD2  LEU  88          3HD2      LEU  88  -5.442 -18.198   0.249
  681    H    THR  89           H        THR  89  -6.849 -14.746  -0.954
  682    HA   THR  89           HA       THR  89  -7.005 -16.747  -2.966
  683    HB   THR  89           HB       THR  89  -9.409 -16.004  -3.165
  684    HG1  THR  89           HG1      THR  89  -8.481 -13.845  -1.928
  685   1HG2  THR  89          1HG2      THR  89  -8.742 -17.807  -1.668
  686   2HG2  THR  89          2HG2      THR  89  -8.361 -16.636  -0.404
  687   3HG2  THR  89          3HG2      THR  89 -10.028 -16.844  -0.941
  688    H    ARG  90           H        ARG  90  -6.089 -13.532  -3.180
  689    HA   ARG  90           HA       ARG  90  -6.937 -13.361  -5.986
  690   1HB   ARG  90          1HB       ARG  90  -5.835 -11.244  -4.134
  691   2HB   ARG  90          2HB       ARG  90  -6.179 -10.983  -5.837
  692   1HG   ARG  90          1HG       ARG  90  -8.164 -11.671  -3.681
  693   2HG   ARG  90          2HG       ARG  90  -7.988 -10.124  -4.510
  694   1HD   ARG  90          1HD       ARG  90  -8.825 -12.740  -5.756
  695   2HD   ARG  90          2HD       ARG  90  -9.871 -11.366  -5.411
  696    HE   ARG  90           HE       ARG  90  -7.828 -10.443  -7.052
  697   1HH1  ARG  90          1HH1      ARG  90 -10.474 -12.740  -7.241
  698   2HH1  ARG  90          2HH1      ARG  90 -10.672 -12.545  -8.955
  699   1HH2  ARG  90          1HH2      ARG  90  -8.107 -10.177  -9.290
  700   2HH2  ARG  90          2HH2      ARG  90  -9.320 -11.108 -10.128
  701    H    GLY  91           H        GLY  91  -4.302 -14.131  -4.031
  702   1HA   GLY  91          1HA       GLY  91  -2.191 -14.848  -4.596
  703   2HA   GLY  91          2HA       GLY  91  -2.628 -14.631  -6.284
  704    H    ILE  92           H        ILE  92  -2.791 -12.075  -3.890
  705    HA   ILE  92           HA       ILE  92  -0.759 -10.626  -5.440
  706    HB   ILE  92           HB       ILE  92  -2.748  -9.478  -3.471
  707   1HG1  ILE  92          1HG1      ILE  92  -2.888  -9.508  -6.498
  708   2HG1  ILE  92          2HG1      ILE  92  -3.856 -10.529  -5.441
  709   1HG2  ILE  92          1HG2      ILE  92  -0.773  -8.097  -3.789
  710   2HG2  ILE  92          2HG2      ILE  92  -0.977  -8.176  -5.540
  711   3HG2  ILE  92          3HG2      ILE  92  -2.173  -7.342  -4.548
  712   1HD1  ILE  92          1HD1      ILE  92  -4.919  -8.560  -4.494
  713   2HD1  ILE  92          2HD1      ILE  92  -3.927  -7.524  -5.519
  714   3HD1  ILE  92          3HD1      ILE  92  -5.114  -8.606  -6.247
  715    H    GLY  93           H        GLY  93   1.098  -9.936  -4.515
  716   1HA   GLY  93          1HA       GLY  93   1.838 -10.998  -1.950
  717   2HA   GLY  93          2HA       GLY  93   2.845 -10.012  -3.003
  718    H    LEU  94           H        LEU  94   2.501  -9.824  -0.124
  719    HA   LEU  94           HA       LEU  94   1.635  -7.036   0.048
  720   1HB   LEU  94          1HB       LEU  94  -0.328  -8.303   0.701
  721   2HB   LEU  94          2HB       LEU  94   0.620  -9.258   1.823
  722    HG   LEU  94           HG       LEU  94   1.016  -7.238   3.187
  723   1HD1  LEU  94          1HD1      LEU  94   0.835  -5.559   1.436
  724   2HD1  LEU  94          2HD1      LEU  94  -0.881  -5.923   1.249
  725   3HD1  LEU  94          3HD1      LEU  94  -0.287  -5.217   2.753
  726   1HD2  LEU  94          1HD2      LEU  94  -1.882  -7.843   2.619
  727   2HD2  LEU  94          2HD2      LEU  94  -0.830  -8.727   3.725
  728   3HD2  LEU  94          3HD2      LEU  94  -1.261  -7.051   4.068
  729    H    GLU  95           H        GLU  95   3.519  -6.141   0.591
  730    HA   GLU  95           HA       GLU  95   5.162  -7.422   2.663
  731   1HB   GLU  95          1HB       GLU  95   5.818  -5.217   0.700
  732   2HB   GLU  95          2HB       GLU  95   6.928  -5.829   1.920
  733   1HG   GLU  95          1HG       GLU  95   5.739  -7.445  -0.327
  734   2HG   GLU  95          2HG       GLU  95   7.364  -6.762  -0.302
  735    H    ALA  96           H        ALA  96   5.093  -6.649   4.664
  736    HA   ALA  96           HA       ALA  96   3.874  -4.017   5.107
  737   1HB   ALA  96          1HB       ALA  96   2.783  -5.902   6.218
  738   2HB   ALA  96          2HB       ALA  96   4.292  -6.289   7.047
  739   3HB   ALA  96          3HB       ALA  96   3.460  -4.773   7.391
  740    H    MET  97           H        MET  97   5.167  -2.383   5.519
  741    HA   MET  97           HA       MET  97   7.516  -2.737   7.212
  742   1HB   MET  97          1HB       MET  97   7.630  -1.628   4.401
  743   2HB   MET  97          2HB       MET  97   8.889  -1.355   5.597
  744   1HG   MET  97          1HG       MET  97   9.295  -3.755   5.728
  745   2HG   MET  97          2HG       MET  97   8.018  -4.039   4.545
  746   1HE   MET  97          1HE       MET  97   9.495  -2.340   1.339
  747   2HE   MET  97          2HE       MET  97   8.466  -1.581   2.554
  748   3HE   MET  97          3HE       MET  97   8.134  -3.230   2.026
  749    H    THR  98           H        THR  98   8.606  -0.270   7.044
  750    HA   THR  98           HA       THR  98   6.519   1.448   8.098
  751    HB   THR  98           HB       THR  98   8.509   2.997   8.529
  752    HG1  THR  98           HG1      THR  98  10.423   1.201   8.574
  753   1HG2  THR  98          1HG2      THR  98   7.510   1.626  10.284
  754   2HG2  THR  98          2HG2      THR  98   8.498   0.252   9.793
  755   3HG2  THR  98          3HG2      THR  98   9.262   1.689  10.472
  756    H    ASN  99           H        ASN  99   6.767   3.858   7.471
  757    HA   ASN  99           HA       ASN  99   6.014   4.173   4.797
  758   1HB   ASN  99          1HB       ASN  99   5.374   5.770   6.530
  759   2HB   ASN  99          2HB       ASN  99   7.055   6.238   6.752
  760   1HD2  ASN  99          2HD2      ASN  99   4.254   6.485   4.729
  761   2HD2  ASN  99          1HD2      ASN  99   4.834   7.771   3.736
  762    H    ALA 100           H        ALA 100   9.091   5.000   6.383
  763    HA   ALA 100           HA       ALA 100  10.357   6.014   4.083
  764   1HB   ALA 100          1HB       ALA 100  11.142   6.473   6.349
  765   2HB   ALA 100          2HB       ALA 100  11.615   4.783   6.530
  766   3HB   ALA 100          3HB       ALA 100  12.429   5.806   5.347
  767    H    ALA 101           H        ALA 101  10.122   2.751   5.370
  768    HA   ALA 101           HA       ALA 101  12.125   1.651   3.656
  769   1HB   ALA 101          1HB       ALA 101   9.940   0.257   5.197
  770   2HB   ALA 101          2HB       ALA 101  11.338  -0.517   4.449
  771   3HB   ALA 101          3HB       ALA 101  11.565   0.608   5.789
  772    H    ALA 102           H        ALA 102   8.582   1.749   3.587
  773    HA   ALA 102           HA       ALA 102   8.321   0.135   1.265
  774   1HB   ALA 102          1HB       ALA 102   6.000   0.865   1.248
  775   2HB   ALA 102          2HB       ALA 102   6.506   0.426   2.881
  776   3HB   ALA 102          3HB       ALA 102   6.374   2.124   2.423
  777    H    ALA 103           H        ALA 103   8.708   3.582   1.795
  778    HA   ALA 103           HA       ALA 103   8.050   4.489  -0.784
  779   1HB   ALA 103          1HB       ALA 103   9.309   6.491  -0.222
  780   2HB   ALA 103          2HB       ALA 103   8.324   5.979   1.149
  781   3HB   ALA 103          3HB       ALA 103  10.059   5.660   1.140
  782    H    ARG 104           H        ARG 104  11.036   3.229   0.584
  783    HA   ARG 104           HA       ARG 104  12.730   3.732  -1.609
  784   1HB   ARG 104          1HB       ARG 104  13.567   3.110   0.612
  785   2HB   ARG 104          2HB       ARG 104  12.846   1.515   0.448
  786   1HG   ARG 104          1HG       ARG 104  14.323   1.191  -1.570
  787   2HG   ARG 104          2HG       ARG 104  15.159   2.667  -1.079
  788   1HD   ARG 104          1HD       ARG 104  14.844   0.164   0.574
  789   2HD   ARG 104          2HD       ARG 104  16.314   0.689  -0.244
  790    HE   ARG 104           HE       ARG 104  16.285   2.643   1.275
  791   1HH1  ARG 104          1HH1      ARG 104  14.475  -0.224   2.176
  792   2HH1  ARG 104          2HH1      ARG 104  14.630   0.074   3.881
  793   1HH2  ARG 104          1HH2      ARG 104  16.468   3.041   3.502
  794   2HH2  ARG 104          2HH2      ARG 104  15.751   1.930   4.638
  795    H    THR 105           H        THR 105  10.751   0.931  -0.744
  796    HA   THR 105           HA       THR 105  11.566  -0.721  -2.872
  797    HB   THR 105           HB       THR 105   8.855  -0.874  -1.577
  798    HG1  THR 105           HG1      THR 105  10.990  -2.202  -0.368
  799   1HG2  THR 105          1HG2      THR 105   9.239  -3.288  -1.790
  800   2HG2  THR 105          2HG2      THR 105   9.358  -2.482  -3.355
  801   3HG2  THR 105          3HG2      THR 105  10.821  -2.974  -2.503
  802    H    TYR 106           H        TYR 106   8.938   1.615  -2.520
  803    HA   TYR 106           HA       TYR 106   7.518   1.074  -4.859
  804   1HB   TYR 106          1HB       TYR 106   6.695   2.595  -3.117
  805   2HB   TYR 106          2HB       TYR 106   7.969   3.746  -3.505
  806    HD1  TYR 106           HD1      TYR 106   4.850   2.195  -4.747
  807    HD2  TYR 106           HD2      TYR 106   7.745   5.261  -5.334
  808    HE1  TYR 106           HE1      TYR 106   3.371   3.275  -6.389
  809    HE2  TYR 106           HE2      TYR 106   6.273   6.346  -6.977
  810    HH   TYR 106           HH       TYR 106   3.010   5.529  -7.351
  811    H    ASN 107           H        ASN 107  10.310   3.184  -4.325
  812    HA   ASN 107           HA       ASN 107  10.499   4.312  -6.873
  813   1HB   ASN 107          1HB       ASN 107  11.794   4.909  -4.753
  814   2HB   ASN 107          2HB       ASN 107  12.864   3.573  -5.144
  815   1HD2  ASN 107          2HD2      ASN 107  12.677   4.116  -8.062
  816   2HD2  ASN 107          1HD2      ASN 107  13.663   5.520  -8.318
  817    H    VAL 108           H        VAL 108  11.823   1.292  -5.596
  818    HA   VAL 108           HA       VAL 108  13.317   0.625  -7.916
  819    HB   VAL 108           HB       VAL 108  12.263  -1.239  -5.782
  820   1HG1  VAL 108          1HG1      VAL 108  14.127  -2.688  -6.451
  821   2HG1  VAL 108          2HG1      VAL 108  13.001  -2.413  -7.781
  822   3HG1  VAL 108          3HG1      VAL 108  14.541  -1.553  -7.736
  823   1HG2  VAL 108          1HG2      VAL 108  14.892   0.235  -5.926
  824   2HG2  VAL 108          2HG2      VAL 108  13.575   0.570  -4.802
  825   3HG2  VAL 108          3HG2      VAL 108  14.447  -0.961  -4.710
  826    H    LEU 109           H        LEU 109  10.151  -0.458  -6.704
  827    HA   LEU 109           HA       LEU 109   9.666  -2.291  -8.794
  828   1HB   LEU 109          1HB       LEU 109   7.702  -0.876  -6.993
  829   2HB   LEU 109          2HB       LEU 109   7.341  -2.276  -7.986
  830    HG   LEU 109           HG       LEU 109   9.298  -2.212  -5.685
  831   1HD1  LEU 109          1HD1      LEU 109   6.962  -2.074  -4.973
  832   2HD1  LEU 109          2HD1      LEU 109   6.592  -3.514  -5.921
  833   3HD1  LEU 109          3HD1      LEU 109   7.686  -3.624  -4.543
  834   1HD2  LEU 109          1HD2      LEU 109   8.379  -4.511  -7.408
  835   2HD2  LEU 109          2HD2      LEU 109   9.980  -3.770  -7.438
  836   3HD2  LEU 109          3HD2      LEU 109   9.431  -4.626  -5.997
  837    H    ALA 110           H        ALA 110   9.010   1.140  -8.467
  838    HA   ALA 110           HA       ALA 110   7.248   1.401 -10.656
  839   1HB   ALA 110          1HB       ALA 110   7.523   3.135  -8.946
  840   2HB   ALA 110          2HB       ALA 110   9.154   3.453  -9.536
  841   3HB   ALA 110          3HB       ALA 110   7.763   3.777 -10.571
  842    H    SER 111           H        SER 111  10.767   1.421 -10.418
  843    HA   SER 111           HA       SER 111  11.082   2.081 -13.211
  844   1HB   SER 111          1HB       SER 111  13.527   1.692 -12.718
  845   2HB   SER 111          2HB       SER 111  12.759   2.938 -11.734
  846    HG   SER 111           HG       SER 111  12.600   0.439 -10.616
  847    H    GLU 112           H        GLU 112  10.437  -0.716 -11.469
  848    HA   GLU 112           HA       GLU 112  11.788  -2.551 -13.254
  849   1HB   GLU 112          1HB       GLU 112  11.277  -2.928 -10.766
  850   2HB   GLU 112          2HB       GLU 112   9.617  -3.209 -11.259
  851   1HG   GLU 112          1HG       GLU 112  11.945  -4.795 -12.312
  852   2HG   GLU 112          2HG       GLU 112  11.021  -5.255 -10.887
  853    H    GLY 113           H        GLY 113   8.576  -1.248 -12.719
  854   1HA   GLY 113          1HA       GLY 113   7.010  -0.950 -14.499
  855   2HA   GLY 113          2HA       GLY 113   7.754  -2.306 -15.337
  856    H    ARG 114           H        ARG 114   6.687  -2.059 -11.984
  857    HA   ARG 114           HA       ARG 114   4.684  -4.144 -12.517
  858   1HB   ARG 114          1HB       ARG 114   6.658  -5.170 -11.499
  859   2HB   ARG 114          2HB       ARG 114   6.622  -3.994 -10.195
  860   1HG   ARG 114          1HG       ARG 114   4.715  -4.950  -9.235
  861   2HG   ARG 114          2HG       ARG 114   4.333  -5.864 -10.697
  862   1HD   ARG 114          1HD       ARG 114   6.817  -6.310  -9.049
  863   2HD   ARG 114          2HD       ARG 114   5.321  -7.217  -8.826
  864    HE   ARG 114           HE       ARG 114   5.599  -7.935 -11.196
  865   1HH1  ARG 114          1HH1      ARG 114   8.383  -7.001  -9.275
  866   2HH1  ARG 114          2HH1      ARG 114   9.509  -7.848 -10.286
  867   1HH2  ARG 114          1HH2      ARG 114   7.093  -9.076 -12.498
  868   2HH2  ARG 114          2HH2      ARG 114   8.787  -9.016 -12.115
  869    H    ARG 115           H        ARG 115   2.696  -3.657 -11.761
  870    HA   ARG 115           HA       ARG 115   2.241  -1.118 -10.568
  871   1HB   ARG 115          1HB       ARG 115   0.354  -3.446 -10.936
  872   2HB   ARG 115          2HB       ARG 115  -0.129  -1.850 -10.379
  873   1HG   ARG 115          1HG       ARG 115   0.940  -1.015 -12.573
  874   2HG   ARG 115          2HG       ARG 115   0.812  -2.699 -13.083
  875   1HD   ARG 115          1HD       ARG 115  -1.413  -0.855 -12.241
  876   2HD   ARG 115          2HD       ARG 115  -1.143  -1.551 -13.836
  877    HE   ARG 115           HE       ARG 115  -2.093  -3.000 -11.454
  878   1HH1  ARG 115          1HH1      ARG 115  -1.622  -2.791 -14.912
  879   2HH1  ARG 115          2HH1      ARG 115  -2.579  -4.201 -15.266
  880   1HH2  ARG 115          1HH2      ARG 115  -3.378  -4.840 -11.895
  881   2HH2  ARG 115          2HH2      ARG 115  -3.610  -5.350 -13.546
  882    H    VAL 116           H        VAL 116   3.118  -0.844  -8.642
  883    HA   VAL 116           HA       VAL 116   2.459  -2.717  -6.504
  884    HB   VAL 116           HB       VAL 116   4.792  -2.198  -6.570
  885   1HG1  VAL 116          1HG1      VAL 116   5.661   0.087  -6.399
  886   2HG1  VAL 116          2HG1      VAL 116   4.709  -0.144  -7.865
  887   3HG1  VAL 116          3HG1      VAL 116   4.016   0.715  -6.490
  888   1HG2  VAL 116          1HG2      VAL 116   3.484  -0.626  -4.353
  889   2HG2  VAL 116          2HG2      VAL 116   3.824  -2.356  -4.345
  890   3HG2  VAL 116          3HG2      VAL 116   5.153  -1.196  -4.364
  891    H    ALA 117           H        ALA 117   0.956  -2.273  -5.056
  892    HA   ALA 117           HA       ALA 117  -0.291   0.366  -5.046
  893   1HB   ALA 117          1HB       ALA 117  -1.092  -2.168  -3.608
  894   2HB   ALA 117          2HB       ALA 117  -2.025  -0.672  -3.671
  895   3HB   ALA 117          3HB       ALA 117  -1.751  -1.604  -5.143
  896    H    LEU 118           H        LEU 118   0.925   1.755  -3.892
  897    HA   LEU 118           HA       LEU 118   2.210   0.882  -1.439
  898   1HB   LEU 118          1HB       LEU 118   3.339   2.384  -3.090
  899   2HB   LEU 118          2HB       LEU 118   2.158   3.622  -2.710
  900    HG   LEU 118           HG       LEU 118   2.968   3.607  -0.356
  901   1HD1  LEU 118          1HD1      LEU 118   5.109   2.528   0.133
  902   2HD1  LEU 118          2HD1      LEU 118   3.871   1.347  -0.298
  903   3HD1  LEU 118          3HD1      LEU 118   5.105   1.799  -1.473
  904   1HD2  LEU 118          1HD2      LEU 118   5.052   4.800  -0.823
  905   2HD2  LEU 118          2HD2      LEU 118   5.048   4.162  -2.467
  906   3HD2  LEU 118          3HD2      LEU 118   3.773   5.265  -1.947
  907    H    ALA 119           H        ALA 119   0.621   0.537   0.043
  908    HA   ALA 119           HA       ALA 119  -1.373   2.618   0.509
  909   1HB   ALA 119          1HB       ALA 119  -2.150   0.306   0.402
  910   2HB   ALA 119          2HB       ALA 119  -1.083  -0.121   1.740
  911   3HB   ALA 119          3HB       ALA 119  -2.426   0.992   2.004
  912    H    MET 120           H        MET 120  -0.559   4.247   1.645
  913    HA   MET 120           HA       MET 120   1.278   3.671   3.850
  914   1HB   MET 120          1HB       MET 120   0.631   6.209   2.362
  915   2HB   MET 120          2HB       MET 120   1.581   6.196   3.841
  916   1HG   MET 120          1HG       MET 120   2.289   4.752   1.296
  917   2HG   MET 120          2HG       MET 120   2.975   6.283   1.838
  918   1HE   MET 120          1HE       MET 120   5.464   5.599   1.850
  919   2HE   MET 120          2HE       MET 120   4.940   4.122   1.040
  920   3HE   MET 120          3HE       MET 120   6.042   4.031   2.414
  921    H    ILE 121           H        ILE 121   0.526   3.574   5.809
  922    HA   ILE 121           HA       ILE 121  -1.814   5.214   6.540
  923    HB   ILE 121           HB       ILE 121  -0.765   2.746   7.956
  924   1HG1  ILE 121          1HG1      ILE 121  -3.255   3.065   6.258
  925   2HG1  ILE 121          2HG1      ILE 121  -1.791   2.225   5.756
  926   1HG2  ILE 121          1HG2      ILE 121  -1.841   4.343   9.454
  927   2HG2  ILE 121          2HG2      ILE 121  -3.269   4.368   8.417
  928   3HG2  ILE 121          3HG2      ILE 121  -2.823   2.890   9.270
  929   1HD1  ILE 121          1HD1      ILE 121  -3.614   1.444   8.020
  930   2HD1  ILE 121          2HD1      ILE 121  -3.468   0.642   6.456
  931   3HD1  ILE 121          3HD1      ILE 121  -2.117   0.619   7.589
  932    H    VAL 122           H        VAL 122  -1.144   7.024   7.519
  933    HA   VAL 122           HA       VAL 122   1.074   6.811   9.436
  934    HB   VAL 122           HB       VAL 122   1.754   9.151   8.770
  935   1HG1  VAL 122          1HG1      VAL 122   3.059   7.205   8.110
  936   2HG1  VAL 122          2HG1      VAL 122   2.044   6.993   6.683
  937   3HG1  VAL 122          3HG1      VAL 122   3.063   8.425   6.835
  938   1HG2  VAL 122          1HG2      VAL 122   1.148   9.909   6.523
  939   2HG2  VAL 122          2HG2      VAL 122   0.040   8.546   6.365
  940   3HG2  VAL 122          3HG2      VAL 122  -0.263   9.794   7.574
  941    H    GLY 123           H        GLY 123   0.858   7.968  11.304
  942   1HA   GLY 123          1HA       GLY 123  -1.845   8.965  11.787
  943   2HA   GLY 123          2HA       GLY 123  -0.682   8.503  13.016
  944    H    GLY 124           H        GLY 124  -1.554  10.983  10.696
  945   1HA   GLY 124          1HA       GLY 124   0.332  12.933  11.407
  946   2HA   GLY 124          2HA       GLY 124  -1.271  13.267  10.764
  947    H    LEU 125           H        LEU 125  -3.007  12.590  12.569
  948    HA   LEU 125           HA       LEU 125  -2.123  13.635  15.168
  949   1HB   LEU 125          1HB       LEU 125  -4.705  14.320  13.748
  950   2HB   LEU 125          2HB       LEU 125  -4.357  14.720  15.416
  951    HG   LEU 125           HG       LEU 125  -2.318  16.004  14.421
  952   1HD1  LEU 125          1HD1      LEU 125  -2.757  16.933  12.198
  953   2HD1  LEU 125          2HD1      LEU 125  -2.520  15.185  12.140
  954   3HD1  LEU 125          3HD1      LEU 125  -4.146  15.860  12.027
  955   1HD2  LEU 125          1HD2      LEU 125  -4.181  17.041  15.582
  956   2HD2  LEU 125          2HD2      LEU 125  -3.710  18.000  14.180
  957   3HD2  LEU 125          3HD2      LEU 125  -5.150  16.984  14.109
  958    H    GLU 126           H        GLU 126  -3.026  12.568  16.953
  959    HA   GLU 126           HA       GLU 126  -4.323  10.059  16.257
  960   1HB   GLU 126          1HB       GLU 126  -2.353  10.158  17.843
  961   2HB   GLU 126          2HB       GLU 126  -3.432  10.916  19.008
  962   1HG   GLU 126          1HG       GLU 126  -4.918   8.922  18.814
  963   2HG   GLU 126          2HG       GLU 126  -3.674   8.161  17.825
  964    H    HIS 127           H        HIS 127  -4.838  11.985  19.194
  965    HA   HIS 127           HA       HIS 127  -6.746  12.424  20.364
  966   1HB   HIS 127          1HB       HIS 127  -7.569  13.156  17.555
  967   2HB   HIS 127          2HB       HIS 127  -8.654  13.373  18.921
  968    HD1  HIS 127           HD1      HIS 127  -8.580  15.638  19.903
  969    HD2  HIS 127           HD2      HIS 127  -4.977  14.616  18.078
  970    HE1  HIS 127           HE1      HIS 127  -7.110  17.670  20.105
  971    HE2  HIS 127           HE2      HIS 127  -4.954  17.055  18.955
  972    H    HIS 128           H        HIS 128  -6.572   9.898  20.430
  973    HA   HIS 128           HA       HIS 128  -8.307   8.355  18.808
  974   1HB   HIS 128          1HB       HIS 128  -6.200   7.660  20.179
  975   2HB   HIS 128          2HB       HIS 128  -7.340   7.440  21.501
  976    HD1  HIS 128           HD1      HIS 128  -7.228   6.354  17.839
  977    HD2  HIS 128           HD2      HIS 128  -8.105   4.855  21.623
  978    HE1  HIS 128           HE1      HIS 128  -7.825   3.937  17.493
  979    HE2  HIS 128           HE2      HIS 128  -8.114   3.001  19.812
  980    H    HIS 129           H        HIS 129 -10.397   8.921  18.851
  981    HA   HIS 129           HA       HIS 129 -11.811   8.729  21.431
  982   1HB   HIS 129          1HB       HIS 129 -13.228  10.609  20.829
  983   2HB   HIS 129          2HB       HIS 129 -11.546  11.118  20.763
  984    HD1  HIS 129           HD1      HIS 129 -10.513  11.310  18.269
  985    HD2  HIS 129           HD2      HIS 129 -14.650  11.016  18.541
  986    HE1  HIS 129           HE1      HIS 129 -11.394  12.075  16.044
  987    HE2  HIS 129           HE2      HIS 129 -13.903  12.060  16.294
  988    H    HIS 130           H        HIS 130 -14.071   8.109  21.227
  989    HA   HIS 130           HA       HIS 130 -14.484   6.526  18.795
  990   1HB   HIS 130          1HB       HIS 130 -16.098   5.186  20.096
  991   2HB   HIS 130          2HB       HIS 130 -14.490   5.158  20.797
  992    HD1  HIS 130           HD1      HIS 130 -14.179   6.365  23.092
  993    HD2  HIS 130           HD2      HIS 130 -18.097   6.258  21.702
  994    HE1  HIS 130           HE1      HIS 130 -15.616   6.984  25.061
  995    HE2  HIS 130           HE2      HIS 130 -17.951   7.145  24.130
  996    H    HIS 131           H        HIS 131 -15.598   7.630  17.344
  997    HA   HIS 131           HA       HIS 131 -17.877   9.252  18.141
  998   1HB   HIS 131          1HB       HIS 131 -16.357   9.897  16.221
  999   2HB   HIS 131          2HB       HIS 131 -16.996   8.517  15.334
 1000    HD1  HIS 131           HD1      HIS 131 -18.184   9.817  13.504
 1001    HD2  HIS 131           HD2      HIS 131 -19.299  10.996  17.339
 1002    HE1  HIS 131           HE1      HIS 131 -20.146  11.365  13.202
 1003    HE2  HIS 131           HE2      HIS 131 -20.913  11.916  15.537
 1004    H    HIS 132           H        HIS 132 -17.134   6.094  17.521
 1005    HA   HIS 132           HA       HIS 132 -19.732   5.234  16.581
 1006   1HB   HIS 132          1HB       HIS 132 -17.695   4.087  15.808
 1007   2HB   HIS 132          2HB       HIS 132 -17.282   3.684  17.469
 1008    HD1  HIS 132           HD1      HIS 132 -18.751   1.824  18.637
 1009    HD2  HIS 132           HD2      HIS 132 -19.513   2.404  14.583
 1010    HE1  HIS 132           HE1      HIS 132 -20.028  -0.209  17.882
 1011    HE2  HIS 132           HE2      HIS 132 -20.319   0.083  15.397
  Start of MODEL    9
    1   1H    MET   1          1HT       MET   1  -2.644  29.658 -24.178
    2   2H    MET   1          2HT       MET   1  -3.772  29.382 -25.413
    3   3H    MET   1          3HT       MET   1  -2.196  29.874 -25.798
    4    HA   MET   1           HA       MET   1  -2.934  27.309 -24.516
    5   1HB   MET   1          1HB       MET   1  -3.617  27.374 -26.861
    6   2HB   MET   1          2HB       MET   1  -2.020  27.939 -27.332
    7   1HG   MET   1          1HG       MET   1  -1.071  25.812 -26.491
    8   2HG   MET   1          2HG       MET   1  -2.710  25.252 -26.167
    9   1HE   MET   1          1HE       MET   1  -0.615  23.647 -27.963
   10   2HE   MET   1          2HE       MET   1  -1.658  23.133 -29.289
   11   3HE   MET   1          3HE       MET   1  -2.255  23.088 -27.630
   12    HA   PRO   2           HA       PRO   2   1.428  27.487 -23.408
   13   1HB   PRO   2          1HB       PRO   2   0.959  24.922 -22.123
   14   2HB   PRO   2          2HB       PRO   2   1.344  26.475 -21.378
   15   1HG   PRO   2          1HG       PRO   2  -1.075  25.259 -21.119
   16   2HG   PRO   2          2HG       PRO   2  -0.860  27.017 -21.064
   17   1HD   PRO   2          1HD       PRO   2  -1.801  25.290 -23.326
   18   2HD   PRO   2          2HD       PRO   2  -2.402  26.876 -22.792
   19    H    LEU   3           H        LEU   3   3.272  26.232 -23.980
   20    HA   LEU   3           HA       LEU   3   2.863  24.653 -26.362
   21   1HB   LEU   3          1HB       LEU   3   5.382  25.379 -24.863
   22   2HB   LEU   3          2HB       LEU   3   5.350  24.521 -26.392
   23    HG   LEU   3           HG       LEU   3   4.395  27.348 -25.925
   24   1HD1  LEU   3          1HD1      LEU   3   6.777  26.271 -27.426
   25   2HD1  LEU   3          2HD1      LEU   3   6.287  27.963 -27.340
   26   3HD1  LEU   3          3HD1      LEU   3   6.821  27.124 -25.883
   27   1HD2  LEU   3          1HD2      LEU   3   4.101  27.434 -28.353
   28   2HD2  LEU   3          2HD2      LEU   3   4.504  25.721 -28.463
   29   3HD2  LEU   3          3HD2      LEU   3   3.043  26.231 -27.616
   30    H    ASN   4           H        ASN   4   3.431  24.081 -23.015
   31    HA   ASN   4           HA       ASN   4   3.339  22.213 -21.738
   32   1HB   ASN   4          1HB       ASN   4   2.654  20.842 -24.342
   33   2HB   ASN   4          2HB       ASN   4   2.680  20.025 -22.782
   34   1HD2  ASN   4          2HD2      ASN   4   0.473  20.446 -24.629
   35   2HD2  ASN   4          1HD2      ASN   4  -0.748  21.285 -23.736
   36    H    GLN   5           H        GLN   5   5.220  21.959 -24.683
   37    HA   GLN   5           HA       GLN   5   6.939  19.875 -23.821
   38   1HB   GLN   5          1HB       GLN   5   8.354  20.587 -25.732
   39   2HB   GLN   5          2HB       GLN   5   6.668  20.339 -26.170
   40   1HG   GLN   5          1HG       GLN   5   6.281  22.737 -26.116
   41   2HG   GLN   5          2HG       GLN   5   7.952  23.006 -25.624
   42   1HE2  GLN   5          2HE2      GLN   5   5.839  22.077 -28.220
   43   2HE2  GLN   5          1HE2      GLN   5   6.994  22.262 -29.499
   44    H    GLU   6           H        GLU   6   6.660  22.860 -22.529
   45    HA   GLU   6           HA       GLU   6   9.337  23.717 -22.271
   46   1HB   GLU   6          1HB       GLU   6   7.480  25.216 -21.785
   47   2HB   GLU   6          2HB       GLU   6   6.970  24.185 -20.452
   48   1HG   GLU   6          1HG       GLU   6   9.304  24.610 -19.488
   49   2HG   GLU   6          2HG       GLU   6   9.392  25.931 -20.652
   50    H    HIS   7           H        HIS   7   7.237  21.934 -20.006
   51    HA   HIS   7           HA       HIS   7   9.671  20.778 -18.871
   52   1HB   HIS   7          1HB       HIS   7   8.653  20.878 -16.595
   53   2HB   HIS   7          2HB       HIS   7   9.046  22.447 -17.273
   54    HD1  HIS   7           HD1      HIS   7   7.068  24.063 -17.770
   55    HD2  HIS   7           HD2      HIS   7   5.938  20.416 -16.106
   56    HE1  HIS   7           HE1      HIS   7   4.686  24.357 -17.036
   57    HE2  HIS   7           HE2      HIS   7   4.126  22.238 -15.792
   58    HA   PRO   8           HA       PRO   8   6.962  17.252 -19.890
   59   1HB   PRO   8          1HB       PRO   8   9.433  15.998 -20.766
   60   2HB   PRO   8          2HB       PRO   8   7.991  16.371 -21.709
   61   1HG   PRO   8          1HG       PRO   8  10.364  17.646 -22.065
   62   2HG   PRO   8          2HG       PRO   8   8.796  18.414 -22.378
   63   1HD   PRO   8          1HD       PRO   8  10.591  18.669 -19.990
   64   2HD   PRO   8          2HD       PRO   8   9.681  19.929 -20.855
   65    H    ASP   9           H        ASP   9   7.234  14.971 -19.176
   66    HA   ASP   9           HA       ASP   9   7.564  13.421 -17.558
   67   1HB   ASP   9          1HB       ASP   9  10.173  14.895 -17.169
   68   2HB   ASP   9          2HB       ASP   9   9.745  13.432 -16.290
   69    H    TYR  10           H        TYR  10   5.828  14.032 -16.332
   70    HA   TYR  10           HA       TYR  10   6.135  16.071 -14.297
   71   1HB   TYR  10          1HB       TYR  10   3.833  14.210 -14.927
   72   2HB   TYR  10          2HB       TYR  10   3.787  15.496 -13.722
   73    HD1  TYR  10           HD1      TYR  10   3.614  14.691 -17.259
   74    HD2  TYR  10           HD2      TYR  10   3.894  17.863 -14.438
   75    HE1  TYR  10           HE1      TYR  10   2.950  16.292 -19.002
   76    HE2  TYR  10           HE2      TYR  10   3.226  19.473 -16.173
   77    HH   TYR  10           HH       TYR  10   3.190  19.689 -18.567
   78    H    THR  11           H        THR  11   6.263  15.712 -12.104
   79    HA   THR  11           HA       THR  11   6.790  12.932 -11.313
   80    HB   THR  11           HB       THR  11   8.948  13.968 -11.728
   81    HG1  THR  11           HG1      THR  11   9.810  13.282  -9.877
   82   1HG2  THR  11          1HG2      THR  11   8.088  16.077  -9.745
   83   2HG2  THR  11          2HG2      THR  11   9.699  15.924 -10.447
   84   3HG2  THR  11          3HG2      THR  11   8.320  16.312 -11.478
   85    H    TYR  12           H        TYR  12   6.206  12.361  -9.286
   86    HA   TYR  12           HA       TYR  12   5.320  14.474  -7.459
   87   1HB   TYR  12          1HB       TYR  12   3.655  12.711  -6.559
   88   2HB   TYR  12          2HB       TYR  12   3.248  13.564  -8.038
   89    HD1  TYR  12           HD1      TYR  12   3.353  12.394 -10.212
   90    HD2  TYR  12           HD2      TYR  12   4.019  10.330  -6.549
   91    HE1  TYR  12           HE1      TYR  12   2.974  10.251 -11.356
   92    HE2  TYR  12           HE2      TYR  12   3.648   8.184  -7.688
   93    HH   TYR  12           HH       TYR  12   3.542   7.883 -11.067
   94    H    ALA  13           H        ALA  13   7.203  14.510  -6.344
   95    HA   ALA  13           HA       ALA  13   8.381  11.978  -5.493
   96   1HB   ALA  13          1HB       ALA  13   9.495  14.775  -5.339
   97   2HB   ALA  13          2HB       ALA  13  10.361  13.288  -4.958
   98   3HB   ALA  13          3HB       ALA  13   9.831  13.598  -6.610
   99    H    LEU  14           H        LEU  14   8.441  11.296  -3.459
  100    HA   LEU  14           HA       LEU  14   7.049  12.726  -1.395
  101   1HB   LEU  14          1HB       LEU  14   8.635  10.157  -1.383
  102   2HB   LEU  14          2HB       LEU  14   7.920  10.832   0.065
  103    HG   LEU  14           HG       LEU  14   6.472   9.118  -0.696
  104   1HD1  LEU  14          1HD1      LEU  14   5.343  11.103   0.112
  105   2HD1  LEU  14          2HD1      LEU  14   5.322  11.776  -1.519
  106   3HD1  LEU  14          3HD1      LEU  14   4.399  10.318  -1.152
  107   1HD2  LEU  14          1HD2      LEU  14   7.254   8.897  -2.978
  108   2HD2  LEU  14          2HD2      LEU  14   5.500   9.074  -2.949
  109   3HD2  LEU  14          3HD2      LEU  14   6.516  10.440  -3.405
  110    H    ARG  15           H        ARG  15   8.077  14.578  -0.852
  111    HA   ARG  15           HA       ARG  15  10.944  14.701  -0.630
  112   1HB   ARG  15          1HB       ARG  15   8.902  16.568  -1.014
  113   2HB   ARG  15          2HB       ARG  15   9.552  16.941   0.578
  114   1HG   ARG  15          1HG       ARG  15  10.745  18.247  -1.002
  115   2HG   ARG  15          2HG       ARG  15  11.830  16.969  -0.453
  116   1HD   ARG  15          1HD       ARG  15  11.105  15.660  -2.493
  117   2HD   ARG  15          2HD       ARG  15  10.332  17.140  -3.058
  118    HE   ARG  15           HE       ARG  15  13.230  16.764  -2.649
  119   1HH1  ARG  15          1HH1      ARG  15  10.546  18.512  -4.087
  120   2HH1  ARG  15          2HH1      ARG  15  11.563  19.478  -5.116
  121   1HH2  ARG  15          1HH2      ARG  15  14.554  17.977  -4.043
  122   2HH2  ARG  15          2HH2      ARG  15  13.849  19.169  -5.100
  123    H    ALA  16           H        ALA  16   8.412  13.796   1.384
  124    HA   ALA  16           HA       ALA  16  10.243  13.515   3.614
  125   1HB   ALA  16          1HB       ALA  16   7.608  14.949   3.936
  126   2HB   ALA  16          2HB       ALA  16   8.720  14.514   5.233
  127   3HB   ALA  16          3HB       ALA  16   9.203  15.698   4.018
  128    H    ALA  17           H        ALA  17  10.112  11.426   4.046
  129    HA   ALA  17           HA       ALA  17   7.463  10.141   4.013
  130   1HB   ALA  17          1HB       ALA  17   8.946   9.217   2.302
  131   2HB   ALA  17          2HB       ALA  17  10.159   8.866   3.532
  132   3HB   ALA  17          3HB       ALA  17   8.610   8.023   3.554
  133    H    ASP  18           H        ASP  18   6.759  10.004   6.035
  134    HA   ASP  18           HA       ASP  18   8.528   8.933   8.094
  135   1HB   ASP  18          1HB       ASP  18   8.711  11.405   8.229
  136   2HB   ASP  18          2HB       ASP  18   6.966  11.509   8.434
  137    H    GLY  19           H        GLY  19   7.179   8.558  10.169
  138   1HA   GLY  19          1HA       GLY  19   4.936   6.956   9.417
  139   2HA   GLY  19          2HA       GLY  19   5.534   7.212  11.047
  140    H    ARG  20           H        ARG  20   5.296  10.163  10.821
  141    HA   ARG  20           HA       ARG  20   2.344  10.297  10.943
  142   1HB   ARG  20          1HB       ARG  20   3.811  12.265  12.573
  143   2HB   ARG  20          2HB       ARG  20   2.350  11.365  12.940
  144   1HG   ARG  20          1HG       ARG  20   3.744  10.461  14.483
  145   2HG   ARG  20          2HG       ARG  20   4.071   9.364  13.139
  146   1HD   ARG  20          1HD       ARG  20   6.155  10.087  14.150
  147   2HD   ARG  20          2HD       ARG  20   6.015  10.736  12.516
  148    HE   ARG  20           HE       ARG  20   5.218  12.413  14.788
  149   1HH1  ARG  20          1HH1      ARG  20   7.412  11.792  12.118
  150   2HH1  ARG  20          2HH1      ARG  20   8.184  13.350  12.238
  151   1HH2  ARG  20          1HH2      ARG  20   6.192  14.428  14.928
  152   2HH2  ARG  20          2HH2      ARG  20   7.479  14.866  13.844
  153    H    HIS  21           H        HIS  21   4.734  11.137   9.039
  154    HA   HIS  21           HA       HIS  21   3.431  13.604   8.218
  155   1HB   HIS  21          1HB       HIS  21   5.173  14.361   9.739
  156   2HB   HIS  21          2HB       HIS  21   6.387  13.461   8.845
  157    HD1  HIS  21           HD1      HIS  21   7.779  15.022   7.564
  158    HD2  HIS  21           HD2      HIS  21   3.812  16.266   7.700
  159    HE1  HIS  21           HE1      HIS  21   7.682  17.136   6.207
  160    HE2  HIS  21           HE2      HIS  21   5.353  18.017   6.575
  161    H    ALA  22           H        ALA  22   3.521  13.987   6.100
  162    HA   ALA  22           HA       ALA  22   5.325  12.482   4.381
  163   1HB   ALA  22          1HB       ALA  22   3.369  11.021   4.573
  164   2HB   ALA  22          2HB       ALA  22   2.326  12.348   4.059
  165   3HB   ALA  22          3HB       ALA  22   3.515  11.678   2.942
  166    H    LYS  23           H        LYS  23   5.404  13.373   2.211
  167    HA   LYS  23           HA       LYS  23   3.969  15.848   1.741
  168   1HB   LYS  23          1HB       LYS  23   5.931  16.561   3.045
  169   2HB   LYS  23          2HB       LYS  23   6.989  15.785   1.877
  170   1HG   LYS  23          1HG       LYS  23   6.310  17.340   0.163
  171   2HG   LYS  23          2HG       LYS  23   5.127  18.068   1.254
  172   1HD   LYS  23          1HD       LYS  23   6.938  18.761   2.749
  173   2HD   LYS  23          2HD       LYS  23   8.118  18.032   1.660
  174   1HE   LYS  23          1HE       LYS  23   7.532  19.590  -0.087
  175   2HE   LYS  23          2HE       LYS  23   6.234  20.260   0.902
  176   1HZ   LYS  23          1HZ       LYS  23   7.867  21.041   2.482
  177   2HZ   LYS  23          2HZ       LYS  23   9.127  20.356   1.575
  178   3HZ   LYS  23          3HZ       LYS  23   8.227  21.649   0.941
  179    H    VAL  24           H        VAL  24   3.089  15.182  -0.132
  180    HA   VAL  24           HA       VAL  24   4.781  13.975  -2.183
  181    HB   VAL  24           HB       VAL  24   1.846  14.671  -2.399
  182   1HG1  VAL  24          1HG1      VAL  24   1.849  12.958  -4.164
  183   2HG1  VAL  24          2HG1      VAL  24   2.939  14.296  -4.530
  184   3HG1  VAL  24          3HG1      VAL  24   3.590  12.762  -3.951
  185   1HG2  VAL  24          1HG2      VAL  24   2.160  13.172  -0.503
  186   2HG2  VAL  24          2HG2      VAL  24   1.369  12.335  -1.839
  187   3HG2  VAL  24          3HG2      VAL  24   3.082  12.062  -1.519
  188    H    ASN  25           H        ASN  25   6.118  15.654  -2.748
  189    HA   ASN  25           HA       ASN  25   6.859  17.569  -3.690
  190   1HB   ASN  25          1HB       ASN  25   4.129  17.471  -4.948
  191   2HB   ASN  25          2HB       ASN  25   5.234  18.807  -5.252
  192   1HD2  ASN  25          2HD2      ASN  25   4.192  16.904  -7.127
  193   2HD2  ASN  25          1HD2      ASN  25   5.561  16.086  -7.813
  194    H    GLU  26           H        GLU  26   3.472  18.322  -2.934
  195    HA   GLU  26           HA       GLU  26   4.425  20.575  -1.290
  196   1HB   GLU  26          1HB       GLU  26   3.534  21.518  -3.303
  197   2HB   GLU  26          2HB       GLU  26   2.127  20.464  -3.247
  198   1HG   GLU  26          1HG       GLU  26   1.584  21.641  -1.034
  199   2HG   GLU  26          2HG       GLU  26   2.753  22.853  -1.554
  200    H    GLN  27           H        GLN  27   1.658  18.441  -1.947
  201    HA   GLN  27           HA       GLN  27   0.290  19.370   0.400
  202   1HB   GLN  27          1HB       GLN  27  -0.832  18.842  -1.775
  203   2HB   GLN  27          2HB       GLN  27  -0.506  17.140  -1.474
  204   1HG   GLN  27          1HG       GLN  27  -1.973  17.065   0.348
  205   2HG   GLN  27          2HG       GLN  27  -2.035  18.823   0.479
  206   1HE2  GLN  27          2HE2      GLN  27  -3.210  16.033  -1.223
  207   2HE2  GLN  27          1HE2      GLN  27  -4.481  16.837  -2.073
  208    H    ILE  28           H        ILE  28   0.202  18.497   2.317
  209    HA   ILE  28           HA       ILE  28   1.632  16.039   2.884
  210    HB   ILE  28           HB       ILE  28   0.232  17.977   4.736
  211   1HG1  ILE  28          1HG1      ILE  28   3.181  17.597   4.173
  212   2HG1  ILE  28          2HG1      ILE  28   2.200  18.922   3.556
  213   1HG2  ILE  28          1HG2      ILE  28   0.331  15.752   5.709
  214   2HG2  ILE  28          2HG2      ILE  28   2.059  15.663   5.373
  215   3HG2  ILE  28          3HG2      ILE  28   1.446  16.835   6.540
  216   1HD1  ILE  28          1HD1      ILE  28   3.525  19.616   5.466
  217   2HD1  ILE  28          2HD1      ILE  28   1.803  19.687   5.837
  218   3HD1  ILE  28          3HD1      ILE  28   2.783  18.357   6.453
  219    H    LEU  29           H        LEU  29   0.484  14.254   2.397
  220    HA   LEU  29           HA       LEU  29  -2.369  14.161   2.893
  221   1HB   LEU  29          1HB       LEU  29  -0.480  12.086   1.777
  222   2HB   LEU  29          2HB       LEU  29  -2.218  11.885   1.913
  223    HG   LEU  29           HG       LEU  29  -0.819  13.952   0.211
  224   1HD1  LEU  29          1HD1      LEU  29  -2.302  11.443  -0.555
  225   2HD1  LEU  29          2HD1      LEU  29  -1.663  12.646  -1.674
  226   3HD1  LEU  29          3HD1      LEU  29  -0.561  11.700  -0.673
  227   1HD2  LEU  29          1HD2      LEU  29  -3.055  14.400  -0.685
  228   2HD2  LEU  29          2HD2      LEU  29  -3.745  13.286   0.495
  229   3HD2  LEU  29          3HD2      LEU  29  -2.953  14.765   1.038
  230    H    GLN  30           H        GLN  30  -2.694  14.154   5.038
  231    HA   GLN  30           HA       GLN  30  -1.132  12.472   6.799
  232   1HB   GLN  30          1HB       GLN  30  -2.576  13.514   8.576
  233   2HB   GLN  30          2HB       GLN  30  -1.633  14.653   7.624
  234   1HG   GLN  30          1HG       GLN  30  -3.566  15.270   6.343
  235   2HG   GLN  30          2HG       GLN  30  -4.532  14.017   7.121
  236   1HE2  GLN  30          2HE2      GLN  30  -4.937  16.911   6.995
  237   2HE2  GLN  30          1HE2      GLN  30  -5.037  17.442   8.636
  238    H    GLN  31           H        GLN  31  -2.500  10.889   5.021
  239    HA   GLN  31           HA       GLN  31  -4.172   9.369   6.851
  240   1HB   GLN  31          1HB       GLN  31  -6.000   9.074   5.288
  241   2HB   GLN  31          2HB       GLN  31  -5.774  10.791   5.583
  242   1HG   GLN  31          1HG       GLN  31  -4.657  11.055   3.461
  243   2HG   GLN  31          2HG       GLN  31  -4.718   9.317   3.177
  244   1HE2  GLN  31          2HE2      GLN  31  -7.350  11.099   4.604
  245   2HE2  GLN  31          1HE2      GLN  31  -8.435  10.946   3.272
  246    H    SER  32           H        SER  32  -4.812   7.209   5.621
  247    HA   SER  32           HA       SER  32  -2.427   6.223   4.304
  248   1HB   SER  32          1HB       SER  32  -3.649   4.831   5.992
  249   2HB   SER  32          2HB       SER  32  -5.014   4.754   4.877
  250    HG   SER  32           HG       SER  32  -2.401   3.932   4.166
  251    H    PHE  33           H        PHE  33  -2.236   6.852   2.256
  252    HA   PHE  33           HA       PHE  33  -4.632   6.722   0.555
  253   1HB   PHE  33          1HB       PHE  33  -3.523   8.330  -0.933
  254   2HB   PHE  33          2HB       PHE  33  -3.690   8.978   0.693
  255    HD1  PHE  33           HD1      PHE  33  -1.394   7.969  -1.917
  256    HD2  PHE  33           HD2      PHE  33  -1.711   9.176   2.150
  257    HE1  PHE  33           HE1      PHE  33   1.011   8.484  -1.887
  258    HE2  PHE  33           HE2      PHE  33   0.694   9.691   2.190
  259    HZ   PHE  33           HZ       PHE  33   2.058   9.347   0.168
  260    H    ILE  34           H        ILE  34  -4.322   5.993  -1.644
  261    HA   ILE  34           HA       ILE  34  -2.379   3.803  -1.725
  262    HB   ILE  34           HB       ILE  34  -4.760   4.290  -3.522
  263   1HG1  ILE  34          1HG1      ILE  34  -4.480   2.344  -1.225
  264   2HG1  ILE  34          2HG1      ILE  34  -5.367   3.862  -1.141
  265   1HG2  ILE  34          1HG2      ILE  34  -2.979   1.880  -3.186
  266   2HG2  ILE  34          2HG2      ILE  34  -4.426   1.950  -4.192
  267   3HG2  ILE  34          3HG2      ILE  34  -3.031   2.954  -4.583
  268   1HD1  ILE  34          1HD1      ILE  34  -6.869   1.995  -1.470
  269   2HD1  ILE  34          2HD1      ILE  34  -6.888   3.059  -2.878
  270   3HD1  ILE  34          3HD1      ILE  34  -6.004   1.533  -2.936
  271    H    LEU  35           H        LEU  35  -0.542   4.236  -2.729
  272    HA   LEU  35           HA       LEU  35  -0.565   6.202  -4.911
  273   1HB   LEU  35          1HB       LEU  35   0.926   6.718  -3.035
  274   2HB   LEU  35          2HB       LEU  35   1.735   5.176  -3.244
  275    HG   LEU  35           HG       LEU  35   2.544   5.895  -5.452
  276   1HD1  LEU  35          1HD1      LEU  35   0.732   7.414  -6.034
  277   2HD1  LEU  35          2HD1      LEU  35   1.246   8.525  -4.763
  278   3HD1  LEU  35          3HD1      LEU  35   2.297   8.219  -6.147
  279   1HD2  LEU  35          1HD2      LEU  35   3.942   6.269  -3.500
  280   2HD2  LEU  35          2HD2      LEU  35   4.140   7.580  -4.661
  281   3HD2  LEU  35          3HD2      LEU  35   3.159   7.822  -3.215
  282    H    MET  36           H        MET  36  -0.609   5.392  -6.855
  283    HA   MET  36           HA       MET  36   0.685   2.797  -7.365
  284   1HB   MET  36          1HB       MET  36  -1.504   4.140  -8.972
  285   2HB   MET  36          2HB       MET  36  -0.864   2.522  -9.221
  286   1HG   MET  36          1HG       MET  36  -1.763   1.806  -7.092
  287   2HG   MET  36          2HG       MET  36  -2.339   3.437  -6.764
  288   1HE   MET  36          1HE       MET  36  -2.422   1.304 -10.097
  289   2HE   MET  36          2HE       MET  36  -4.048   0.626  -9.996
  290   3HE   MET  36          3HE       MET  36  -2.824   0.160  -8.816
  291    HA   PRO  37           HA       PRO  37   3.529   5.014  -9.946
  292   1HB   PRO  37          1HB       PRO  37   4.342   3.030 -11.594
  293   2HB   PRO  37          2HB       PRO  37   4.813   3.103  -9.893
  294   1HG   PRO  37          1HG       PRO  37   2.669   1.472 -11.195
  295   2HG   PRO  37          2HG       PRO  37   3.841   0.992  -9.956
  296   1HD   PRO  37          1HD       PRO  37   1.266   1.641  -9.384
  297   2HD   PRO  37          2HD       PRO  37   2.604   1.914  -8.252
  298    H    ASP  38           H        ASP  38   0.981   5.639 -10.677
  299    HA   ASP  38           HA       ASP  38   1.127   6.184 -13.439
  300   1HB   ASP  38          1HB       ASP  38   0.591   3.788 -13.655
  301   2HB   ASP  38          2HB       ASP  38  -0.845   4.020 -12.665
  302    H    GLU  39           H        GLU  39  -1.028   5.649 -10.682
  303    HA   GLU  39           HA       GLU  39  -2.193   8.299 -11.121
  304   1HB   GLU  39          1HB       GLU  39  -3.718   5.716 -10.839
  305   2HB   GLU  39          2HB       GLU  39  -4.441   7.261 -10.421
  306   1HG   GLU  39          1HG       GLU  39  -3.290   6.640 -13.127
  307   2HG   GLU  39          2HG       GLU  39  -4.984   6.404 -12.703
  308    H    LEU  40           H        LEU  40  -2.883   9.339  -9.244
  309    HA   LEU  40           HA       LEU  40  -1.994   8.108  -6.730
  310   1HB   LEU  40          1HB       LEU  40  -1.052  10.291  -7.191
  311   2HB   LEU  40          2HB       LEU  40  -2.648  10.968  -7.452
  312    HG   LEU  40           HG       LEU  40  -3.178  10.596  -5.064
  313   1HD1  LEU  40          1HD1      LEU  40  -0.292   9.749  -4.865
  314   2HD1  LEU  40          2HD1      LEU  40  -1.382  10.030  -3.507
  315   3HD1  LEU  40          3HD1      LEU  40  -1.699   8.711  -4.634
  316   1HD2  LEU  40          1HD2      LEU  40  -0.667  12.183  -5.574
  317   2HD2  LEU  40          2HD2      LEU  40  -2.322  12.750  -5.799
  318   3HD2  LEU  40          3HD2      LEU  40  -1.734  12.363  -4.182
  319    H    VAL  41           H        VAL  41  -3.556   7.025  -5.689
  320    HA   VAL  41           HA       VAL  41  -6.329   7.918  -6.016
  321    HB   VAL  41           HB       VAL  41  -5.298   5.310  -4.896
  322   1HG1  VAL  41          1HG1      VAL  41  -7.622   4.548  -5.133
  323   2HG1  VAL  41          2HG1      VAL  41  -7.475   5.885  -3.992
  324   3HG1  VAL  41          3HG1      VAL  41  -8.094   6.177  -5.618
  325   1HG2  VAL  41          1HG2      VAL  41  -4.786   5.531  -7.266
  326   2HG2  VAL  41          2HG2      VAL  41  -6.047   4.324  -7.007
  327   3HG2  VAL  41          3HG2      VAL  41  -6.471   5.930  -7.602
  328    H    GLU  42           H        GLU  42  -6.697   9.471  -4.566
  329    HA   GLU  42           HA       GLU  42  -5.844   9.172  -1.793
  330   1HB   GLU  42          1HB       GLU  42  -7.378  11.401  -3.148
  331   2HB   GLU  42          2HB       GLU  42  -6.746  11.440  -1.511
  332   1HG   GLU  42          1HG       GLU  42  -4.488  11.418  -2.327
  333   2HG   GLU  42          2HG       GLU  42  -5.055  11.206  -3.987
  334    H    HIS  43           H        HIS  43  -7.725  10.218  -0.301
  335    HA   HIS  43           HA       HIS  43  -9.793  10.157   0.614
  336   1HB   HIS  43          1HB       HIS  43 -10.650   9.300  -2.156
  337   2HB   HIS  43          2HB       HIS  43 -11.767   9.656  -0.844
  338    HD1  HIS  43           HD1      HIS  43 -12.286  12.091  -0.369
  339    HD2  HIS  43           HD2      HIS  43  -9.267  11.578  -3.186
  340    HE1  HIS  43           HE1      HIS  43 -11.857  14.376  -1.334
  341    HE2  HIS  43           HE2      HIS  43  -9.886  14.070  -2.876
  342    H    TRP  44           H        TRP  44  -8.160   8.070   1.151
  343    HA   TRP  44           HA       TRP  44 -10.015   5.784   1.211
  344   1HB   TRP  44          1HB       TRP  44  -7.660   5.537   0.172
  345   2HB   TRP  44          2HB       TRP  44  -7.067   5.626   1.826
  346    HD1  TRP  44           HD1      TRP  44 -10.247   3.692   0.834
  347    HE1  TRP  44           HE1      TRP  44  -9.864   1.190   1.319
  348    HE3  TRP  44           HE3      TRP  44  -5.301   3.864   2.123
  349    HZ2  TRP  44           HZ2      TRP  44  -7.746  -0.481   2.131
  350    HZ3  TRP  44           HZ3      TRP  44  -4.168   1.767   2.732
  351    HH2  TRP  44           HH2      TRP  44  -5.367  -0.361   2.736
  352    HA   PRO  45           HA       PRO  45 -10.452   7.241   5.395
  353   1HB   PRO  45          1HB       PRO  45 -12.493   5.634   6.106
  354   2HB   PRO  45          2HB       PRO  45 -12.704   7.002   5.006
  355   1HG   PRO  45          1HG       PRO  45 -12.429   4.089   4.378
  356   2HG   PRO  45          2HG       PRO  45 -13.527   5.289   3.672
  357   1HD   PRO  45          1HD       PRO  45 -11.209   4.472   2.480
  358   2HD   PRO  45          2HD       PRO  45 -11.938   6.068   2.219
  359    H    VAL  46           H        VAL  46  -8.213   5.804   5.328
  360    HA   VAL  46           HA       VAL  46  -8.573   3.904   7.554
  361    HB   VAL  46           HB       VAL  46  -6.480   3.774   5.370
  362   1HG1  VAL  46          1HG1      VAL  46  -6.891   1.977   7.759
  363   2HG1  VAL  46          2HG1      VAL  46  -5.731   1.714   6.458
  364   3HG1  VAL  46          3HG1      VAL  46  -5.554   3.104   7.529
  365   1HG2  VAL  46          1HG2      VAL  46  -8.774   1.931   6.038
  366   2HG2  VAL  46          2HG2      VAL  46  -8.667   2.995   4.637
  367   3HG2  VAL  46          3HG2      VAL  46  -7.550   1.640   4.802
  368    HA   PRO  47           HA       PRO  47  -5.826   7.002   9.396
  369   1HB   PRO  47          1HB       PRO  47  -6.932   6.269  11.938
  370   2HB   PRO  47          2HB       PRO  47  -7.204   7.753  11.024
  371   1HG   PRO  47          1HG       PRO  47  -9.126   5.830  11.510
  372   2HG   PRO  47          2HG       PRO  47  -9.187   7.010  10.191
  373   1HD   PRO  47          1HD       PRO  47  -8.359   4.137  10.130
  374   2HD   PRO  47          2HD       PRO  47  -9.275   5.075   8.930
  375    H    SER  48           H        SER  48  -6.658   3.958  11.058
  376    HA   SER  48           HA       SER  48  -3.785   3.474  11.463
  377   1HB   SER  48          1HB       SER  48  -6.129   2.817  13.254
  378   2HB   SER  48          2HB       SER  48  -4.534   2.094  13.461
  379    HG   SER  48           HG       SER  48  -5.115   4.883  13.502
  380    H    LEU  49           H        LEU  49  -3.307   1.071  11.730
  381    HA   LEU  49           HA       LEU  49  -4.199  -0.225   9.364
  382   1HB   LEU  49          1HB       LEU  49  -1.934  -0.503  10.309
  383   2HB   LEU  49          2HB       LEU  49  -2.623  -1.367  11.671
  384    HG   LEU  49           HG       LEU  49  -3.412  -3.136  10.151
  385   1HD1  LEU  49          1HD1      LEU  49  -3.716  -1.771   8.150
  386   2HD1  LEU  49          2HD1      LEU  49  -1.969  -1.562   8.021
  387   3HD1  LEU  49          3HD1      LEU  49  -2.682  -3.163   7.825
  388   1HD2  LEU  49          1HD2      LEU  49  -1.235  -3.362  11.209
  389   2HD2  LEU  49          2HD2      LEU  49  -1.223  -4.069   9.592
  390   3HD2  LEU  49          3HD2      LEU  49  -0.481  -2.493   9.871
  391    H    GLY  50           H        GLY  50  -5.299  -0.208  12.618
  392   1HA   GLY  50          1HA       GLY  50  -6.685  -2.690  12.612
  393   2HA   GLY  50          2HA       GLY  50  -6.998  -1.333  13.685
  394    H    GLN  51           H        GLN  51  -7.203   0.031  10.770
  395    HA   GLN  51           HA       GLN  51 -10.096  -0.286  10.615
  396   1HB   GLN  51          1HB       GLN  51  -9.116   1.980  10.582
  397   2HB   GLN  51          2HB       GLN  51  -8.222   1.571   9.128
  398   1HG   GLN  51          1HG       GLN  51 -10.101   2.886   8.502
  399   2HG   GLN  51          2HG       GLN  51 -10.384   1.236   7.957
  400   1HE2  GLN  51          2HE2      GLN  51 -12.260   3.413   8.480
  401   2HE2  GLN  51          1HE2      GLN  51 -13.385   2.805   9.648
  402    H    LEU  52           H        LEU  52  -7.372  -1.695   9.303
  403    HA   LEU  52           HA       LEU  52  -8.154  -1.998   6.590
  404   1HB   LEU  52          1HB       LEU  52  -5.827  -2.262   7.371
  405   2HB   LEU  52          2HB       LEU  52  -6.293  -3.714   8.235
  406    HG   LEU  52           HG       LEU  52  -6.878  -4.786   6.086
  407   1HD1  LEU  52          1HD1      LEU  52  -5.734  -2.276   4.870
  408   2HD1  LEU  52          2HD1      LEU  52  -6.186  -3.738   3.991
  409   3HD1  LEU  52          3HD1      LEU  52  -7.422  -2.783   4.811
  410   1HD2  LEU  52          1HD2      LEU  52  -4.583  -5.082   5.293
  411   2HD2  LEU  52          2HD2      LEU  52  -4.078  -3.675   6.229
  412   3HD2  LEU  52          3HD2      LEU  52  -4.669  -5.118   7.054
  413    H    GLN  53           H        GLN  53  -9.953  -2.932   6.051
  414    HA   GLN  53           HA       GLN  53 -10.562  -5.629   6.979
  415   1HB   GLN  53          1HB       GLN  53 -11.765  -3.965   8.452
  416   2HB   GLN  53          2HB       GLN  53 -12.602  -3.386   7.021
  417   1HG   GLN  53          1HG       GLN  53 -13.593  -5.604   6.715
  418   2HG   GLN  53          2HG       GLN  53 -12.774  -6.159   8.175
  419   1HE2  GLN  53          2HE2      GLN  53 -13.479  -5.431  10.180
  420   2HE2  GLN  53          1HE2      GLN  53 -15.016  -4.663  10.395
  421    HA   PRO  54           HA       PRO  54 -11.248  -6.473   2.691
  422   1HB   PRO  54          1HB       PRO  54 -13.856  -7.590   3.658
  423   2HB   PRO  54          2HB       PRO  54 -12.691  -8.282   2.522
  424   1HG   PRO  54          1HG       PRO  54 -12.762  -9.120   5.038
  425   2HG   PRO  54          2HG       PRO  54 -11.213  -8.895   4.206
  426   1HD   PRO  54          1HD       PRO  54 -12.478  -7.245   6.327
  427   2HD   PRO  54          2HD       PRO  54 -10.760  -7.501   5.967
  428    H    ALA  55           H        ALA  55 -14.147  -5.276   4.401
  429    HA   ALA  55           HA       ALA  55 -15.555  -4.331   2.192
  430   1HB   ALA  55          1HB       ALA  55 -15.552  -3.165   4.971
  431   2HB   ALA  55          2HB       ALA  55 -16.806  -2.959   3.749
  432   3HB   ALA  55          3HB       ALA  55 -16.505  -4.552   4.443
  433    H    HIS  56           H        HIS  56 -12.862  -2.876   3.894
  434    HA   HIS  56           HA       HIS  56 -13.187  -0.416   2.329
  435   1HB   HIS  56          1HB       HIS  56 -11.770  -1.051   4.879
  436   2HB   HIS  56          2HB       HIS  56 -11.164   0.271   3.884
  437    HD1  HIS  56           HD1      HIS  56 -13.275  -0.206   6.657
  438    HD2  HIS  56           HD2      HIS  56 -13.583   2.031   3.155
  439    HE1  HIS  56           HE1      HIS  56 -14.984   1.579   7.130
  440    HE2  HIS  56           HE2      HIS  56 -15.144   2.935   5.010
  441    H    MET  57           H        MET  57 -11.522  -3.315   2.262
  442    HA   MET  57           HA       MET  57  -9.259  -2.218   0.780
  443   1HB   MET  57          1HB       MET  57  -8.978  -4.097   2.447
  444   2HB   MET  57          2HB       MET  57  -9.878  -5.124   1.339
  445   1HG   MET  57          1HG       MET  57  -8.178  -4.809  -0.367
  446   2HG   MET  57          2HG       MET  57  -7.290  -3.723   0.700
  447   1HE   MET  57          1HE       MET  57  -4.931  -6.815   0.654
  448   2HE   MET  57          2HE       MET  57  -5.055  -5.067   0.457
  449   3HE   MET  57          3HE       MET  57  -5.851  -6.143  -0.692
  450    H    ASP  58           H        ASP  58 -12.381  -3.101   0.240
  451    HA   ASP  58           HA       ASP  58 -12.463  -4.484  -2.149
  452   1HB   ASP  58          1HB       ASP  58 -14.502  -4.061  -1.002
  453   2HB   ASP  58          2HB       ASP  58 -14.241  -2.320  -1.024
  454    H    ALA  59           H        ALA  59 -12.045  -1.012  -1.610
  455    HA   ALA  59           HA       ALA  59 -12.027  -0.183  -4.283
  456   1HB   ALA  59          1HB       ALA  59 -10.884   1.811  -3.497
  457   2HB   ALA  59          2HB       ALA  59 -12.167   1.358  -2.377
  458   3HB   ALA  59          3HB       ALA  59 -10.485   1.007  -1.979
  459    H    VAL  60           H        VAL  60  -9.449  -1.450  -2.242
  460    HA   VAL  60           HA       VAL  60  -7.325  -0.958  -4.067
  461    HB   VAL  60           HB       VAL  60  -7.434  -3.078  -1.914
  462   1HG1  VAL  60          1HG1      VAL  60  -4.996  -2.831  -1.884
  463   2HG1  VAL  60          2HG1      VAL  60  -5.581  -3.352  -3.465
  464   3HG1  VAL  60          3HG1      VAL  60  -5.102  -1.673  -3.211
  465   1HG2  VAL  60          1HG2      VAL  60  -6.544  -0.205  -1.692
  466   2HG2  VAL  60          2HG2      VAL  60  -8.002  -0.896  -0.979
  467   3HG2  VAL  60          3HG2      VAL  60  -6.415  -1.429  -0.429
  468    H    LEU  61           H        LEU  61  -9.418  -3.724  -3.399
  469    HA   LEU  61           HA       LEU  61  -8.170  -5.524  -5.193
  470   1HB   LEU  61          1HB       LEU  61 -11.021  -5.482  -4.197
  471   2HB   LEU  61          2HB       LEU  61 -10.243  -6.838  -4.991
  472    HG   LEU  61           HG       LEU  61  -9.441  -5.674  -2.322
  473   1HD1  LEU  61          1HD1      LEU  61 -10.857  -8.244  -3.014
  474   2HD1  LEU  61          2HD1      LEU  61 -10.290  -7.781  -1.409
  475   3HD1  LEU  61          3HD1      LEU  61 -11.559  -6.846  -2.198
  476   1HD2  LEU  61          1HD2      LEU  61  -7.536  -6.592  -3.544
  477   2HD2  LEU  61          2HD2      LEU  61  -7.954  -7.605  -2.161
  478   3HD2  LEU  61          3HD2      LEU  61  -8.415  -8.103  -3.790
  479    H    ALA  62           H        ALA  62 -10.685  -3.110  -5.558
  480    HA   ALA  62           HA       ALA  62 -11.534  -3.828  -8.157
  481   1HB   ALA  62          1HB       ALA  62 -11.574  -1.104  -6.860
  482   2HB   ALA  62          2HB       ALA  62 -12.521  -1.610  -8.258
  483   3HB   ALA  62          3HB       ALA  62 -12.818  -2.340  -6.681
  484    H    LEU  63           H        LEU  63  -8.920  -1.807  -6.963
  485    HA   LEU  63           HA       LEU  63  -8.132  -0.753  -9.477
  486   1HB   LEU  63          1HB       LEU  63  -6.525  -1.190  -6.958
  487   2HB   LEU  63          2HB       LEU  63  -5.993  -0.245  -8.336
  488    HG   LEU  63           HG       LEU  63  -8.386   0.401  -6.609
  489   1HD1  LEU  63          1HD1      LEU  63  -7.021   2.250  -5.784
  490   2HD1  LEU  63          2HD1      LEU  63  -6.286   0.693  -5.409
  491   3HD1  LEU  63          3HD1      LEU  63  -5.653   1.670  -6.734
  492   1HD2  LEU  63          1HD2      LEU  63  -7.070   1.949  -8.837
  493   2HD2  LEU  63          2HD2      LEU  63  -8.649   1.165  -8.906
  494   3HD2  LEU  63          3HD2      LEU  63  -8.387   2.526  -7.816
  495    H    ASN  64           H        ASN  64  -7.509  -3.702  -7.773
  496    HA   ASN  64           HA       ASN  64  -6.520  -5.655  -8.310
  497   1HB   ASN  64          1HB       ASN  64  -7.894  -5.485 -10.361
  498   2HB   ASN  64          2HB       ASN  64  -6.573  -4.634 -11.156
  499   1HD2  ASN  64          2HD2      ASN  64  -4.701  -5.777 -11.716
  500   2HD2  ASN  64          1HD2      ASN  64  -4.674  -7.507 -11.786
  501    HA   PRO  65           HA       PRO  65  -2.249  -4.197  -8.635
  502   1HB   PRO  65          1HB       PRO  65  -1.602  -4.528  -6.013
  503   2HB   PRO  65          2HB       PRO  65  -2.310  -3.045  -6.655
  504   1HG   PRO  65          1HG       PRO  65  -3.494  -5.005  -4.869
  505   2HG   PRO  65          2HG       PRO  65  -4.109  -3.412  -5.335
  506   1HD   PRO  65          1HD       PRO  65  -4.829  -6.058  -6.374
  507   2HD   PRO  65          2HD       PRO  65  -5.682  -4.510  -6.551
  508    H    ALA  66           H        ALA  66  -0.343  -5.464  -8.559
  509    HA   ALA  66           HA       ALA  66  -0.775  -8.329  -8.311
  510   1HB   ALA  66          1HB       ALA  66   0.503  -7.499 -10.219
  511   2HB   ALA  66          2HB       ALA  66   1.689  -6.785  -9.125
  512   3HB   ALA  66          3HB       ALA  66   1.499  -8.537  -9.198
  513    H    VAL  67           H        VAL  67   0.997  -5.717  -6.775
  514    HA   VAL  67           HA       VAL  67   1.242  -7.377  -4.380
  515    HB   VAL  67           HB       VAL  67   3.391  -7.669  -5.471
  516   1HG1  VAL  67          1HG1      VAL  67   3.604  -4.664  -5.454
  517   2HG1  VAL  67          2HG1      VAL  67   4.885  -5.785  -5.916
  518   3HG1  VAL  67          3HG1      VAL  67   3.408  -5.691  -6.875
  519   1HG2  VAL  67          1HG2      VAL  67   3.383  -7.525  -3.038
  520   2HG2  VAL  67          2HG2      VAL  67   4.875  -6.860  -3.704
  521   3HG2  VAL  67          3HG2      VAL  67   3.605  -5.779  -3.130
  522    H    ILE  68           H        ILE  68   0.944  -6.267  -2.512
  523    HA   ILE  68           HA       ILE  68   0.592  -3.353  -2.748
  524    HB   ILE  68           HB       ILE  68  -0.653  -5.265  -0.757
  525   1HG1  ILE  68          1HG1      ILE  68  -2.782  -4.193  -1.807
  526   2HG1  ILE  68          2HG1      ILE  68  -1.712  -3.773  -3.140
  527   1HG2  ILE  68          1HG2      ILE  68  -1.853  -3.320   0.122
  528   2HG2  ILE  68          2HG2      ILE  68  -0.109  -3.156   0.322
  529   3HG2  ILE  68          3HG2      ILE  68  -0.937  -2.270  -0.958
  530   1HD1  ILE  68          1HD1      ILE  68  -2.908  -5.825  -3.595
  531   2HD1  ILE  68          2HD1      ILE  68  -1.179  -6.136  -3.444
  532   3HD1  ILE  68          3HD1      ILE  68  -2.268  -6.546  -2.118
  533    H    LEU  69           H        LEU  69   2.025  -2.125  -1.764
  534    HA   LEU  69           HA       LEU  69   3.721  -3.277   0.325
  535   1HB   LEU  69          1HB       LEU  69   3.929  -0.661  -1.173
  536   2HB   LEU  69          2HB       LEU  69   5.044  -1.188   0.073
  537    HG   LEU  69           HG       LEU  69   4.606  -2.548  -2.588
  538   1HD1  LEU  69          1HD1      LEU  69   6.919  -0.929  -1.533
  539   2HD1  LEU  69          2HD1      LEU  69   6.883  -1.791  -3.071
  540   3HD1  LEU  69          3HD1      LEU  69   5.791  -0.434  -2.794
  541   1HD2  LEU  69          1HD2      LEU  69   6.550  -3.172  -0.365
  542   2HD2  LEU  69          2HD2      LEU  69   5.156  -4.149  -0.828
  543   3HD2  LEU  69          3HD2      LEU  69   6.504  -3.951  -1.948
  544    H    LEU  70           H        LEU  70   2.912  -3.110   2.291
  545    HA   LEU  70           HA       LEU  70   1.032  -0.962   2.894
  546   1HB   LEU  70          1HB       LEU  70   0.422  -3.298   3.398
  547   2HB   LEU  70          2HB       LEU  70   1.795  -3.415   4.482
  548    HG   LEU  70           HG       LEU  70   0.767  -1.625   5.884
  549   1HD1  LEU  70          1HD1      LEU  70  -1.592  -1.099   5.549
  550   2HD1  LEU  70          2HD1      LEU  70  -0.618  -0.585   4.173
  551   3HD1  LEU  70          3HD1      LEU  70  -1.596  -2.048   4.062
  552   1HD2  LEU  70          1HD2      LEU  70  -0.925  -3.081   6.873
  553   2HD2  LEU  70          2HD2      LEU  70  -0.904  -4.092   5.427
  554   3HD2  LEU  70          3HD2      LEU  70   0.530  -3.983   6.449
  555    H    GLY  71           H        GLY  71   2.099   0.854   3.424
  556   1HA   GLY  71          1HA       GLY  71   4.410   0.712   5.208
  557   2HA   GLY  71          2HA       GLY  71   3.819   2.148   4.381
  558    H    THR  72           H        THR  72   3.758   0.316   7.251
  559    HA   THR  72           HA       THR  72   1.349   1.552   8.282
  560    HB   THR  72           HB       THR  72   1.967   0.269  10.388
  561    HG1  THR  72           HG1      THR  72   4.028  -0.614   8.637
  562   1HG2  THR  72          1HG2      THR  72   1.628  -1.289   7.824
  563   2HG2  THR  72          2HG2      THR  72   1.282  -1.888   9.447
  564   3HG2  THR  72          3HG2      THR  72   0.333  -0.562   8.775
  565    H    GLY  73           H        GLY  73   2.505   3.734   7.879
  566   1HA   GLY  73          1HA       GLY  73   3.696   5.553   8.624
  567   2HA   GLY  73          2HA       GLY  73   3.094   5.059  10.200
  568    H    GLU  74           H        GLU  74   4.659   5.027  11.623
  569    HA   GLU  74           HA       GLU  74   7.073   3.512  10.950
  570   1HB   GLU  74          1HB       GLU  74   7.426   6.069  11.095
  571   2HB   GLU  74          2HB       GLU  74   7.154   5.876  12.821
  572   1HG   GLU  74          1HG       GLU  74   9.262   4.342  11.327
  573   2HG   GLU  74          2HG       GLU  74   9.557   5.923  12.046
  574    H    ARG  75           H        ARG  75   5.527   1.943  11.798
  575    HA   ARG  75           HA       ARG  75   6.238   1.198  14.427
  576   1HB   ARG  75          1HB       ARG  75   3.914   1.178  15.377
  577   2HB   ARG  75          2HB       ARG  75   4.596   2.785  15.176
  578   1HG   ARG  75          1HG       ARG  75   3.325   2.899  12.989
  579   2HG   ARG  75          2HG       ARG  75   2.479   1.445  13.522
  580   1HD   ARG  75          1HD       ARG  75   1.796   2.644  15.572
  581   2HD   ARG  75          2HD       ARG  75   2.563   4.102  14.943
  582    HE   ARG  75           HE       ARG  75   0.102   2.857  13.984
  583   1HH1  ARG  75          1HH1      ARG  75   2.515   5.384  13.586
  584   2HH1  ARG  75          2HH1      ARG  75   1.466   6.381  12.620
  585   1HH2  ARG  75          1HH2      ARG  75  -1.246   4.165  12.726
  586   2HH2  ARG  75          2HH2      ARG  75  -0.660   5.691  12.127
  587    H    GLN  76           H        GLN  76   6.706  -0.801  13.836
  588    HA   GLN  76           HA       GLN  76   5.524  -2.085  11.631
  589   1HB   GLN  76          1HB       GLN  76   7.827  -2.508  12.479
  590   2HB   GLN  76          2HB       GLN  76   7.127  -3.365  13.845
  591   1HG   GLN  76          1HG       GLN  76   6.233  -5.055  12.421
  592   2HG   GLN  76          2HG       GLN  76   6.677  -4.144  10.977
  593   1HE2  GLN  76          2HE2      GLN  76   7.415  -6.842  11.775
  594   2HE2  GLN  76          1HE2      GLN  76   9.141  -6.877  11.823
  595    H    GLN  77           H        GLN  77   3.383  -2.353  11.756
  596    HA   GLN  77           HA       GLN  77   2.362  -4.113  13.883
  597   1HB   GLN  77          1HB       GLN  77   1.338  -1.894  13.992
  598   2HB   GLN  77          2HB       GLN  77   0.903  -1.990  12.291
  599   1HG   GLN  77          1HG       GLN  77  -1.026  -2.414  13.670
  600   2HG   GLN  77          2HG       GLN  77  -0.586  -3.870  12.781
  601   1HE2  GLN  77          2HE2      GLN  77  -1.501  -5.312  14.162
  602   2HE2  GLN  77          1HE2      GLN  77  -0.930  -5.592  15.775
  603    H    PHE  78           H        PHE  78   1.208  -5.896  13.277
  604    HA   PHE  78           HA       PHE  78   1.470  -6.662  10.492
  605   1HB   PHE  78          1HB       PHE  78   0.528  -8.280  12.868
  606   2HB   PHE  78          2HB       PHE  78   0.908  -8.911  11.268
  607    HD1  PHE  78           HD1      PHE  78   2.185  -8.120  14.492
  608    HD2  PHE  78           HD2      PHE  78   3.297  -8.584  10.411
  609    HE1  PHE  78           HE1      PHE  78   4.535  -8.395  15.168
  610    HE2  PHE  78           HE2      PHE  78   5.649  -8.866  11.079
  611    HZ   PHE  78           HZ       PHE  78   6.269  -8.770  13.461
  612    HA   PRO  79           HA       PRO  79  -2.660  -5.631   9.472
  613   1HB   PRO  79          1HB       PRO  79  -2.646  -7.738   7.442
  614   2HB   PRO  79          2HB       PRO  79  -2.682  -5.986   7.235
  615   1HG   PRO  79          1HG       PRO  79  -0.513  -7.471   6.616
  616   2HG   PRO  79          2HG       PRO  79  -0.390  -5.808   7.222
  617   1HD   PRO  79          1HD       PRO  79  -0.001  -8.393   8.684
  618   2HD   PRO  79          2HD       PRO  79   0.931  -6.884   8.791
  619    H    SER  80           H        SER  80  -4.827  -6.490   9.217
  620    HA   SER  80           HA       SER  80  -5.571  -8.308  11.186
  621   1HB   SER  80          1HB       SER  80  -7.191  -7.669   8.715
  622   2HB   SER  80          2HB       SER  80  -7.791  -8.095  10.318
  623    HG   SER  80           HG       SER  80  -7.651  -5.732   9.535
  624    H    THR  81           H        THR  81  -5.874 -10.482  11.229
  625    HA   THR  81           HA       THR  81  -4.492 -12.087   9.413
  626    HB   THR  81           HB       THR  81  -5.803 -13.945  10.623
  627    HG1  THR  81           HG1      THR  81  -6.610 -13.010  12.713
  628   1HG2  THR  81          1HG2      THR  81  -4.427 -13.687  12.638
  629   2HG2  THR  81          2HG2      THR  81  -3.506 -13.331  11.178
  630   3HG2  THR  81          3HG2      THR  81  -4.099 -12.012  12.189
  631    H    ASP  82           H        ASP  82  -7.927 -11.350   9.698
  632    HA   ASP  82           HA       ASP  82  -8.883 -13.190   7.800
  633   1HB   ASP  82          1HB       ASP  82 -10.320 -11.932   9.396
  634   2HB   ASP  82          2HB       ASP  82 -10.022 -10.466   8.468
  635    H    VAL  83           H        VAL  83  -7.570  -9.948   7.486
  636    HA   VAL  83           HA       VAL  83  -8.202  -9.609   4.729
  637    HB   VAL  83           HB       VAL  83  -6.103  -8.225   6.411
  638   1HG1  VAL  83          1HG1      VAL  83  -6.179  -6.460   4.712
  639   2HG1  VAL  83          2HG1      VAL  83  -5.624  -7.991   4.036
  640   3HG1  VAL  83          3HG1      VAL  83  -7.277  -7.445   3.745
  641   1HG2  VAL  83          1HG2      VAL  83  -8.929  -7.433   5.720
  642   2HG2  VAL  83          2HG2      VAL  83  -8.334  -7.918   7.308
  643   3HG2  VAL  83          3HG2      VAL  83  -7.765  -6.419   6.572
  644    H    LEU  84           H        LEU  84  -5.476 -10.917   6.503
  645    HA   LEU  84           HA       LEU  84  -3.642 -11.152   4.393
  646   1HB   LEU  84          1HB       LEU  84  -4.012 -12.942   6.799
  647   2HB   LEU  84          2HB       LEU  84  -2.603 -12.931   5.759
  648    HG   LEU  84           HG       LEU  84  -3.519 -10.592   7.435
  649   1HD1  LEU  84          1HD1      LEU  84  -2.750 -12.428   8.834
  650   2HD1  LEU  84          2HD1      LEU  84  -1.271 -12.550   7.881
  651   3HD1  LEU  84          3HD1      LEU  84  -1.585 -11.103   8.841
  652   1HD2  LEU  84          1HD2      LEU  84  -1.333  -9.649   6.878
  653   2HD2  LEU  84          2HD2      LEU  84  -0.999 -11.034   5.839
  654   3HD2  LEU  84          3HD2      LEU  84  -2.305  -9.920   5.431
  655    H    ALA  85           H        ALA  85  -6.246 -13.256   5.491
  656    HA   ALA  85           HA       ALA  85  -5.730 -15.420   3.753
  657   1HB   ALA  85          1HB       ALA  85  -8.003 -16.137   4.267
  658   2HB   ALA  85          2HB       ALA  85  -7.166 -15.610   5.726
  659   3HB   ALA  85          3HB       ALA  85  -8.356 -14.556   4.961
  660    H    ALA  86           H        ALA  86  -7.483 -12.412   3.350
  661    HA   ALA  86           HA       ALA  86  -8.835 -13.072   0.955
  662   1HB   ALA  86          1HB       ALA  86  -9.505 -11.181   2.342
  663   2HB   ALA  86          2HB       ALA  86  -7.985 -10.364   1.978
  664   3HB   ALA  86          3HB       ALA  86  -9.156 -10.660   0.692
  665    H    CYS  87           H        CYS  87  -5.634 -11.802   1.636
  666    HA   CYS  87           HA       CYS  87  -5.007 -11.359  -1.142
  667   1HB   CYS  87          1HB       CYS  87  -3.137 -11.501   1.233
  668   2HB   CYS  87          2HB       CYS  87  -2.783 -10.800  -0.343
  669    HG   CYS  87           HG       CYS  87  -5.071  -9.577   1.897
  670    H    LEU  88           H        LEU  88  -4.497 -13.826   1.277
  671    HA   LEU  88           HA       LEU  88  -2.583 -15.389  -0.050
  672   1HB   LEU  88          1HB       LEU  88  -3.156 -15.535   2.355
  673   2HB   LEU  88          2HB       LEU  88  -4.699 -16.243   1.933
  674    HG   LEU  88           HG       LEU  88  -2.178 -17.611   1.064
  675   1HD1  LEU  88          1HD1      LEU  88  -3.432 -17.816   3.802
  676   2HD1  LEU  88          2HD1      LEU  88  -2.131 -18.830   3.179
  677   3HD1  LEU  88          3HD1      LEU  88  -1.859 -17.108   3.440
  678   1HD2  LEU  88          1HD2      LEU  88  -3.559 -19.601   1.309
  679   2HD2  LEU  88          2HD2      LEU  88  -4.885 -18.624   1.941
  680   3HD2  LEU  88          3HD2      LEU  88  -4.362 -18.425   0.269
  681    H    THR  89           H        THR  89  -6.093 -15.321  -0.267
  682    HA   THR  89           HA       THR  89  -6.453 -17.836  -1.459
  683    HB   THR  89           HB       THR  89  -8.239 -16.397  -0.388
  684    HG1  THR  89           HG1      THR  89  -9.766 -17.450  -1.530
  685   1HG2  THR  89          1HG2      THR  89  -9.469 -14.865  -1.850
  686   2HG2  THR  89          2HG2      THR  89  -7.811 -14.319  -1.604
  687   3HG2  THR  89          3HG2      THR  89  -8.265 -15.103  -3.116
  688    H    ARG  90           H        ARG  90  -5.186 -14.947  -2.809
  689    HA   ARG  90           HA       ARG  90  -5.414 -16.156  -5.485
  690   1HB   ARG  90          1HB       ARG  90  -6.822 -14.167  -5.377
  691   2HB   ARG  90          2HB       ARG  90  -5.468 -13.212  -4.792
  692   1HG   ARG  90          1HG       ARG  90  -4.462 -13.120  -6.856
  693   2HG   ARG  90          2HG       ARG  90  -5.236 -14.602  -7.419
  694   1HD   ARG  90          1HD       ARG  90  -6.702 -12.020  -6.909
  695   2HD   ARG  90          2HD       ARG  90  -6.090 -12.513  -8.489
  696    HE   ARG  90           HE       ARG  90  -7.779 -14.478  -7.224
  697   1HH1  ARG  90          1HH1      ARG  90  -7.710 -11.644  -9.302
  698   2HH1  ARG  90          2HH1      ARG  90  -9.231 -12.027 -10.064
  699   1HH2  ARG  90          1HH2      ARG  90  -9.770 -14.955  -8.218
  700   2HH2  ARG  90          2HH2      ARG  90 -10.403 -13.895  -9.438
  701    H    GLY  91           H        GLY  91  -3.361 -15.535  -3.041
  702   1HA   GLY  91          1HA       GLY  91  -1.067 -15.593  -2.895
  703   2HA   GLY  91          2HA       GLY  91  -1.031 -15.929  -4.621
  704    H    ILE  92           H        ILE  92  -2.378 -13.137  -2.936
  705    HA   ILE  92           HA       ILE  92  -0.859 -11.381  -4.689
  706    HB   ILE  92           HB       ILE  92  -2.903 -10.655  -2.580
  707   1HG1  ILE  92          1HG1      ILE  92  -3.259 -11.001  -5.568
  708   2HG1  ILE  92          2HG1      ILE  92  -3.853 -12.111  -4.339
  709   1HG2  ILE  92          1HG2      ILE  92  -1.440  -8.810  -3.162
  710   2HG2  ILE  92          2HG2      ILE  92  -1.749  -9.080  -4.877
  711   3HG2  ILE  92          3HG2      ILE  92  -3.054  -8.538  -3.821
  712   1HD1  ILE  92          1HD1      ILE  92  -5.317 -10.367  -3.467
  713   2HD1  ILE  92          2HD1      ILE  92  -4.711  -9.248  -4.688
  714   3HD1  ILE  92          3HD1      ILE  92  -5.624 -10.676  -5.177
  715    H    GLY  93           H        GLY  93   0.793 -10.100  -4.054
  716   1HA   GLY  93          1HA       GLY  93   2.130 -10.748  -1.610
  717   2HA   GLY  93          2HA       GLY  93   2.640  -9.551  -2.792
  718    H    LEU  94           H        LEU  94   2.115  -9.755   0.285
  719    HA   LEU  94           HA       LEU  94   1.131  -7.008   0.485
  720   1HB   LEU  94          1HB       LEU  94  -0.824  -8.429   0.912
  721   2HB   LEU  94          2HB       LEU  94   0.068  -9.301   2.144
  722    HG   LEU  94           HG       LEU  94   0.207  -7.225   3.486
  723   1HD1  LEU  94          1HD1      LEU  94  -1.184  -5.311   2.886
  724   2HD1  LEU  94          2HD1      LEU  94   0.069  -5.603   1.679
  725   3HD1  LEU  94          3HD1      LEU  94  -1.596  -6.087   1.356
  726   1HD2  LEU  94          1HD2      LEU  94  -1.574  -8.827   3.906
  727   2HD2  LEU  94          2HD2      LEU  94  -2.146  -7.179   4.161
  728   3HD2  LEU  94          3HD2      LEU  94  -2.582  -8.046   2.688
  729    H    GLU  95           H        GLU  95   3.046  -6.179   1.114
  730    HA   GLU  95           HA       GLU  95   4.541  -7.529   3.248
  731   1HB   GLU  95          1HB       GLU  95   5.394  -5.254   1.448
  732   2HB   GLU  95          2HB       GLU  95   6.421  -6.118   2.584
  733   1HG   GLU  95          1HG       GLU  95   5.108  -7.294   0.144
  734   2HG   GLU  95          2HG       GLU  95   6.805  -6.840   0.295
  735    H    ALA  96           H        ALA  96   4.186  -6.821   5.264
  736    HA   ALA  96           HA       ALA  96   3.186  -4.120   5.698
  737   1HB   ALA  96          1HB       ALA  96   3.723  -6.312   7.703
  738   2HB   ALA  96          2HB       ALA  96   2.890  -4.789   8.016
  739   3HB   ALA  96          3HB       ALA  96   2.169  -5.982   6.937
  740    H    MET  97           H        MET  97   4.674  -2.589   5.614
  741    HA   MET  97           HA       MET  97   7.189  -2.966   7.098
  742   1HB   MET  97          1HB       MET  97   6.943  -1.699   4.355
  743   2HB   MET  97          2HB       MET  97   8.422  -1.859   5.290
  744   1HG   MET  97          1HG       MET  97   8.283  -4.287   5.115
  745   2HG   MET  97          2HG       MET  97   6.786  -4.139   4.200
  746   1HE   MET  97          1HE       MET  97  10.103  -1.994   4.000
  747   2HE   MET  97          2HE       MET  97  10.938  -2.818   2.684
  748   3HE   MET  97          3HE       MET  97  10.658  -3.655   4.210
  749    H    THR  98           H        THR  98   8.344  -0.587   6.903
  750    HA   THR  98           HA       THR  98   6.376   1.297   7.960
  751    HB   THR  98           HB       THR  98   8.477   2.656   8.488
  752    HG1  THR  98           HG1      THR  98  10.419   1.671   8.244
  753   1HG2  THR  98          1HG2      THR  98   7.265   1.361  10.180
  754   2HG2  THR  98          2HG2      THR  98   8.183  -0.078   9.740
  755   3HG2  THR  98          3HG2      THR  98   9.004   1.305  10.462
  756    H    ASN  99           H        ASN  99   6.584   3.616   7.267
  757    HA   ASN  99           HA       ASN  99   6.107   3.784   4.512
  758   1HB   ASN  99          1HB       ASN  99   6.611   5.912   6.581
  759   2HB   ASN  99          2HB       ASN  99   6.303   6.313   4.896
  760   1HD2  ASN  99          2HD2      ASN  99   4.688   7.098   7.071
  761   2HD2  ASN  99          1HD2      ASN  99   3.139   6.344   6.883
  762    H    ALA 100           H        ALA 100   9.007   4.637   6.367
  763    HA   ALA 100           HA       ALA 100  10.396   5.779   4.168
  764   1HB   ALA 100          1HB       ALA 100  11.521   4.594   6.702
  765   2HB   ALA 100          2HB       ALA 100  12.370   5.661   5.583
  766   3HB   ALA 100          3HB       ALA 100  10.984   6.261   6.493
  767    H    ALA 101           H        ALA 101   9.904   2.520   5.211
  768    HA   ALA 101           HA       ALA 101  12.151   1.493   3.681
  769   1HB   ALA 101          1HB       ALA 101  11.628   0.509   5.855
  770   2HB   ALA 101          2HB       ALA 101  10.040   0.031   5.257
  771   3HB   ALA 101          3HB       ALA 101  11.495  -0.681   4.561
  772    H    ALA 102           H        ALA 102   8.620   1.518   3.552
  773    HA   ALA 102           HA       ALA 102   8.361  -0.279   1.382
  774   1HB   ALA 102          1HB       ALA 102   6.069   0.505   1.234
  775   2HB   ALA 102          2HB       ALA 102   6.523   0.250   2.918
  776   3HB   ALA 102          3HB       ALA 102   6.453   1.885   2.261
  777    H    ALA 103           H        ALA 103   8.725   3.218   1.567
  778    HA   ALA 103           HA       ALA 103   8.137   3.853  -1.097
  779   1HB   ALA 103          1HB       ALA 103   9.362   5.925  -0.702
  780   2HB   ALA 103          2HB       ALA 103   8.323   5.534   0.668
  781   3HB   ALA 103          3HB       ALA 103  10.059   5.241   0.768
  782    H    ARG 104           H        ARG 104  10.992   2.502   0.361
  783    HA   ARG 104           HA       ARG 104  12.798   3.098  -1.754
  784   1HB   ARG 104          1HB       ARG 104  12.910   0.948   0.369
  785   2HB   ARG 104          2HB       ARG 104  14.240   1.377  -0.699
  786   1HG   ARG 104          1HG       ARG 104  12.942   3.214   1.303
  787   2HG   ARG 104          2HG       ARG 104  14.489   2.389   1.505
  788   1HD   ARG 104          1HD       ARG 104  15.442   3.604  -0.334
  789   2HD   ARG 104          2HD       ARG 104  13.879   4.320  -0.724
  790    HE   ARG 104           HE       ARG 104  14.639   4.941   1.937
  791   1HH1  ARG 104          1HH1      ARG 104  15.369   5.731  -1.381
  792   2HH1  ARG 104          2HH1      ARG 104  15.859   7.360  -1.039
  793   1HH2  ARG 104          1HH2      ARG 104  15.268   7.092   2.422
  794   2HH2  ARG 104          2HH2      ARG 104  15.777   8.145   1.129
  795    H    THR 105           H        THR 105  10.835   0.262  -0.945
  796    HA   THR 105           HA       THR 105  11.721  -1.281  -3.170
  797    HB   THR 105           HB       THR 105   9.161  -1.620  -1.591
  798    HG1  THR 105           HG1      THR 105  11.851  -2.145  -0.977
  799   1HG2  THR 105          1HG2      THR 105   9.294  -2.966  -3.638
  800   2HG2  THR 105          2HG2      THR 105  10.854  -3.606  -3.118
  801   3HG2  THR 105          3HG2      THR 105   9.397  -3.981  -2.199
  802    H    TYR 106           H        TYR 106   9.162   1.029  -2.604
  803    HA   TYR 106           HA       TYR 106   7.522   0.526  -4.803
  804   1HB   TYR 106          1HB       TYR 106   6.804   2.035  -3.058
  805   2HB   TYR 106          2HB       TYR 106   8.141   3.131  -3.394
  806    HD1  TYR 106           HD1      TYR 106   7.917   4.846  -4.984
  807    HD2  TYR 106           HD2      TYR 106   5.012   1.738  -4.844
  808    HE1  TYR 106           HE1      TYR 106   6.514   6.093  -6.568
  809    HE2  TYR 106           HE2      TYR 106   3.602   2.981  -6.432
  810    HH   TYR 106           HH       TYR 106   3.288   5.343  -7.168
  811    H    ASN 107           H        ASN 107  10.380   2.627  -4.543
  812    HA   ASN 107           HA       ASN 107  10.275   3.709  -7.119
  813   1HB   ASN 107          1HB       ASN 107  11.739   4.694  -5.498
  814   2HB   ASN 107          2HB       ASN 107  12.626   3.188  -5.294
  815   1HD2  ASN 107          2HD2      ASN 107  14.340   2.795  -6.558
  816   2HD2  ASN 107          1HD2      ASN 107  14.848   3.801  -7.869
  817    H    VAL 108           H        VAL 108  11.677   0.696  -5.961
  818    HA   VAL 108           HA       VAL 108  12.956  -0.015  -8.392
  819    HB   VAL 108           HB       VAL 108  11.970  -1.846  -6.194
  820   1HG1  VAL 108          1HG1      VAL 108  14.066  -2.283  -8.321
  821   2HG1  VAL 108          2HG1      VAL 108  13.660  -3.407  -7.024
  822   3HG1  VAL 108          3HG1      VAL 108  12.470  -3.033  -8.270
  823   1HG2  VAL 108          1HG2      VAL 108  14.652  -0.515  -6.560
  824   2HG2  VAL 108          2HG2      VAL 108  13.464  -0.146  -5.309
  825   3HG2  VAL 108          3HG2      VAL 108  14.265  -1.717  -5.330
  826    H    LEU 109           H        LEU 109   9.837  -0.931  -6.951
  827    HA   LEU 109           HA       LEU 109   9.084  -2.663  -9.060
  828   1HB   LEU 109          1HB       LEU 109   7.358  -1.248  -7.029
  829   2HB   LEU 109          2HB       LEU 109   6.842  -2.579  -8.047
  830    HG   LEU 109           HG       LEU 109   8.970  -2.710  -5.909
  831   1HD1  LEU 109          1HD1      LEU 109   6.715  -2.548  -5.005
  832   2HD1  LEU 109          2HD1      LEU 109   6.201  -3.892  -6.025
  833   3HD1  LEU 109          3HD1      LEU 109   7.387  -4.158  -4.749
  834   1HD2  LEU 109          1HD2      LEU 109   9.495  -4.188  -7.764
  835   2HD2  LEU 109          2HD2      LEU 109   8.975  -5.116  -6.358
  836   3HD2  LEU 109          3HD2      LEU 109   7.868  -4.862  -7.707
  837    H    ALA 110           H        ALA 110   8.548   0.763  -8.462
  838    HA   ALA 110           HA       ALA 110   6.692   1.218 -10.540
  839   1HB   ALA 110          1HB       ALA 110   7.291   3.574 -10.316
  840   2HB   ALA 110          2HB       ALA 110   7.078   2.824  -8.734
  841   3HB   ALA 110          3HB       ALA 110   8.700   3.132  -9.353
  842    H    SER 111           H        SER 111  10.221   1.233 -10.446
  843    HA   SER 111           HA       SER 111  10.540   2.104 -13.143
  844   1HB   SER 111          1HB       SER 111  12.487   0.636 -11.346
  845   2HB   SER 111          2HB       SER 111  12.895   1.488 -12.837
  846    HG   SER 111           HG       SER 111  12.171   2.509 -10.327
  847    H    GLU 112           H        GLU 112  10.189  -0.998 -11.567
  848    HA   GLU 112           HA       GLU 112  10.873  -2.616 -13.785
  849   1HB   GLU 112          1HB       GLU 112   9.337  -3.045 -11.245
  850   2HB   GLU 112          2HB       GLU 112   9.417  -4.302 -12.467
  851   1HG   GLU 112          1HG       GLU 112  11.828  -3.019 -11.219
  852   2HG   GLU 112          2HG       GLU 112  11.094  -4.521 -10.651
  853    H    GLY 113           H        GLY 113   8.004  -0.901 -12.854
  854   1HA   GLY 113          1HA       GLY 113   6.122  -0.445 -14.127
  855   2HA   GLY 113          2HA       GLY 113   6.758  -1.495 -15.389
  856    H    ARG 114           H        ARG 114   6.420  -2.495 -12.070
  857    HA   ARG 114           HA       ARG 114   4.419  -4.465 -12.923
  858   1HB   ARG 114          1HB       ARG 114   6.614  -5.160 -11.794
  859   2HB   ARG 114          2HB       ARG 114   5.954  -4.467 -10.320
  860   1HG   ARG 114          1HG       ARG 114   4.357  -6.106 -10.101
  861   2HG   ARG 114          2HG       ARG 114   4.362  -6.489 -11.824
  862   1HD   ARG 114          1HD       ARG 114   5.425  -8.312 -10.817
  863   2HD   ARG 114          2HD       ARG 114   6.739  -7.332 -11.458
  864    HE   ARG 114           HE       ARG 114   5.968  -7.149  -8.624
  865   1HH1  ARG 114          1HH1      ARG 114   8.390  -7.666 -11.103
  866   2HH1  ARG 114          2HH1      ARG 114   9.674  -7.951  -9.968
  867   1HH2  ARG 114          1HH2      ARG 114   7.651  -7.572  -7.119
  868   2HH2  ARG 114          2HH2      ARG 114   9.254  -7.927  -7.711
  869    H    ARG 115           H        ARG 115   2.449  -4.664 -11.817
  870    HA   ARG 115           HA       ARG 115   1.474  -2.124 -10.959
  871   1HB   ARG 115          1HB       ARG 115   0.165  -3.756 -12.331
  872   2HB   ARG 115          2HB       ARG 115   0.018  -4.766 -10.901
  873   1HG   ARG 115          1HG       ARG 115  -1.974  -3.374 -11.363
  874   2HG   ARG 115          2HG       ARG 115  -1.267  -3.103  -9.770
  875   1HD   ARG 115          1HD       ARG 115  -1.944  -1.012 -10.899
  876   2HD   ARG 115          2HD       ARG 115  -0.226  -1.067 -10.522
  877    HE   ARG 115           HE       ARG 115  -0.046  -1.822 -12.994
  878   1HH1  ARG 115          1HH1      ARG 115  -2.450   0.427 -11.778
  879   2HH1  ARG 115          2HH1      ARG 115  -2.469   1.394 -13.219
  880   1HH2  ARG 115          1HH2      ARG 115  -0.081  -0.554 -14.899
  881   2HH2  ARG 115          2HH2      ARG 115  -1.133   0.830 -14.997
  882    H    VAL 116           H        VAL 116   2.435  -1.547  -9.100
  883    HA   VAL 116           HA       VAL 116   1.916  -3.199  -6.731
  884    HB   VAL 116           HB       VAL 116   4.282  -2.756  -7.049
  885   1HG1  VAL 116          1HG1      VAL 116   4.133  -0.739  -8.403
  886   2HG1  VAL 116          2HG1      VAL 116   3.563   0.173  -7.006
  887   3HG1  VAL 116          3HG1      VAL 116   5.199  -0.486  -7.022
  888   1HG2  VAL 116          1HG2      VAL 116   4.812  -1.686  -4.908
  889   2HG2  VAL 116          2HG2      VAL 116   3.154  -1.092  -4.799
  890   3HG2  VAL 116          3HG2      VAL 116   3.476  -2.826  -4.755
  891    H    ALA 117           H        ALA 117   0.721  -2.412  -5.086
  892    HA   ALA 117           HA       ALA 117  -0.297   0.341  -5.353
  893   1HB   ALA 117          1HB       ALA 117  -2.039  -1.382  -5.456
  894   2HB   ALA 117          2HB       ALA 117  -1.524  -1.995  -3.884
  895   3HB   ALA 117          3HB       ALA 117  -2.211  -0.375  -4.018
  896    H    LEU 118           H        LEU 118   0.837   1.668  -4.087
  897    HA   LEU 118           HA       LEU 118   2.053   0.669  -1.648
  898   1HB   LEU 118          1HB       LEU 118   3.346   2.151  -3.104
  899   2HB   LEU 118          2HB       LEU 118   2.131   3.402  -2.936
  900    HG   LEU 118           HG       LEU 118   2.650   3.545  -0.515
  901   1HD1  LEU 118          1HD1      LEU 118   3.500   1.295  -0.168
  902   2HD1  LEU 118          2HD1      LEU 118   4.881   1.639  -1.210
  903   3HD1  LEU 118          3HD1      LEU 118   4.697   2.495   0.321
  904   1HD2  LEU 118          1HD2      LEU 118   4.810   4.666  -0.788
  905   2HD2  LEU 118          2HD2      LEU 118   4.987   3.926  -2.380
  906   3HD2  LEU 118          3HD2      LEU 118   3.686   5.080  -2.082
  907    H    ALA 119           H        ALA 119   0.665   0.428  -0.020
  908    HA   ALA 119           HA       ALA 119  -1.417   2.395   0.468
  909   1HB   ALA 119          1HB       ALA 119  -1.925   0.020   0.794
  910   2HB   ALA 119          2HB       ALA 119  -0.668  -0.080   2.027
  911   3HB   ALA 119          3HB       ALA 119  -2.093   0.923   2.299
  912    H    MET 120           H        MET 120  -0.318   4.229   0.990
  913    HA   MET 120           HA       MET 120   1.844   4.153   2.929
  914   1HB   MET 120          1HB       MET 120   1.725   5.564   0.763
  915   2HB   MET 120          2HB       MET 120   0.658   6.618   1.675
  916   1HG   MET 120          1HG       MET 120   2.764   7.595   1.853
  917   2HG   MET 120          2HG       MET 120   2.522   6.767   3.391
  918   1HE   MET 120          1HE       MET 120   5.303   7.822   1.896
  919   2HE   MET 120          2HE       MET 120   6.412   6.554   2.421
  920   3HE   MET 120          3HE       MET 120   5.263   7.252   3.564
  921    H    ILE 121           H        ILE 121   0.941   3.753   4.937
  922    HA   ILE 121           HA       ILE 121  -1.381   5.263   5.805
  923    HB   ILE 121           HB       ILE 121   0.327   3.356   7.418
  924   1HG1  ILE 121          1HG1      ILE 121  -2.272   2.842   5.947
  925   2HG1  ILE 121          2HG1      ILE 121  -0.688   2.236   5.468
  926   1HG2  ILE 121          1HG2      ILE 121  -0.980   4.900   8.780
  927   2HG2  ILE 121          2HG2      ILE 121  -2.445   4.443   7.911
  928   3HG2  ILE 121          3HG2      ILE 121  -1.608   3.257   8.914
  929   1HD1  ILE 121          1HD1      ILE 121  -2.145   1.543   8.009
  930   2HD1  ILE 121          2HD1      ILE 121  -2.000   0.520   6.579
  931   3HD1  ILE 121          3HD1      ILE 121  -0.566   0.929   7.520
  932    H    VAL 122           H        VAL 122  -0.927   7.346   6.136
  933    HA   VAL 122           HA       VAL 122   1.339   8.011   7.893
  934    HB   VAL 122           HB       VAL 122  -0.200   9.844   6.040
  935   1HG1  VAL 122          1HG1      VAL 122   1.601  11.444   6.489
  936   2HG1  VAL 122          2HG1      VAL 122   0.737  11.008   7.963
  937   3HG1  VAL 122          3HG1      VAL 122   2.320  10.308   7.631
  938   1HG2  VAL 122          1HG2      VAL 122   2.540   8.626   5.711
  939   2HG2  VAL 122          2HG2      VAL 122   1.100   8.214   4.779
  940   3HG2  VAL 122          3HG2      VAL 122   1.811   9.823   4.641
  941    H    GLY 123           H        GLY 123   0.912   8.760   9.882
  942   1HA   GLY 123          1HA       GLY 123  -0.343  10.222  11.347
  943   2HA   GLY 123          2HA       GLY 123  -1.784   9.832  10.418
  944    H    GLY 124           H        GLY 124  -3.135   8.780  11.743
  945   1HA   GLY 124          1HA       GLY 124  -2.949   6.200  12.485
  946   2HA   GLY 124          2HA       GLY 124  -2.118   7.016  13.800
  947    H    LEU 125           H        LEU 125  -3.434   8.977  14.660
  948    HA   LEU 125           HA       LEU 125  -5.940   7.842  15.558
  949   1HB   LEU 125          1HB       LEU 125  -4.246   8.958  17.062
  950   2HB   LEU 125          2HB       LEU 125  -4.690  10.482  16.321
  951    HG   LEU 125           HG       LEU 125  -7.057  10.052  17.111
  952   1HD1  LEU 125          1HD1      LEU 125  -7.338   8.479  18.959
  953   2HD1  LEU 125          2HD1      LEU 125  -6.866   7.652  17.473
  954   3HD1  LEU 125          3HD1      LEU 125  -5.675   7.927  18.744
  955   1HD2  LEU 125          1HD2      LEU 125  -4.892  10.330  19.191
  956   2HD2  LEU 125          2HD2      LEU 125  -5.577  11.634  18.220
  957   3HD2  LEU 125          3HD2      LEU 125  -6.584  10.786  19.394
  958    H    GLU 126           H        GLU 126  -7.925   9.113  15.618
  959    HA   GLU 126           HA       GLU 126  -8.740  10.181  13.191
  960   1HB   GLU 126          1HB       GLU 126  -9.897  10.930  15.882
  961   2HB   GLU 126          2HB       GLU 126 -10.709  11.012  14.327
  962   1HG   GLU 126          1HG       GLU 126 -11.598   9.108  15.252
  963   2HG   GLU 126          2HG       GLU 126 -10.300   8.462  14.249
  964    H    HIS 127           H        HIS 127  -9.095  12.278  12.454
  965    HA   HIS 127           HA       HIS 127  -7.212  14.234  13.519
  966   1HB   HIS 127          1HB       HIS 127  -8.893  14.396  11.005
  967   2HB   HIS 127          2HB       HIS 127  -7.548  15.443  11.439
  968    HD1  HIS 127           HD1      HIS 127  -8.327  12.535   9.489
  969    HD2  HIS 127           HD2      HIS 127  -5.003  13.884  11.583
  970    HE1  HIS 127           HE1      HIS 127  -6.390  11.209   8.597
  971    HE2  HIS 127           HE2      HIS 127  -4.368  12.200   9.718
  972    H    HIS 128           H        HIS 128  -7.865  16.386  14.027
  973    HA   HIS 128           HA       HIS 128 -10.494  16.532  15.200
  974   1HB   HIS 128          1HB       HIS 128  -8.523  18.810  14.944
  975   2HB   HIS 128          2HB       HIS 128  -9.821  18.636  16.118
  976    HD1  HIS 128           HD1      HIS 128  -6.337  18.520  16.002
  977    HD2  HIS 128           HD2      HIS 128  -9.207  16.037  17.714
  978    HE1  HIS 128           HE1      HIS 128  -5.127  17.194  17.768
  979    HE2  HIS 128           HE2      HIS 128  -6.836  15.573  18.657
  980    H    HIS 129           H        HIS 129 -11.716  16.265  13.299
  981    HA   HIS 129           HA       HIS 129 -12.940  16.869  11.501
  982   1HB   HIS 129          1HB       HIS 129 -12.039  19.662  12.224
  983   2HB   HIS 129          2HB       HIS 129 -13.226  19.298  10.975
  984    HD1  HIS 129           HD1      HIS 129 -15.585  18.629  11.735
  985    HD2  HIS 129           HD2      HIS 129 -12.929  19.285  14.870
  986    HE1  HIS 129           HE1      HIS 129 -16.998  18.733  13.818
  987    HE2  HIS 129           HE2      HIS 129 -15.383  19.285  15.673
  988    H    HIS 130           H        HIS 130 -10.235  19.184  11.214
  989    HA   HIS 130           HA       HIS 130  -9.232  17.598   8.963
  990   1HB   HIS 130          1HB       HIS 130  -9.684  20.587   8.884
  991   2HB   HIS 130          2HB       HIS 130  -8.752  19.692   7.691
  992    HD1  HIS 130           HD1      HIS 130 -12.168  20.696   8.570
  993    HD2  HIS 130           HD2      HIS 130 -10.351  17.875   6.107
  994    HE1  HIS 130           HE1      HIS 130 -13.957  19.926   6.979
  995    HE2  HIS 130           HE2      HIS 130 -12.791  18.361   5.386
  996    H    HIS 131           H        HIS 131  -8.163  20.807   9.941
  997    HA   HIS 131           HA       HIS 131  -6.240  19.936  11.835
  998   1HB   HIS 131          1HB       HIS 131  -5.263  19.160   9.573
  999   2HB   HIS 131          2HB       HIS 131  -4.983  20.869   9.257
 1000    HD1  HIS 131           HD1      HIS 131  -2.823  21.796  10.098
 1001    HD2  HIS 131           HD2      HIS 131  -3.877  18.257  12.023
 1002    HE1  HIS 131           HE1      HIS 131  -0.869  21.211  11.575
 1003    HE2  HIS 131           HE2      HIS 131  -1.569  19.131  12.815
 1004    H    HIS 132           H        HIS 132  -8.267  22.104  10.925
 1005    HA   HIS 132           HA       HIS 132  -6.612  24.467  11.403
 1006   1HB   HIS 132          1HB       HIS 132  -9.456  24.117  10.476
 1007   2HB   HIS 132          2HB       HIS 132  -8.872  25.669  11.064
 1008    HD1  HIS 132           HD1      HIS 132  -5.960  25.016   9.584
 1009    HD2  HIS 132           HD2      HIS 132  -9.760  25.318   7.923
 1010    HE1  HIS 132           HE1      HIS 132  -5.598  25.542   7.153
 1011    HE2  HIS 132           HE2      HIS 132  -7.904  25.514   6.132
  Start of MODEL   10
    1   1H    MET   1          1HT       MET   1  12.644  37.255 -15.735
    2   2H    MET   1          2HT       MET   1  13.499  36.872 -14.322
    3   3H    MET   1          3HT       MET   1  13.048  38.478 -14.628
    4    HA   MET   1           HA       MET   1  10.695  37.797 -14.517
    5   1HB   MET   1          1HB       MET   1  11.920  35.238 -13.457
    6   2HB   MET   1          2HB       MET   1  10.209  35.633 -13.434
    7   1HG   MET   1          1HG       MET   1  10.166  35.643 -15.868
    8   2HG   MET   1          2HG       MET   1  11.890  35.275 -15.902
    9   1HE   MET   1          1HE       MET   1   9.756  33.566 -17.492
   10   2HE   MET   1          2HE       MET   1  10.291  31.924 -17.132
   11   3HE   MET   1          3HE       MET   1  11.477  33.184 -17.474
   12    HA   PRO   2           HA       PRO   2  11.355  39.605 -10.507
   13   1HB   PRO   2          1HB       PRO   2   8.768  39.726  -9.683
   14   2HB   PRO   2          2HB       PRO   2   9.451  40.835 -10.878
   15   1HG   PRO   2          1HG       PRO   2   7.786  38.385 -11.305
   16   2HG   PRO   2          2HG       PRO   2   7.681  39.964 -12.105
   17   1HD   PRO   2          1HD       PRO   2   8.881  37.828 -13.253
   18   2HD   PRO   2          2HD       PRO   2   9.425  39.493 -13.538
   19    H    LEU   3           H        LEU   3   9.677  36.628 -11.020
   20    HA   LEU   3           HA       LEU   3  10.472  35.726  -8.337
   21   1HB   LEU   3          1HB       LEU   3   7.987  34.996  -9.900
   22   2HB   LEU   3          2HB       LEU   3   8.522  34.144  -8.464
   23    HG   LEU   3           HG       LEU   3   7.778  37.069  -8.520
   24   1HD1  LEU   3          1HD1      LEU   3   6.181  34.694  -7.573
   25   2HD1  LEU   3          2HD1      LEU   3   5.717  36.388  -7.417
   26   3HD1  LEU   3          3HD1      LEU   3   5.847  35.653  -9.015
   27   1HD2  LEU   3          1HD2      LEU   3   9.356  36.441  -6.750
   28   2HD2  LEU   3          2HD2      LEU   3   7.773  36.862  -6.095
   29   3HD2  LEU   3          3HD2      LEU   3   8.251  35.170  -6.223
   30    H    ASN   4           H        ASN   4  10.280  33.114  -8.480
   31    HA   ASN   4           HA       ASN   4  12.082  32.338 -10.616
   32   1HB   ASN   4          1HB       ASN   4  10.911  30.799  -8.290
   33   2HB   ASN   4          2HB       ASN   4  11.999  30.090  -9.478
   34   1HD2  ASN   4          2HD2      ASN   4  14.153  30.722  -9.523
   35   2HD2  ASN   4          1HD2      ASN   4  14.895  31.548  -8.188
   36    H    GLN   5           H        GLN   5  11.447  29.885 -11.379
   37    HA   GLN   5           HA       GLN   5   9.266  30.280 -13.133
   38   1HB   GLN   5          1HB       GLN   5  10.808  27.777 -12.455
   39   2HB   GLN   5          2HB       GLN   5   9.602  27.878 -13.732
   40   1HG   GLN   5          1HG       GLN   5  10.984  29.747 -14.715
   41   2HG   GLN   5          2HG       GLN   5  12.242  29.295 -13.566
   42   1HE2  GLN   5          2HE2      GLN   5  10.077  27.009 -15.075
   43   2HE2  GLN   5          1HE2      GLN   5  11.275  26.228 -16.055
   44    H    GLU   6           H        GLU   6   7.231  30.149 -12.717
   45    HA   GLU   6           HA       GLU   6   6.281  29.044 -10.225
   46   1HB   GLU   6          1HB       GLU   6   5.546  31.257 -11.105
   47   2HB   GLU   6          2HB       GLU   6   4.784  30.439 -12.458
   48   1HG   GLU   6          1HG       GLU   6   3.165  31.082 -10.764
   49   2HG   GLU   6          2HG       GLU   6   3.245  29.330 -10.950
   50    H    HIS   7           H        HIS   7   4.184  27.814 -10.283
   51    HA   HIS   7           HA       HIS   7   2.716  26.247 -11.021
   52   1HB   HIS   7          1HB       HIS   7   2.825  27.159 -13.297
   53   2HB   HIS   7          2HB       HIS   7   4.276  26.214 -13.611
   54    HD1  HIS   7           HD1      HIS   7   3.964  23.615 -13.886
   55    HD2  HIS   7           HD2      HIS   7   0.435  25.785 -13.508
   56    HE1  HIS   7           HE1      HIS   7   2.132  22.071 -14.649
   57    HE2  HIS   7           HE2      HIS   7   0.053  23.497 -14.642
   58    HA   PRO   8           HA       PRO   8   5.553  22.897  -9.766
   59   1HB   PRO   8          1HB       PRO   8   3.843  22.019  -7.826
   60   2HB   PRO   8          2HB       PRO   8   5.107  23.218  -7.533
   61   1HG   PRO   8          1HG       PRO   8   2.182  23.619  -7.988
   62   2HG   PRO   8          2HG       PRO   8   3.269  24.448  -6.857
   63   1HD   PRO   8          1HD       PRO   8   2.475  25.538  -9.218
   64   2HD   PRO   8          2HD       PRO   8   4.044  25.892  -8.469
   65    H    ASP   9           H        ASP   9   5.328  21.362 -11.265
   66    HA   ASP   9           HA       ASP   9   2.989  20.772 -12.647
   67   1HB   ASP   9          1HB       ASP   9   5.657  19.486 -12.413
   68   2HB   ASP   9          2HB       ASP   9   4.355  18.546 -13.139
   69    H    TYR  10           H        TYR  10   1.608  19.011 -12.675
   70    HA   TYR  10           HA       TYR  10   0.888  18.234  -9.975
   71   1HB   TYR  10          1HB       TYR  10  -0.568  17.829 -12.595
   72   2HB   TYR  10          2HB       TYR  10  -1.229  17.505 -10.996
   73    HD1  TYR  10           HD1      TYR  10  -0.367  20.083 -13.430
   74    HD2  TYR  10           HD2      TYR  10  -1.824  19.356  -9.499
   75    HE1  TYR  10           HE1      TYR  10  -1.167  22.404 -13.305
   76    HE2  TYR  10           HE2      TYR  10  -2.628  21.677  -9.363
   77    HH   TYR  10           HH       TYR  10  -2.717  23.760 -12.131
   78    H    THR  11           H        THR  11   2.921  16.911 -12.103
   79    HA   THR  11           HA       THR  11   2.165  14.180 -12.087
   80    HB   THR  11           HB       THR  11   4.930  15.396 -12.322
   81    HG1  THR  11           HG1      THR  11   4.377  15.819 -14.327
   82   1HG2  THR  11          1HG2      THR  11   5.534  13.281 -13.417
   83   2HG2  THR  11          2HG2      THR  11   5.016  13.015 -11.750
   84   3HG2  THR  11          3HG2      THR  11   3.921  12.649 -13.084
   85    H    TYR  12           H        TYR  12   2.239  12.748 -10.479
   86    HA   TYR  12           HA       TYR  12   2.720  13.564  -7.842
   87   1HB   TYR  12          1HB       TYR  12   2.440  10.777  -8.980
   88   2HB   TYR  12          2HB       TYR  12   2.387  11.173  -7.265
   89    HD1  TYR  12           HD1      TYR  12   0.475  10.832 -10.258
   90    HD2  TYR  12           HD2      TYR  12   0.579  12.826  -6.502
   91    HE1  TYR  12           HE1      TYR  12  -1.939  11.277 -10.433
   92    HE2  TYR  12           HE2      TYR  12  -1.830  13.275  -6.666
   93    HH   TYR  12           HH       TYR  12  -3.838  11.773  -8.983
   94    H    ALA  13           H        ALA  13   4.598  14.037  -7.012
   95    HA   ALA  13           HA       ALA  13   6.878  12.240  -7.529
   96   1HB   ALA  13          1HB       ALA  13   7.220  14.395  -8.634
   97   2HB   ALA  13          2HB       ALA  13   6.974  15.227  -7.099
   98   3HB   ALA  13          3HB       ALA  13   8.367  14.168  -7.316
   99    H    LEU  14           H        LEU  14   7.013  11.049  -5.741
  100    HA   LEU  14           HA       LEU  14   6.579  12.259  -3.125
  101   1HB   LEU  14          1HB       LEU  14   5.541  10.086  -3.615
  102   2HB   LEU  14          2HB       LEU  14   7.121   9.393  -3.918
  103    HG   LEU  14           HG       LEU  14   7.724   9.818  -1.546
  104   1HD1  LEU  14          1HD1      LEU  14   6.193  11.673  -1.122
  105   2HD1  LEU  14          2HD1      LEU  14   4.818  10.580  -1.279
  106   3HD1  LEU  14          3HD1      LEU  14   5.964  10.372   0.046
  107   1HD2  LEU  14          1HD2      LEU  14   5.243   8.163  -1.997
  108   2HD2  LEU  14          2HD2      LEU  14   6.908   7.636  -2.243
  109   3HD2  LEU  14          3HD2      LEU  14   6.335   8.022  -0.619
  110    H    ARG  15           H        ARG  15   8.278  13.272  -2.278
  111    HA   ARG  15           HA       ARG  15  10.934  12.054  -2.648
  112   1HB   ARG  15          1HB       ARG  15  10.730  14.277  -3.703
  113   2HB   ARG  15          2HB       ARG  15  10.293  14.966  -2.145
  114   1HG   ARG  15          1HG       ARG  15  12.496  14.251  -1.262
  115   2HG   ARG  15          2HG       ARG  15  12.924  13.702  -2.883
  116   1HD   ARG  15          1HD       ARG  15  12.174  16.527  -2.140
  117   2HD   ARG  15          2HD       ARG  15  13.819  15.939  -2.364
  118    HE   ARG  15           HE       ARG  15  12.269  15.406  -4.676
  119   1HH1  ARG  15          1HH1      ARG  15  13.867  18.015  -2.956
  120   2HH1  ARG  15          2HH1      ARG  15  14.065  18.995  -4.377
  121   1HH2  ARG  15          1HH2      ARG  15  12.567  16.685  -6.552
  122   2HH2  ARG  15          2HH2      ARG  15  13.333  18.241  -6.418
  123    H    ALA  16           H        ALA  16   9.047  14.044  -0.367
  124    HA   ALA  16           HA       ALA  16  10.837  13.339   1.792
  125   1HB   ALA  16          1HB       ALA  16   9.936  15.613   1.640
  126   2HB   ALA  16          2HB       ALA  16   8.306  14.976   1.849
  127   3HB   ALA  16          3HB       ALA  16   9.481  14.831   3.153
  128    H    ALA  17           H        ALA  17  10.662  11.384   2.615
  129    HA   ALA  17           HA       ALA  17   7.962  10.335   3.169
  130   1HB   ALA  17          1HB       ALA  17   9.096   9.025   1.454
  131   2HB   ALA  17          2HB       ALA  17  10.465   8.772   2.537
  132   3HB   ALA  17          3HB       ALA  17   8.889   8.083   2.931
  133    H    ASP  18           H        ASP  18   7.582  10.649   5.243
  134    HA   ASP  18           HA       ASP  18   9.647   9.843   7.188
  135   1HB   ASP  18          1HB       ASP  18   9.289  12.302   7.175
  136   2HB   ASP  18          2HB       ASP  18   7.579  12.045   7.489
  137    H    GLY  19           H        GLY  19   8.752   8.941   9.199
  138   1HA   GLY  19          1HA       GLY  19   6.668   7.084   8.704
  139   2HA   GLY  19          2HA       GLY  19   7.386   7.428  10.270
  140    H    ARG  20           H        ARG  20   6.654  10.339   9.822
  141    HA   ARG  20           HA       ARG  20   3.872  10.078  10.772
  142   1HB   ARG  20          1HB       ARG  20   5.841  12.306  11.308
  143   2HB   ARG  20          2HB       ARG  20   4.265  12.090  12.056
  144   1HG   ARG  20          1HG       ARG  20   5.003  10.480  13.474
  145   2HG   ARG  20          2HG       ARG  20   6.227   9.889  12.345
  146   1HD   ARG  20          1HD       ARG  20   6.358  12.472  13.899
  147   2HD   ARG  20          2HD       ARG  20   7.242  10.993  14.281
  148    HE   ARG  20           HE       ARG  20   7.902  11.580  11.669
  149   1HH1  ARG  20          1HH1      ARG  20   8.135  13.277  14.730
  150   2HH1  ARG  20          2HH1      ARG  20   9.563  14.156  14.282
  151   1HH2  ARG  20          1HH2      ARG  20   9.803  12.689  11.090
  152   2HH2  ARG  20          2HH2      ARG  20  10.527  13.800  12.219
  153    H    HIS  21           H        HIS  21   5.741  11.236   8.186
  154    HA   HIS  21           HA       HIS  21   3.513  12.924   7.292
  155   1HB   HIS  21          1HB       HIS  21   6.359  13.858   6.958
  156   2HB   HIS  21          2HB       HIS  21   4.883  14.761   6.666
  157    HD1  HIS  21           HD1      HIS  21   3.424  14.635   9.290
  158    HD2  HIS  21           HD2      HIS  21   7.556  15.011   9.041
  159    HE1  HIS  21           HE1      HIS  21   4.141  15.664  11.462
  160    HE2  HIS  21           HE2      HIS  21   6.614  16.064  11.203
  161    H    ALA  22           H        ALA  22   3.002  12.563   5.205
  162    HA   ALA  22           HA       ALA  22   5.133  11.571   3.423
  163   1HB   ALA  22          1HB       ALA  22   3.434  10.349   2.158
  164   2HB   ALA  22          2HB       ALA  22   3.470   9.816   3.839
  165   3HB   ALA  22          3HB       ALA  22   2.191  10.896   3.283
  166    H    LYS  23           H        LYS  23   5.659  13.087   1.967
  167    HA   LYS  23           HA       LYS  23   3.669  15.180   1.406
  168   1HB   LYS  23          1HB       LYS  23   5.757  15.960   2.443
  169   2HB   LYS  23          2HB       LYS  23   6.677  15.269   1.114
  170   1HG   LYS  23          1HG       LYS  23   5.476  16.806  -0.433
  171   2HG   LYS  23          2HG       LYS  23   4.725  17.558   0.974
  172   1HD   LYS  23          1HD       LYS  23   6.913  18.178   1.835
  173   2HD   LYS  23          2HD       LYS  23   7.694  17.376   0.472
  174   1HE   LYS  23          1HE       LYS  23   7.656  19.709  -0.003
  175   2HE   LYS  23          2HE       LYS  23   6.457  18.942  -1.042
  176   1HZ   LYS  23          1HZ       LYS  23   5.581  20.962  -0.100
  177   2HZ   LYS  23          2HZ       LYS  23   4.736  19.639   0.538
  178   3HZ   LYS  23          3HZ       LYS  23   5.911  20.424   1.475
  179    H    VAL  24           H        VAL  24   2.590  14.705  -0.383
  180    HA   VAL  24           HA       VAL  24   4.050  13.700  -2.721
  181    HB   VAL  24           HB       VAL  24   1.061  14.070  -2.393
  182   1HG1  VAL  24          1HG1      VAL  24   1.788  14.088  -4.713
  183   2HG1  VAL  24          2HG1      VAL  24   2.675  12.583  -4.464
  184   3HG1  VAL  24          3HG1      VAL  24   0.915  12.599  -4.353
  185   1HG2  VAL  24          1HG2      VAL  24   0.963  11.633  -2.097
  186   2HG2  VAL  24          2HG2      VAL  24   2.726  11.571  -2.094
  187   3HG2  VAL  24          3HG2      VAL  24   1.873  12.417  -0.804
  188    H    ASN  25           H        ASN  25   5.012  15.328  -3.737
  189    HA   ASN  25           HA       ASN  25   5.388  17.256  -4.861
  190   1HB   ASN  25          1HB       ASN  25   2.367  17.437  -4.947
  191   2HB   ASN  25          2HB       ASN  25   3.453  18.512  -5.819
  192   1HD2  ASN  25          2HD2      ASN  25   2.749  17.934  -7.835
  193   2HD2  ASN  25          1HD2      ASN  25   3.055  16.379  -8.526
  194    H    GLU  26           H        GLU  26   2.461  18.213  -3.116
  195    HA   GLU  26           HA       GLU  26   4.087  20.091  -1.541
  196   1HB   GLU  26          1HB       GLU  26   3.037  21.386  -3.295
  197   2HB   GLU  26          2HB       GLU  26   1.472  20.665  -2.943
  198   1HG   GLU  26          1HG       GLU  26   1.476  21.741  -0.746
  199   2HG   GLU  26          2HG       GLU  26   3.035  22.477  -1.118
  200    H    GLN  27           H        GLN  27   1.060  18.315  -1.859
  201    HA   GLN  27           HA       GLN  27   0.059  18.991   0.711
  202   1HB   GLN  27          1HB       GLN  27  -0.703  16.694  -1.101
  203   2HB   GLN  27          2HB       GLN  27  -1.640  17.285   0.263
  204   1HG   GLN  27          1HG       GLN  27  -2.009  19.394  -0.852
  205   2HG   GLN  27          2HG       GLN  27  -0.973  18.898  -2.189
  206   1HE2  GLN  27          2HE2      GLN  27  -3.244  16.775  -0.581
  207   2HE2  GLN  27          1HE2      GLN  27  -4.322  16.604  -1.923
  208    H    ILE  28           H        ILE  28   0.542  18.159   2.623
  209    HA   ILE  28           HA       ILE  28   2.119  15.694   2.740
  210    HB   ILE  28           HB       ILE  28   1.616  17.758   4.893
  211   1HG1  ILE  28          1HG1      ILE  28   4.081  17.160   3.237
  212   2HG1  ILE  28          2HG1      ILE  28   3.063  18.589   3.093
  213   1HG2  ILE  28          1HG2      ILE  28   3.409  15.329   4.902
  214   2HG2  ILE  28          2HG2      ILE  28   3.331  16.551   6.170
  215   3HG2  ILE  28          3HG2      ILE  28   1.929  15.534   5.841
  216   1HD1  ILE  28          1HD1      ILE  28   4.734  17.829   5.480
  217   2HD1  ILE  28          2HD1      ILE  28   5.094  19.094   4.303
  218   3HD1  ILE  28          3HD1      ILE  28   3.693  19.250   5.363
  219    H    LEU  29           H        LEU  29   0.863  13.970   2.826
  220    HA   LEU  29           HA       LEU  29  -1.676  14.071   4.258
  221   1HB   LEU  29          1HB       LEU  29  -0.457  11.876   2.573
  222   2HB   LEU  29          2HB       LEU  29  -2.071  11.856   3.258
  223    HG   LEU  29           HG       LEU  29  -1.090  13.833   1.193
  224   1HD1  LEU  29          1HD1      LEU  29  -2.571  12.640  -0.341
  225   2HD1  LEU  29          2HD1      LEU  29  -1.295  11.589   0.272
  226   3HD1  LEU  29          3HD1      LEU  29  -2.929  11.461   0.920
  227   1HD2  LEU  29          1HD2      LEU  29  -2.810  14.754   2.670
  228   2HD2  LEU  29          2HD2      LEU  29  -3.430  14.499   1.039
  229   3HD2  LEU  29          3HD2      LEU  29  -3.846  13.369   2.329
  230    H    GLN  30           H        GLN  30  -2.023  13.093   6.163
  231    HA   GLN  30           HA       GLN  30   0.181  11.514   7.305
  232   1HB   GLN  30          1HB       GLN  30  -1.478  13.608   8.726
  233   2HB   GLN  30          2HB       GLN  30  -0.243  12.602   9.474
  234   1HG   GLN  30          1HG       GLN  30   1.449  13.603   8.016
  235   2HG   GLN  30          2HG       GLN  30   0.211  14.621   7.288
  236   1HE2  GLN  30          2HE2      GLN  30  -0.648  16.326   8.471
  237   2HE2  GLN  30          1HE2      GLN  30   0.121  16.935   9.893
  238    H    GLN  31           H        GLN  31  -2.235  10.642   5.998
  239    HA   GLN  31           HA       GLN  31  -3.322   9.023   8.182
  240   1HB   GLN  31          1HB       GLN  31  -4.956  10.385   6.027
  241   2HB   GLN  31          2HB       GLN  31  -5.580   9.137   7.097
  242   1HG   GLN  31          1HG       GLN  31  -5.087  10.572   9.027
  243   2HG   GLN  31          2HG       GLN  31  -4.533  11.831   7.927
  244   1HE2  GLN  31          2HE2      GLN  31  -6.083  13.279   8.633
  245   2HE2  GLN  31          1HE2      GLN  31  -7.758  13.117   8.244
  246    H    SER  32           H        SER  32  -5.080   7.529   6.472
  247    HA   SER  32           HA       SER  32  -3.042   5.965   5.083
  248   1HB   SER  32          1HB       SER  32  -5.909   5.207   5.681
  249   2HB   SER  32          2HB       SER  32  -4.595   4.129   5.206
  250    HG   SER  32           HG       SER  32  -4.625   5.677   7.588
  251    H    PHE  33           H        PHE  33  -2.830   6.129   2.943
  252    HA   PHE  33           HA       PHE  33  -5.206   6.508   1.284
  253   1HB   PHE  33          1HB       PHE  33  -4.164   8.281  -0.040
  254   2HB   PHE  33          2HB       PHE  33  -4.312   8.779   1.639
  255    HD1  PHE  33           HD1      PHE  33  -2.284   8.790   3.095
  256    HD2  PHE  33           HD2      PHE  33  -2.068   8.157  -1.109
  257    HE1  PHE  33           HE1      PHE  33   0.111   9.350   3.137
  258    HE2  PHE  33           HE2      PHE  33   0.327   8.713  -1.073
  259    HZ   PHE  33           HZ       PHE  33   1.420   9.311   1.051
  260    H    ILE  34           H        ILE  34  -4.542   6.286  -1.138
  261    HA   ILE  34           HA       ILE  34  -2.470   4.173  -1.289
  262    HB   ILE  34           HB       ILE  34  -4.906   4.234  -3.063
  263   1HG1  ILE  34          1HG1      ILE  34  -4.546   2.524  -0.597
  264   2HG1  ILE  34          2HG1      ILE  34  -5.536   3.979  -0.635
  265   1HG2  ILE  34          1HG2      ILE  34  -3.003   2.995  -3.911
  266   2HG2  ILE  34          2HG2      ILE  34  -2.905   2.082  -2.405
  267   3HG2  ILE  34          3HG2      ILE  34  -4.303   1.890  -3.463
  268   1HD1  ILE  34          1HD1      ILE  34  -6.912   2.017  -0.873
  269   2HD1  ILE  34          2HD1      ILE  34  -6.938   2.956  -2.365
  270   3HD1  ILE  34          3HD1      ILE  34  -5.965   1.488  -2.265
  271    H    LEU  35           H        LEU  35  -0.857   4.637  -2.628
  272    HA   LEU  35           HA       LEU  35  -1.316   6.697  -4.684
  273   1HB   LEU  35          1HB       LEU  35   0.299   7.370  -2.985
  274   2HB   LEU  35          2HB       LEU  35   1.238   5.919  -3.273
  275    HG   LEU  35           HG       LEU  35   1.726   6.712  -5.566
  276   1HD1  LEU  35          1HD1      LEU  35   0.312   9.221  -4.676
  277   2HD1  LEU  35          2HD1      LEU  35   1.226   9.026  -6.172
  278   3HD1  LEU  35          3HD1      LEU  35  -0.250   8.095  -5.913
  279   1HD2  LEU  35          1HD2      LEU  35   3.294   7.156  -3.757
  280   2HD2  LEU  35          2HD2      LEU  35   3.279   8.486  -4.916
  281   3HD2  LEU  35          3HD2      LEU  35   2.443   8.652  -3.373
  282    H    MET  36           H        MET  36  -1.118   6.152  -6.742
  283    HA   MET  36           HA       MET  36   0.596   3.882  -7.458
  284   1HB   MET  36          1HB       MET  36  -2.200   4.402  -8.496
  285   2HB   MET  36          2HB       MET  36  -1.069   3.291  -9.253
  286   1HG   MET  36          1HG       MET  36  -0.997   2.012  -7.124
  287   2HG   MET  36          2HG       MET  36  -2.264   3.068  -6.503
  288   1HE   MET  36          1HE       MET  36  -3.813   0.993  -5.973
  289   2HE   MET  36          2HE       MET  36  -2.553  -0.093  -6.559
  290   3HE   MET  36          3HE       MET  36  -4.207  -0.264  -7.146
  291    HA   PRO  37           HA       PRO  37   2.146   6.690 -10.538
  292   1HB   PRO  37          1HB       PRO  37   2.787   4.984 -12.556
  293   2HB   PRO  37          2HB       PRO  37   3.741   5.127 -11.075
  294   1HG   PRO  37          1HG       PRO  37   1.685   3.083 -11.815
  295   2HG   PRO  37          2HG       PRO  37   3.256   2.855 -11.024
  296   1HD   PRO  37          1HD       PRO  37   0.924   2.879  -9.650
  297   2HD   PRO  37          2HD       PRO  37   2.444   3.479  -8.956
  298    H    ASP  38           H        ASP  38  -0.748   5.156 -10.806
  299    HA   ASP  38           HA       ASP  38  -1.335   6.206 -13.486
  300   1HB   ASP  38          1HB       ASP  38  -1.835   3.813 -13.132
  301   2HB   ASP  38          2HB       ASP  38  -2.903   4.240 -11.800
  302    H    GLU  39           H        GLU  39  -2.755   5.969 -10.228
  303    HA   GLU  39           HA       GLU  39  -3.681   8.712 -10.441
  304   1HB   GLU  39          1HB       GLU  39  -5.970   8.212  -9.850
  305   2HB   GLU  39          2HB       GLU  39  -5.558   7.327 -11.310
  306   1HG   GLU  39          1HG       GLU  39  -5.265   5.292 -10.027
  307   2HG   GLU  39          2HG       GLU  39  -5.597   6.166  -8.533
  308    H    LEU  40           H        LEU  40  -4.623   9.439  -8.315
  309    HA   LEU  40           HA       LEU  40  -3.278   8.051  -6.087
  310   1HB   LEU  40          1HB       LEU  40  -2.384  10.264  -6.371
  311   2HB   LEU  40          2HB       LEU  40  -3.990  10.960  -6.464
  312    HG   LEU  40           HG       LEU  40  -4.362  10.364  -4.087
  313   1HD1  LEU  40          1HD1      LEU  40  -1.462   9.547  -4.157
  314   2HD1  LEU  40          2HD1      LEU  40  -2.452   9.705  -2.707
  315   3HD1  LEU  40          3HD1      LEU  40  -2.841   8.477  -3.911
  316   1HD2  LEU  40          1HD2      LEU  40  -2.870  12.069  -3.150
  317   2HD2  LEU  40          2HD2      LEU  40  -1.916  12.040  -4.632
  318   3HD2  LEU  40          3HD2      LEU  40  -3.591  12.591  -4.673
  319    H    VAL  41           H        VAL  41  -4.573   7.067  -4.677
  320    HA   VAL  41           HA       VAL  41  -7.419   7.638  -4.698
  321    HB   VAL  41           HB       VAL  41  -5.928   5.699  -2.928
  322   1HG1  VAL  41          1HG1      VAL  41  -8.122   6.313  -2.076
  323   2HG1  VAL  41          2HG1      VAL  41  -8.853   5.914  -3.632
  324   3HG1  VAL  41          3HG1      VAL  41  -8.124   4.645  -2.645
  325   1HG2  VAL  41          1HG2      VAL  41  -5.575   5.124  -5.267
  326   2HG2  VAL  41          2HG2      VAL  41  -6.657   3.959  -4.503
  327   3HG2  VAL  41          3HG2      VAL  41  -7.312   5.207  -5.564
  328    H    GLU  42           H        GLU  42  -7.668   9.600  -3.873
  329    HA   GLU  42           HA       GLU  42  -6.416  10.436  -1.402
  330   1HB   GLU  42          1HB       GLU  42  -6.695  12.021  -3.246
  331   2HB   GLU  42          2HB       GLU  42  -8.431  11.761  -3.233
  332   1HG   GLU  42          1HG       GLU  42  -8.509  12.715  -0.950
  333   2HG   GLU  42          2HG       GLU  42  -6.787  13.072  -1.083
  334    H    HIS  43           H        HIS  43  -9.447   9.201  -2.558
  335    HA   HIS  43           HA       HIS  43 -10.683   9.650   0.064
  336   1HB   HIS  43          1HB       HIS  43 -11.931   8.796  -2.555
  337   2HB   HIS  43          2HB       HIS  43 -12.807   9.007  -1.042
  338    HD1  HIS  43           HD1      HIS  43 -12.368  10.700  -4.043
  339    HD2  HIS  43           HD2      HIS  43 -12.107  11.879  -0.064
  340    HE1  HIS  43           HE1      HIS  43 -12.670  13.200  -4.053
  341    HE2  HIS  43           HE2      HIS  43 -12.331  13.906  -1.653
  342    H    TRP  44           H        TRP  44  -9.581   8.039   1.187
  343    HA   TRP  44           HA       TRP  44 -10.573   5.337   0.572
  344   1HB   TRP  44          1HB       TRP  44  -8.036   5.712   0.368
  345   2HB   TRP  44          2HB       TRP  44  -8.036   5.900   2.118
  346    HD1  TRP  44           HD1      TRP  44 -10.225   3.253   0.414
  347    HE1  TRP  44           HE1      TRP  44  -9.377   0.917   1.083
  348    HE3  TRP  44           HE3      TRP  44  -5.948   4.616   2.863
  349    HZ2  TRP  44           HZ2      TRP  44  -7.175  -0.197   2.452
  350    HZ3  TRP  44           HZ3      TRP  44  -4.524   2.852   3.815
  351    HH2  TRP  44           HH2      TRP  44  -5.124   0.495   3.613
  352    HA   PRO  45           HA       PRO  45 -12.789   6.082   4.353
  353   1HB   PRO  45          1HB       PRO  45 -13.521   3.244   4.178
  354   2HB   PRO  45          2HB       PRO  45 -14.548   4.676   4.079
  355   1HG   PRO  45          1HG       PRO  45 -14.048   3.155   1.930
  356   2HG   PRO  45          2HG       PRO  45 -14.222   4.917   1.806
  357   1HD   PRO  45          1HD       PRO  45 -11.723   3.260   1.875
  358   2HD   PRO  45          2HD       PRO  45 -12.134   4.631   0.821
  359    H    VAL  46           H        VAL  46  -9.956   5.297   4.606
  360    HA   VAL  46           HA       VAL  46 -10.181   3.789   7.126
  361    HB   VAL  46           HB       VAL  46  -7.919   3.540   5.128
  362   1HG1  VAL  46          1HG1      VAL  46  -7.122   3.373   7.417
  363   2HG1  VAL  46          2HG1      VAL  46  -8.354   2.162   7.775
  364   3HG1  VAL  46          3HG1      VAL  46  -7.065   1.796   6.627
  365   1HG2  VAL  46          1HG2      VAL  46  -8.667   1.228   4.855
  366   2HG2  VAL  46          2HG2      VAL  46 -10.028   1.540   5.934
  367   3HG2  VAL  46          3HG2      VAL  46  -9.925   2.372   4.383
  368    HA   PRO  47           HA       PRO  47  -8.212   7.721   8.310
  369   1HB   PRO  47          1HB       PRO  47  -8.916   6.778  11.002
  370   2HB   PRO  47          2HB       PRO  47  -9.371   8.277  10.190
  371   1HG   PRO  47          1HG       PRO  47 -11.150   6.311  10.654
  372   2HG   PRO  47          2HG       PRO  47 -11.235   7.338   9.213
  373   1HD   PRO  47          1HD       PRO  47 -10.190   4.546   9.493
  374   2HD   PRO  47          2HD       PRO  47 -11.168   5.258   8.190
  375    H    SER  48           H        SER  48  -7.958   4.656  10.098
  376    HA   SER  48           HA       SER  48  -5.059   4.872  10.027
  377   1HB   SER  48          1HB       SER  48  -4.901   4.335  12.459
  378   2HB   SER  48          2HB       SER  48  -5.616   5.918  12.151
  379    HG   SER  48           HG       SER  48  -7.140   5.183  13.416
  380    H    LEU  49           H        LEU  49  -4.037   2.824  10.799
  381    HA   LEU  49           HA       LEU  49  -5.094   0.619   9.410
  382   1HB   LEU  49          1HB       LEU  49  -2.702   0.994   9.773
  383   2HB   LEU  49          2HB       LEU  49  -2.913   0.755  11.494
  384    HG   LEU  49           HG       LEU  49  -3.587  -1.600  11.037
  385   1HD1  LEU  49          1HD1      LEU  49  -4.368  -1.336   8.755
  386   2HD1  LEU  49          2HD1      LEU  49  -2.736  -0.930   8.226
  387   3HD1  LEU  49          3HD1      LEU  49  -3.087  -2.546   8.838
  388   1HD2  LEU  49          1HD2      LEU  49  -1.308  -1.045  11.683
  389   2HD2  LEU  49          2HD2      LEU  49  -1.327  -2.388  10.539
  390   3HD2  LEU  49          3HD2      LEU  49  -0.884  -0.771   9.993
  391    H    GLY  50           H        GLY  50  -5.882   1.815  12.455
  392   1HA   GLY  50          1HA       GLY  50  -6.146  -0.527  13.993
  393   2HA   GLY  50          2HA       GLY  50  -6.965   0.994  14.295
  394    H    GLN  51           H        GLN  51  -8.188   0.737  11.480
  395    HA   GLN  51           HA       GLN  51 -10.193  -1.292  12.219
  396   1HB   GLN  51          1HB       GLN  51 -11.957   0.163  11.343
  397   2HB   GLN  51          2HB       GLN  51 -11.098   0.924  12.672
  398   1HG   GLN  51          1HG       GLN  51  -9.896   2.343  11.161
  399   2HG   GLN  51          2HG       GLN  51 -10.567   1.495   9.766
  400   1HE2  GLN  51          2HE2      GLN  51 -11.202   3.754  12.329
  401   2HE2  GLN  51          1HE2      GLN  51 -12.696   4.353  11.704
  402    H    LEU  52           H        LEU  52  -7.916  -1.553  10.393
  403    HA   LEU  52           HA       LEU  52  -8.969  -1.430   7.731
  404   1HB   LEU  52          1HB       LEU  52  -6.542  -1.288   8.204
  405   2HB   LEU  52          2HB       LEU  52  -6.567  -2.962   8.730
  406    HG   LEU  52           HG       LEU  52  -7.242  -3.664   6.467
  407   1HD1  LEU  52          1HD1      LEU  52  -6.925  -0.746   5.774
  408   2HD1  LEU  52          2HD1      LEU  52  -7.168  -2.057   4.619
  409   3HD1  LEU  52          3HD1      LEU  52  -8.434  -1.660   5.782
  410   1HD2  LEU  52          1HD2      LEU  52  -4.878  -3.629   7.025
  411   2HD2  LEU  52          2HD2      LEU  52  -5.120  -3.181   5.336
  412   3HD2  LEU  52          3HD2      LEU  52  -4.771  -1.937   6.536
  413    H    GLN  53           H        GLN  53 -10.454  -2.705   6.985
  414    HA   GLN  53           HA       GLN  53 -10.414  -5.561   7.598
  415   1HB   GLN  53          1HB       GLN  53 -12.905  -5.504   7.903
  416   2HB   GLN  53          2HB       GLN  53 -12.005  -4.710   9.188
  417   1HG   GLN  53          1HG       GLN  53 -12.485  -2.536   8.169
  418   2HG   GLN  53          2HG       GLN  53 -13.407  -3.343   6.902
  419   1HE2  GLN  53          2HE2      GLN  53 -13.451  -4.421  10.221
  420   2HE2  GLN  53          1HE2      GLN  53 -15.074  -3.939  10.559
  421    HA   PRO  54           HA       PRO  54 -11.223  -6.401   3.355
  422   1HB   PRO  54          1HB       PRO  54 -13.857  -7.569   4.143
  423   2HB   PRO  54          2HB       PRO  54 -12.590  -8.245   3.113
  424   1HG   PRO  54          1HG       PRO  54 -12.876  -9.093   5.610
  425   2HG   PRO  54          2HG       PRO  54 -11.260  -8.845   4.920
  426   1HD   PRO  54          1HD       PRO  54 -12.762  -7.176   6.882
  427   2HD   PRO  54          2HD       PRO  54 -11.017  -7.480   6.757
  428    H    ALA  55           H        ALA  55 -14.061  -5.146   5.086
  429    HA   ALA  55           HA       ALA  55 -15.504  -4.203   2.886
  430   1HB   ALA  55          1HB       ALA  55 -15.428  -3.056   5.672
  431   2HB   ALA  55          2HB       ALA  55 -16.692  -2.788   4.470
  432   3HB   ALA  55          3HB       ALA  55 -16.437  -4.400   5.138
  433    H    HIS  56           H        HIS  56 -12.562  -3.029   4.168
  434    HA   HIS  56           HA       HIS  56 -12.918  -0.511   2.676
  435   1HB   HIS  56          1HB       HIS  56 -11.204  -1.033   5.109
  436   2HB   HIS  56          2HB       HIS  56 -11.155   0.449   4.164
  437    HD1  HIS  56           HD1      HIS  56 -14.130   1.030   3.816
  438    HD2  HIS  56           HD2      HIS  56 -12.441  -0.269   7.395
  439    HE1  HIS  56           HE1      HIS  56 -15.699   1.795   5.632
  440    HE2  HIS  56           HE2      HIS  56 -14.635   1.049   7.794
  441    H    MET  57           H        MET  57 -11.142  -3.412   2.947
  442    HA   MET  57           HA       MET  57  -8.819  -2.354   1.532
  443   1HB   MET  57          1HB       MET  57  -8.575  -3.955   3.448
  444   2HB   MET  57          2HB       MET  57  -9.339  -5.186   2.453
  445   1HG   MET  57          1HG       MET  57  -6.976  -5.506   2.375
  446   2HG   MET  57          2HG       MET  57  -7.509  -4.915   0.805
  447   1HE   MET  57          1HE       MET  57  -3.927  -3.354   1.219
  448   2HE   MET  57          2HE       MET  57  -4.961  -4.378   0.222
  449   3HE   MET  57          3HE       MET  57  -4.456  -4.924   1.822
  450    H    ASP  58           H        ASP  58 -11.781  -3.839   0.851
  451    HA   ASP  58           HA       ASP  58 -11.230  -5.560  -1.250
  452   1HB   ASP  58          1HB       ASP  58 -13.442  -5.366  -0.205
  453   2HB   ASP  58          2HB       ASP  58 -13.644  -3.768  -0.914
  454    H    ALA  59           H        ALA  59 -11.780  -2.058  -1.340
  455    HA   ALA  59           HA       ALA  59 -11.751  -1.713  -4.107
  456   1HB   ALA  59          1HB       ALA  59 -12.435   0.029  -2.526
  457   2HB   ALA  59          2HB       ALA  59 -10.758   0.213  -2.011
  458   3HB   ALA  59          3HB       ALA  59 -11.222   0.616  -3.664
  459    H    VAL  60           H        VAL  60  -9.088  -1.897  -1.807
  460    HA   VAL  60           HA       VAL  60  -7.034  -1.014  -3.535
  461    HB   VAL  60           HB       VAL  60  -6.681  -2.986  -1.276
  462   1HG1  VAL  60          1HG1      VAL  60  -4.488  -1.918  -1.046
  463   2HG1  VAL  60          2HG1      VAL  60  -4.713  -2.614  -2.651
  464   3HG1  VAL  60          3HG1      VAL  60  -4.859  -0.872  -2.417
  465   1HG2  VAL  60          1HG2      VAL  60  -6.410  -1.055   0.220
  466   2HG2  VAL  60          2HG2      VAL  60  -6.900   0.015  -1.092
  467   3HG2  VAL  60          3HG2      VAL  60  -8.041  -1.160  -0.442
  468    H    LEU  61           H        LEU  61  -8.380  -4.172  -2.800
  469    HA   LEU  61           HA       LEU  61  -6.486  -5.611  -4.407
  470   1HB   LEU  61          1HB       LEU  61  -9.132  -6.506  -3.261
  471   2HB   LEU  61          2HB       LEU  61  -7.876  -7.553  -3.895
  472    HG   LEU  61           HG       LEU  61  -7.553  -5.771  -1.481
  473   1HD1  LEU  61          1HD1      LEU  61  -8.038  -8.739  -1.637
  474   2HD1  LEU  61          2HD1      LEU  61  -7.690  -7.821  -0.173
  475   3HD1  LEU  61          3HD1      LEU  61  -9.184  -7.528  -1.062
  476   1HD2  LEU  61          1HD2      LEU  61  -5.806  -7.960  -2.597
  477   2HD2  LEU  61          2HD2      LEU  61  -5.459  -6.231  -2.635
  478   3HD2  LEU  61          3HD2      LEU  61  -5.527  -7.082  -1.093
  479    H    ALA  62           H        ALA  62  -9.706  -4.300  -4.817
  480    HA   ALA  62           HA       ALA  62 -10.376  -5.632  -7.219
  481   1HB   ALA  62          1HB       ALA  62 -12.044  -4.545  -5.805
  482   2HB   ALA  62          2HB       ALA  62 -11.348  -2.969  -6.188
  483   3HB   ALA  62          3HB       ALA  62 -12.108  -3.930  -7.456
  484    H    LEU  63           H        LEU  63  -8.381  -2.873  -6.539
  485    HA   LEU  63           HA       LEU  63  -8.364  -1.760  -9.154
  486   1HB   LEU  63          1HB       LEU  63  -6.377  -1.550  -6.896
  487   2HB   LEU  63          2HB       LEU  63  -6.275  -0.620  -8.378
  488    HG   LEU  63           HG       LEU  63  -8.554  -0.486  -6.400
  489   1HD1  LEU  63          1HD1      LEU  63  -7.674   1.729  -5.861
  490   2HD1  LEU  63          2HD1      LEU  63  -6.506   0.461  -5.489
  491   3HD1  LEU  63          3HD1      LEU  63  -6.305   1.447  -6.937
  492   1HD2  LEU  63          1HD2      LEU  63  -9.285   1.437  -7.711
  493   2HD2  LEU  63          2HD2      LEU  63  -7.965   1.171  -8.850
  494   3HD2  LEU  63          3HD2      LEU  63  -9.252  -0.025  -8.695
  495    H    ASN  64           H        ASN  64  -7.139  -4.632  -7.996
  496    HA   ASN  64           HA       ASN  64  -5.895  -6.289  -8.886
  497   1HB   ASN  64          1HB       ASN  64  -7.282  -5.811 -10.891
  498   2HB   ASN  64          2HB       ASN  64  -6.032  -4.713 -11.464
  499   1HD2  ASN  64          2HD2      ASN  64  -6.904  -8.034 -10.901
  500   2HD2  ASN  64          1HD2      ASN  64  -5.618  -8.732 -11.825
  501    HA   PRO  65           HA       PRO  65  -1.789  -4.386  -8.804
  502   1HB   PRO  65          1HB       PRO  65  -1.196  -4.786  -6.205
  503   2HB   PRO  65          2HB       PRO  65  -2.095  -3.371  -6.756
  504   1HG   PRO  65          1HG       PRO  65  -3.032  -5.672  -5.205
  505   2HG   PRO  65          2HG       PRO  65  -3.796  -4.093  -5.438
  506   1HD   PRO  65          1HD       PRO  65  -4.326  -6.608  -6.814
  507   2HD   PRO  65          2HD       PRO  65  -5.249  -5.092  -6.864
  508    H    ALA  66           H        ALA  66   0.252  -5.504  -8.539
  509    HA   ALA  66           HA       ALA  66  -0.024  -8.428  -8.402
  510   1HB   ALA  66          1HB       ALA  66   2.273  -6.752  -9.421
  511   2HB   ALA  66          2HB       ALA  66   2.183  -8.513  -9.462
  512   3HB   ALA  66          3HB       ALA  66   1.055  -7.550 -10.416
  513    H    VAL  67           H        VAL  67   1.668  -5.679  -7.057
  514    HA   VAL  67           HA       VAL  67   2.239  -7.245  -4.659
  515    HB   VAL  67           HB       VAL  67   4.340  -7.286  -5.870
  516   1HG1  VAL  67          1HG1      VAL  67   4.156  -4.278  -5.972
  517   2HG1  VAL  67          2HG1      VAL  67   5.536  -5.245  -6.492
  518   3HG1  VAL  67          3HG1      VAL  67   3.995  -5.377  -7.342
  519   1HG2  VAL  67          1HG2      VAL  67   5.809  -6.189  -4.242
  520   2HG2  VAL  67          2HG2      VAL  67   4.431  -5.285  -3.617
  521   3HG2  VAL  67          3HG2      VAL  67   4.479  -7.040  -3.455
  522    H    ILE  68           H        ILE  68   1.855  -6.141  -2.808
  523    HA   ILE  68           HA       ILE  68   1.114  -3.301  -3.100
  524    HB   ILE  68           HB       ILE  68  -0.003  -5.316  -1.139
  525   1HG1  ILE  68          1HG1      ILE  68  -1.304  -3.936  -3.500
  526   2HG1  ILE  68          2HG1      ILE  68  -0.825  -5.629  -3.444
  527   1HG2  ILE  68          1HG2      ILE  68  -1.546  -3.516  -0.490
  528   2HG2  ILE  68          2HG2      ILE  68   0.135  -3.096  -0.160
  529   3HG2  ILE  68          3HG2      ILE  68  -0.688  -2.407  -1.559
  530   1HD1  ILE  68          1HD1      ILE  68  -3.215  -5.365  -3.098
  531   2HD1  ILE  68          2HD1      ILE  68  -2.436  -6.031  -1.663
  532   3HD1  ILE  68          3HD1      ILE  68  -2.907  -4.332  -1.702
  533    H    LEU  69           H        LEU  69   2.369  -1.940  -2.066
  534    HA   LEU  69           HA       LEU  69   4.103  -2.908   0.080
  535   1HB   LEU  69          1HB       LEU  69   4.053  -0.257  -1.371
  536   2HB   LEU  69          2HB       LEU  69   5.217  -0.713  -0.143
  537    HG   LEU  69           HG       LEU  69   4.897  -2.067  -2.823
  538   1HD1  LEU  69          1HD1      LEU  69   7.024  -0.197  -1.796
  539   2HD1  LEU  69          2HD1      LEU  69   7.050  -1.040  -3.343
  540   3HD1  LEU  69          3HD1      LEU  69   5.815   0.179  -3.023
  541   1HD2  LEU  69          1HD2      LEU  69   6.962  -3.233  -2.224
  542   2HD2  LEU  69          2HD2      LEU  69   6.939  -2.463  -0.638
  543   3HD2  LEU  69          3HD2      LEU  69   5.667  -3.599  -1.084
  544    H    LEU  70           H        LEU  70   3.141  -2.896   1.993
  545    HA   LEU  70           HA       LEU  70   1.169  -0.824   2.596
  546   1HB   LEU  70          1HB       LEU  70   0.524  -3.163   2.965
  547   2HB   LEU  70          2HB       LEU  70   1.875  -3.369   4.061
  548    HG   LEU  70           HG       LEU  70   0.859  -1.712   5.596
  549   1HD1  LEU  70          1HD1      LEU  70  -1.451  -1.010   5.247
  550   2HD1  LEU  70          2HD1      LEU  70  -0.403  -0.426   3.954
  551   3HD1  LEU  70          3HD1      LEU  70  -1.463  -1.808   3.674
  552   1HD2  LEU  70          1HD2      LEU  70  -0.956  -3.152   6.380
  553   2HD2  LEU  70          2HD2      LEU  70  -0.935  -4.019   4.844
  554   3HD2  LEU  70          3HD2      LEU  70   0.461  -4.095   5.919
  555    H    GLY  71           H        GLY  71   2.115   0.961   3.331
  556   1HA   GLY  71          1HA       GLY  71   4.366   0.784   5.186
  557   2HA   GLY  71          2HA       GLY  71   3.697   2.257   4.490
  558    H    THR  72           H        THR  72   4.092   0.768   7.325
  559    HA   THR  72           HA       THR  72   1.451   1.520   8.375
  560    HB   THR  72           HB       THR  72   2.096   0.177  10.366
  561    HG1  THR  72           HG1      THR  72   4.114  -0.370  10.569
  562   1HG2  THR  72          1HG2      THR  72   0.808  -0.852   8.556
  563   2HG2  THR  72          2HG2      THR  72   2.306  -1.294   7.736
  564   3HG2  THR  72          3HG2      THR  72   1.908  -2.018   9.292
  565    H    GLY  73           H        GLY  73   3.450   3.496   7.734
  566   1HA   GLY  73          1HA       GLY  73   4.436   5.359   8.635
  567   2HA   GLY  73          2HA       GLY  73   3.491   5.042  10.081
  568    H    GLU  74           H        GLU  74   4.452   4.182  11.835
  569    HA   GLU  74           HA       GLU  74   7.278   3.381  11.624
  570   1HB   GLU  74          1HB       GLU  74   6.086   4.967  13.904
  571   2HB   GLU  74          2HB       GLU  74   7.773   4.518  13.700
  572   1HG   GLU  74          1HG       GLU  74   7.927   5.960  11.743
  573   2HG   GLU  74          2HG       GLU  74   6.230   6.403  11.931
  574    H    ARG  75           H        ARG  75   4.168   2.591  12.547
  575    HA   ARG  75           HA       ARG  75   4.970   0.970  14.854
  576   1HB   ARG  75          1HB       ARG  75   2.201   1.610  13.804
  577   2HB   ARG  75          2HB       ARG  75   2.549   0.679  15.247
  578   1HG   ARG  75          1HG       ARG  75   1.917   2.817  15.988
  579   2HG   ARG  75          2HG       ARG  75   3.671   2.753  16.166
  580   1HD   ARG  75          1HD       ARG  75   4.019   4.133  14.301
  581   2HD   ARG  75          2HD       ARG  75   2.379   3.888  13.706
  582    HE   ARG  75           HE       ARG  75   1.650   5.228  15.692
  583   1HH1  ARG  75          1HH1      ARG  75   4.923   5.530  14.515
  584   2HH1  ARG  75          2HH1      ARG  75   5.069   7.216  14.891
  585   1HH2  ARG  75          1HH2      ARG  75   1.810   7.460  16.213
  586   2HH2  ARG  75          2HH2      ARG  75   3.286   8.309  15.884
  587    H    GLN  76           H        GLN  76   5.474  -1.109  14.446
  588    HA   GLN  76           HA       GLN  76   4.612  -2.355  11.999
  589   1HB   GLN  76          1HB       GLN  76   6.842  -2.837  12.993
  590   2HB   GLN  76          2HB       GLN  76   6.037  -3.619  14.349
  591   1HG   GLN  76          1HG       GLN  76   5.059  -5.258  12.826
  592   2HG   GLN  76          2HG       GLN  76   5.867  -4.478  11.468
  593   1HE2  GLN  76          2HE2      GLN  76   8.102  -4.692  11.245
  594   2HE2  GLN  76          1HE2      GLN  76   8.984  -5.927  12.074
  595    H    GLN  77           H        GLN  77   2.432  -2.536  12.023
  596    HA   GLN  77           HA       GLN  77   1.314  -4.389  14.017
  597   1HB   GLN  77          1HB       GLN  77  -0.072  -2.004  12.768
  598   2HB   GLN  77          2HB       GLN  77  -0.836  -3.180  13.829
  599   1HG   GLN  77          1HG       GLN  77   0.651  -2.506  15.646
  600   2HG   GLN  77          2HG       GLN  77   1.419  -1.332  14.579
  601   1HE2  GLN  77          2HE2      GLN  77  -1.417  -2.114  16.421
  602   2HE2  GLN  77          1HE2      GLN  77  -2.153  -0.551  16.322
  603    H    PHE  78           H        PHE  78  -0.333  -5.782  13.232
  604    HA   PHE  78           HA       PHE  78  -0.269  -6.079  10.302
  605   1HB   PHE  78          1HB       PHE  78  -0.563  -8.214  12.429
  606   2HB   PHE  78          2HB       PHE  78  -0.667  -8.500  10.694
  607    HD1  PHE  78           HD1      PHE  78   1.512  -8.112  13.522
  608    HD2  PHE  78           HD2      PHE  78   1.353  -8.058   9.270
  609    HE1  PHE  78           HE1      PHE  78   3.953  -8.403  13.431
  610    HE2  PHE  78           HE2      PHE  78   3.794  -8.351   9.171
  611    HZ   PHE  78           HZ       PHE  78   5.098  -8.524  11.254
  612    HA   PRO  79           HA       PRO  79  -4.647  -5.396  10.398
  613   1HB   PRO  79          1HB       PRO  79  -4.769  -6.819   7.839
  614   2HB   PRO  79          2HB       PRO  79  -5.103  -5.121   8.189
  615   1HG   PRO  79          1HG       PRO  79  -2.927  -5.904   6.799
  616   2HG   PRO  79          2HG       PRO  79  -2.913  -4.487   7.865
  617   1HD   PRO  79          1HD       PRO  79  -1.860  -7.246   8.365
  618   2HD   PRO  79          2HD       PRO  79  -1.146  -5.675   8.783
  619    H    SER  80           H        SER  80  -6.691  -6.687   9.974
  620    HA   SER  80           HA       SER  80  -6.672  -9.023  11.529
  621   1HB   SER  80          1HB       SER  80  -9.055  -9.262  10.636
  622   2HB   SER  80          2HB       SER  80  -8.681  -7.754  11.471
  623    HG   SER  80           HG       SER  80  -9.034  -6.699   9.688
  624    H    THR  81           H        THR  81  -7.066 -11.193  10.953
  625    HA   THR  81           HA       THR  81  -5.576 -12.189   8.836
  626    HB   THR  81           HB       THR  81  -7.032 -14.304   9.323
  627    HG1  THR  81           HG1      THR  81  -8.711 -13.672  10.499
  628   1HG2  THR  81          1HG2      THR  81  -4.728 -14.015  10.079
  629   2HG2  THR  81          2HG2      THR  81  -5.287 -13.042  11.440
  630   3HG2  THR  81          3HG2      THR  81  -5.711 -14.752  11.343
  631    H    ASP  82           H        ASP  82  -8.912 -11.223   8.989
  632    HA   ASP  82           HA       ASP  82  -9.908 -12.460   6.686
  633   1HB   ASP  82          1HB       ASP  82 -10.641  -9.840   7.999
  634   2HB   ASP  82          2HB       ASP  82 -11.552 -10.552   6.671
  635    H    VAL  83           H        VAL  83  -8.212  -9.393   7.133
  636    HA   VAL  83           HA       VAL  83  -8.393  -8.532   4.431
  637    HB   VAL  83           HB       VAL  83  -6.353  -7.799   6.547
  638   1HG1  VAL  83          1HG1      VAL  83  -5.943  -5.801   5.207
  639   2HG1  VAL  83          2HG1      VAL  83  -5.569  -7.265   4.295
  640   3HG1  VAL  83          3HG1      VAL  83  -7.067  -6.388   3.982
  641   1HG2  VAL  83          1HG2      VAL  83  -8.911  -6.426   5.732
  642   2HG2  VAL  83          2HG2      VAL  83  -8.631  -7.294   7.242
  643   3HG2  VAL  83          3HG2      VAL  83  -7.738  -5.813   6.897
  644    H    LEU  84           H        LEU  84  -5.994 -10.330   6.278
  645    HA   LEU  84           HA       LEU  84  -3.987 -10.462   4.328
  646   1HB   LEU  84          1HB       LEU  84  -4.640 -12.498   6.461
  647   2HB   LEU  84          2HB       LEU  84  -3.114 -12.350   5.609
  648    HG   LEU  84           HG       LEU  84  -4.276 -10.283   7.481
  649   1HD1  LEU  84          1HD1      LEU  84  -2.436 -10.938   8.965
  650   2HD1  LEU  84          2HD1      LEU  84  -3.556 -12.268   8.672
  651   3HD1  LEU  84          3HD1      LEU  84  -2.001 -12.226   7.843
  652   1HD2  LEU  84          1HD2      LEU  84  -2.092  -9.197   7.274
  653   2HD2  LEU  84          2HD2      LEU  84  -1.609 -10.398   6.075
  654   3HD2  LEU  84          3HD2      LEU  84  -2.925  -9.278   5.721
  655    H    ALA  85           H        ALA  85  -6.616 -12.731   5.090
  656    HA   ALA  85           HA       ALA  85  -5.991 -14.685   3.185
  657   1HB   ALA  85          1HB       ALA  85  -8.279 -15.461   3.472
  658   2HB   ALA  85          2HB       ALA  85  -7.566 -15.037   5.028
  659   3HB   ALA  85          3HB       ALA  85  -8.711 -13.941   4.255
  660    H    ALA  86           H        ALA  86  -7.915 -11.741   2.927
  661    HA   ALA  86           HA       ALA  86  -9.024 -12.257   0.385
  662   1HB   ALA  86          1HB       ALA  86  -9.557  -9.883   0.333
  663   2HB   ALA  86          2HB       ALA  86  -9.913 -10.567   1.918
  664   3HB   ALA  86          3HB       ALA  86  -8.461  -9.594   1.684
  665    H    CYS  87           H        CYS  87  -5.918 -11.035   1.384
  666    HA   CYS  87           HA       CYS  87  -5.232 -10.155  -1.296
  667   1HB   CYS  87          1HB       CYS  87  -4.438  -8.915   0.709
  668   2HB   CYS  87          2HB       CYS  87  -3.501 -10.327   1.181
  669    HG   CYS  87           HG       CYS  87  -1.691 -10.195  -0.872
  670    H    LEU  88           H        LEU  88  -4.466 -12.784   0.932
  671    HA   LEU  88           HA       LEU  88  -2.396 -13.942  -0.601
  672   1HB   LEU  88          1HB       LEU  88  -4.228 -15.168   1.458
  673   2HB   LEU  88          2HB       LEU  88  -2.825 -15.972   0.781
  674    HG   LEU  88           HG       LEU  88  -2.779 -13.436   2.421
  675   1HD1  LEU  88          1HD1      LEU  88  -1.916 -16.246   3.093
  676   2HD1  LEU  88          2HD1      LEU  88  -1.701 -14.825   4.116
  677   3HD1  LEU  88          3HD1      LEU  88  -3.325 -15.406   3.745
  678   1HD2  LEU  88          1HD2      LEU  88  -0.998 -13.484   0.750
  679   2HD2  LEU  88          2HD2      LEU  88  -0.350 -13.699   2.376
  680   3HD2  LEU  88          3HD2      LEU  88  -0.515 -15.088   1.301
  681    H    THR  89           H        THR  89  -5.890 -14.478  -0.554
  682    HA   THR  89           HA       THR  89  -5.941 -16.768  -2.179
  683    HB   THR  89           HB       THR  89  -8.298 -16.001  -2.747
  684    HG1  THR  89           HG1      THR  89  -8.107 -14.108  -0.707
  685   1HG2  THR  89          1HG2      THR  89  -7.801 -17.508  -0.874
  686   2HG2  THR  89          2HG2      THR  89  -7.536 -16.112   0.173
  687   3HG2  THR  89          3HG2      THR  89  -9.139 -16.422  -0.494
  688    H    ARG  90           H        ARG  90  -5.648 -13.382  -2.949
  689    HA   ARG  90           HA       ARG  90  -6.053 -13.809  -5.787
  690   1HB   ARG  90          1HB       ARG  90  -5.394 -11.380  -4.131
  691   2HB   ARG  90          2HB       ARG  90  -5.425 -11.342  -5.888
  692   1HG   ARG  90          1HG       ARG  90  -7.751 -11.898  -5.926
  693   2HG   ARG  90          2HG       ARG  90  -7.760 -12.178  -4.183
  694   1HD   ARG  90          1HD       ARG  90  -7.394  -9.871  -3.731
  695   2HD   ARG  90          2HD       ARG  90  -7.057  -9.529  -5.427
  696    HE   ARG  90           HE       ARG  90  -9.329  -9.567  -5.885
  697   1HH1  ARG  90          1HH1      ARG  90  -8.740 -10.503  -2.556
  698   2HH1  ARG  90          2HH1      ARG  90 -10.400 -10.299  -2.073
  699   1HH2  ARG  90          1HH2      ARG  90 -11.505  -9.278  -5.248
  700   2HH2  ARG  90          2HH2      ARG  90 -11.961  -9.571  -3.593
  701    H    GLY  91           H        GLY  91  -3.563 -14.380  -3.724
  702   1HA   GLY  91          1HA       GLY  91  -1.344 -14.863  -4.059
  703   2HA   GLY  91          2HA       GLY  91  -1.676 -14.802  -5.784
  704    H    ILE  92           H        ILE  92  -2.216 -12.108  -3.617
  705    HA   ILE  92           HA       ILE  92  -0.308 -10.544  -5.179
  706    HB   ILE  92           HB       ILE  92  -2.283  -9.603  -3.091
  707   1HG1  ILE  92          1HG1      ILE  92  -2.484  -9.516  -6.111
  708   2HG1  ILE  92          2HG1      ILE  92  -3.374 -10.625  -5.073
  709   1HG2  ILE  92          1HG2      ILE  92  -1.881  -7.380  -4.040
  710   2HG2  ILE  92          2HG2      ILE  92  -0.400  -8.083  -3.389
  711   3HG2  ILE  92          3HG2      ILE  92  -0.677  -8.066  -5.131
  712   1HD1  ILE  92          1HD1      ILE  92  -4.770  -8.777  -5.765
  713   2HD1  ILE  92          2HD1      ILE  92  -4.496  -8.721  -4.024
  714   3HD1  ILE  92          3HD1      ILE  92  -3.616  -7.626  -5.091
  715    H    GLY  93           H        GLY  93   1.589  -9.844  -4.398
  716   1HA   GLY  93          1HA       GLY  93   2.520 -10.839  -1.871
  717   2HA   GLY  93          2HA       GLY  93   3.428  -9.846  -3.002
  718    H    LEU  94           H        LEU  94   1.913  -9.920  -0.025
  719    HA   LEU  94           HA       LEU  94   1.519  -7.012   0.046
  720   1HB   LEU  94          1HB       LEU  94  -0.354  -8.397   0.815
  721   2HB   LEU  94          2HB       LEU  94   0.684  -9.150   2.009
  722    HG   LEU  94           HG       LEU  94   0.945  -6.960   3.134
  723   1HD1  LEU  94          1HD1      LEU  94   0.568  -5.515   1.205
  724   2HD1  LEU  94          2HD1      LEU  94  -1.118  -6.029   1.143
  725   3HD1  LEU  94          3HD1      LEU  94  -0.526  -5.114   2.529
  726   1HD2  LEU  94          1HD2      LEU  94  -1.907  -7.857   2.737
  727   2HD2  LEU  94          2HD2      LEU  94  -0.753  -8.540   3.883
  728   3HD2  LEU  94          3HD2      LEU  94  -1.308  -6.878   4.076
  729    H    GLU  95           H        GLU  95   3.353  -5.988   0.521
  730    HA   GLU  95           HA       GLU  95   5.177  -7.155   2.504
  731   1HB   GLU  95          1HB       GLU  95   5.620  -4.752   0.723
  732   2HB   GLU  95          2HB       GLU  95   6.830  -5.588   1.685
  733   1HG   GLU  95          1HG       GLU  95   5.365  -6.704  -0.695
  734   2HG   GLU  95          2HG       GLU  95   7.035  -6.146  -0.663
  735    H    ALA  96           H        ALA  96   4.686  -6.565   4.537
  736    HA   ALA  96           HA       ALA  96   3.579  -3.899   5.034
  737   1HB   ALA  96          1HB       ALA  96   3.915  -6.237   6.915
  738   2HB   ALA  96          2HB       ALA  96   3.087  -4.723   7.280
  739   3HB   ALA  96          3HB       ALA  96   2.436  -5.812   6.055
  740    H    MET  97           H        MET  97   4.975  -2.323   5.400
  741    HA   MET  97           HA       MET  97   7.329  -2.798   7.073
  742   1HB   MET  97          1HB       MET  97   7.455  -1.590   4.298
  743   2HB   MET  97          2HB       MET  97   8.783  -1.612   5.447
  744   1HG   MET  97          1HG       MET  97   8.915  -4.000   5.340
  745   2HG   MET  97          2HG       MET  97   7.463  -4.077   4.341
  746   1HE   MET  97          1HE       MET  97   7.339  -3.179   1.841
  747   2HE   MET  97          2HE       MET  97   8.689  -2.398   1.018
  748   3HE   MET  97          3HE       MET  97   7.910  -1.601   2.384
  749    H    THR  98           H        THR  98   8.499  -0.555   7.339
  750    HA   THR  98           HA       THR  98   6.494   1.378   8.102
  751    HB   THR  98           HB       THR  98   8.489   2.708   8.882
  752    HG1  THR  98           HG1      THR  98  10.482   1.427   8.968
  753   1HG2  THR  98          1HG2      THR  98   8.277  -0.132   9.891
  754   2HG2  THR  98          2HG2      THR  98   9.002   1.217  10.765
  755   3HG2  THR  98          3HG2      THR  98   7.275   1.227  10.403
  756    H    ASN  99           H        ASN  99   6.892   3.740   7.490
  757    HA   ASN  99           HA       ASN  99   6.592   3.970   4.711
  758   1HB   ASN  99          1HB       ASN  99   7.178   6.107   6.766
  759   2HB   ASN  99          2HB       ASN  99   6.784   6.445   5.085
  760   1HD2  ASN  99          2HD2      ASN  99   5.281   7.441   7.173
  761   2HD2  ASN  99          1HD2      ASN  99   3.721   6.692   7.148
  762    H    ALA 100           H        ALA 100   9.417   4.176   6.719
  763    HA   ALA 100           HA       ALA 100  11.139   5.535   4.962
  764   1HB   ALA 100          1HB       ALA 100  11.842   3.436   7.012
  765   2HB   ALA 100          2HB       ALA 100  12.952   4.598   6.286
  766   3HB   ALA 100          3HB       ALA 100  11.649   5.160   7.333
  767    H    ALA 101           H        ALA 101  10.441   2.089   5.373
  768    HA   ALA 101           HA       ALA 101  12.322   1.316   3.331
  769   1HB   ALA 101          1HB       ALA 101  11.913  -0.112   5.284
  770   2HB   ALA 101          2HB       ALA 101  10.241  -0.330   4.766
  771   3HB   ALA 101          3HB       ALA 101  11.559  -0.952   3.774
  772    H    ALA 102           H        ALA 102   8.835   1.706   3.629
  773    HA   ALA 102           HA       ALA 102   8.030   0.380   1.309
  774   1HB   ALA 102          1HB       ALA 102   5.963   1.656   1.483
  775   2HB   ALA 102          2HB       ALA 102   6.480   1.081   3.067
  776   3HB   ALA 102          3HB       ALA 102   6.731   2.768   2.616
  777    H    ALA 103           H        ALA 103   8.893   3.795   1.774
  778    HA   ALA 103           HA       ALA 103   8.308   4.654  -0.835
  779   1HB   ALA 103          1HB       ALA 103   9.693   6.594  -0.321
  780   2HB   ALA 103          2HB       ALA 103   8.635   6.193   1.032
  781   3HB   ALA 103          3HB       ALA 103  10.345   5.764   1.092
  782    H    ARG 104           H        ARG 104  11.246   3.316   0.586
  783    HA   ARG 104           HA       ARG 104  12.932   3.749  -1.641
  784   1HB   ARG 104          1HB       ARG 104  13.862   3.318   0.553
  785   2HB   ARG 104          2HB       ARG 104  13.096   1.738   0.610
  786   1HG   ARG 104          1HG       ARG 104  14.515   0.943  -1.178
  787   2HG   ARG 104          2HG       ARG 104  15.231   2.547  -1.356
  788   1HD   ARG 104          1HD       ARG 104  15.361   0.889   1.160
  789   2HD   ARG 104          2HD       ARG 104  16.632   0.946  -0.060
  790    HE   ARG 104           HE       ARG 104  16.857   3.338   0.451
  791   1HH1  ARG 104          1HH1      ARG 104  15.206   1.307   2.800
  792   2HH1  ARG 104          2HH1      ARG 104  15.589   2.348   4.145
  793   1HH2  ARG 104          1HH2      ARG 104  17.368   4.688   2.212
  794   2HH2  ARG 104          2HH2      ARG 104  16.810   4.274   3.806
  795    H    THR 105           H        THR 105  11.019   0.939  -0.599
  796    HA   THR 105           HA       THR 105  11.840  -0.729  -2.737
  797    HB   THR 105           HB       THR 105   9.749  -2.056  -2.131
  798    HG1  THR 105           HG1      THR 105   8.922   0.071  -1.046
  799   1HG2  THR 105          1HG2      THR 105  10.713  -2.847  -0.020
  800   2HG2  THR 105          2HG2      THR 105  11.959  -2.591  -1.241
  801   3HG2  THR 105          3HG2      THR 105  11.734  -1.411   0.050
  802    H    TYR 106           H        TYR 106   9.339   1.687  -2.426
  803    HA   TYR 106           HA       TYR 106   7.685   0.887  -4.550
  804   1HB   TYR 106          1HB       TYR 106   6.914   2.534  -2.950
  805   2HB   TYR 106          2HB       TYR 106   8.200   3.643  -3.415
  806    HD1  TYR 106           HD1      TYR 106   5.177   1.920  -4.741
  807    HD2  TYR 106           HD2      TYR 106   7.848   5.211  -5.119
  808    HE1  TYR 106           HE1      TYR 106   3.704   2.915  -6.442
  809    HE2  TYR 106           HE2      TYR 106   6.384   6.215  -6.818
  810    HH   TYR 106           HH       TYR 106   4.675   5.511  -8.428
  811    H    ASN 107           H        ASN 107  10.437   3.127  -4.466
  812    HA   ASN 107           HA       ASN 107  10.308   3.928  -7.151
  813   1HB   ASN 107          1HB       ASN 107  11.680   5.038  -5.378
  814   2HB   ASN 107          2HB       ASN 107  12.801   3.683  -5.453
  815   1HD2  ASN 107          2HD2      ASN 107  11.168   5.067  -8.229
  816   2HD2  ASN 107          1HD2      ASN 107  12.586   5.715  -8.977
  817    H    VAL 108           H        VAL 108  12.047   1.266  -5.600
  818    HA   VAL 108           HA       VAL 108  13.441   0.382  -7.881
  819    HB   VAL 108           HB       VAL 108  12.570  -1.254  -5.493
  820   1HG1  VAL 108          1HG1      VAL 108  14.785  -1.716  -7.490
  821   2HG1  VAL 108          2HG1      VAL 108  14.458  -2.703  -6.064
  822   3HG1  VAL 108          3HG1      VAL 108  13.282  -2.634  -7.377
  823   1HG2  VAL 108          1HG2      VAL 108  15.100   0.319  -5.960
  824   2HG2  VAL 108          2HG2      VAL 108  13.830   0.703  -4.799
  825   3HG2  VAL 108          3HG2      VAL 108  14.801  -0.755  -4.594
  826    H    LEU 109           H        LEU 109  10.356  -0.702  -6.452
  827    HA   LEU 109           HA       LEU 109   9.924  -2.745  -8.375
  828   1HB   LEU 109          1HB       LEU 109   7.997  -1.342  -6.527
  829   2HB   LEU 109          2HB       LEU 109   7.584  -2.738  -7.505
  830    HG   LEU 109           HG       LEU 109   9.644  -2.675  -5.298
  831   1HD1  LEU 109          1HD1      LEU 109   7.348  -2.585  -4.481
  832   2HD1  LEU 109          2HD1      LEU 109   6.943  -4.003  -5.449
  833   3HD1  LEU 109          3HD1      LEU 109   8.094  -4.141  -4.120
  834   1HD2  LEU 109          1HD2      LEU 109   8.705  -4.960  -7.028
  835   2HD2  LEU 109          2HD2      LEU 109  10.296  -4.202  -7.080
  836   3HD2  LEU 109          3HD2      LEU 109   9.790  -5.092  -5.644
  837    H    ALA 110           H        ALA 110   9.120   0.657  -8.273
  838    HA   ALA 110           HA       ALA 110   7.245   0.687 -10.381
  839   1HB   ALA 110          1HB       ALA 110   7.553   2.572  -8.844
  840   2HB   ALA 110          2HB       ALA 110   9.148   2.870  -9.535
  841   3HB   ALA 110          3HB       ALA 110   7.705   3.075 -10.528
  842    H    SER 111           H        SER 111  10.772   1.056 -10.339
  843    HA   SER 111           HA       SER 111  10.940   1.392 -13.183
  844   1HB   SER 111          1HB       SER 111  13.085   0.840 -11.120
  845   2HB   SER 111          2HB       SER 111  13.388   1.259 -12.806
  846    HG   SER 111           HG       SER 111  11.765   3.098 -11.970
  847    H    GLU 112           H        GLU 112  10.788  -1.291 -11.052
  848    HA   GLU 112           HA       GLU 112  12.100  -3.200 -12.696
  849   1HB   GLU 112          1HB       GLU 112  11.553  -3.423 -10.223
  850   2HB   GLU 112          2HB       GLU 112   9.896  -3.759 -10.706
  851   1HG   GLU 112          1HG       GLU 112  11.045  -5.821 -10.276
  852   2HG   GLU 112          2HG       GLU 112  10.692  -5.695 -11.999
  853    H    GLY 113           H        GLY 113   8.947  -1.778 -12.659
  854   1HA   GLY 113          1HA       GLY 113   7.433  -1.760 -14.437
  855   2HA   GLY 113          2HA       GLY 113   8.330  -3.074 -15.184
  856    H    ARG 114           H        ARG 114   6.645  -2.639 -12.077
  857    HA   ARG 114           HA       ARG 114   5.045  -5.021 -12.714
  858   1HB   ARG 114          1HB       ARG 114   6.252  -4.429 -10.002
  859   2HB   ARG 114          2HB       ARG 114   5.289  -5.834 -10.437
  860   1HG   ARG 114          1HG       ARG 114   7.049  -6.549 -11.986
  861   2HG   ARG 114          2HG       ARG 114   8.020  -5.154 -11.511
  862   1HD   ARG 114          1HD       ARG 114   8.794  -7.069 -10.297
  863   2HD   ARG 114          2HD       ARG 114   7.968  -5.991  -9.171
  864    HE   ARG 114           HE       ARG 114   6.294  -8.066 -10.288
  865   1HH1  ARG 114          1HH1      ARG 114   8.473  -7.193  -7.683
  866   2HH1  ARG 114          2HH1      ARG 114   7.872  -8.410  -6.600
  867   1HH2  ARG 114          1HH2      ARG 114   5.516  -9.672  -8.889
  868   2HH2  ARG 114          2HH2      ARG 114   6.203  -9.842  -7.296
  869    H    ARG 115           H        ARG 115   2.986  -5.095 -11.635
  870    HA   ARG 115           HA       ARG 115   1.791  -2.525 -11.253
  871   1HB   ARG 115          1HB       ARG 115   0.883  -5.262 -11.542
  872   2HB   ARG 115          2HB       ARG 115   0.015  -4.442 -10.253
  873   1HG   ARG 115          1HG       ARG 115   0.302  -3.341 -13.036
  874   2HG   ARG 115          2HG       ARG 115  -1.065  -4.317 -12.495
  875   1HD   ARG 115          1HD       ARG 115  -1.544  -2.649 -10.752
  876   2HD   ARG 115          2HD       ARG 115  -0.196  -1.670 -11.332
  877    HE   ARG 115           HE       ARG 115  -1.603  -1.829 -13.551
  878   1HH1  ARG 115          1HH1      ARG 115  -2.784  -1.335 -10.288
  879   2HH1  ARG 115          2HH1      ARG 115  -4.166  -0.422 -10.787
  880   1HH2  ARG 115          1HH2      ARG 115  -3.419  -0.613 -14.214
  881   2HH2  ARG 115          2HH2      ARG 115  -4.537  -0.007 -13.024
  882    H    VAL 116           H        VAL 116   3.013  -1.662  -9.545
  883    HA   VAL 116           HA       VAL 116   2.777  -2.958  -6.946
  884    HB   VAL 116           HB       VAL 116   4.988  -2.134  -7.539
  885   1HG1  VAL 116          1HG1      VAL 116   5.453   0.258  -7.779
  886   2HG1  VAL 116          2HG1      VAL 116   4.370  -0.330  -9.041
  887   3HG1  VAL 116          3HG1      VAL 116   3.724   0.598  -7.687
  888   1HG2  VAL 116          1HG2      VAL 116   4.374  -2.126  -5.187
  889   2HG2  VAL 116          2HG2      VAL 116   5.458  -0.783  -5.554
  890   3HG2  VAL 116          3HG2      VAL 116   3.730  -0.492  -5.347
  891    H    ALA 117           H        ALA 117   1.448  -2.316  -5.400
  892    HA   ALA 117           HA       ALA 117  -0.025   0.212  -5.771
  893   1HB   ALA 117          1HB       ALA 117  -0.862  -2.247  -4.229
  894   2HB   ALA 117          2HB       ALA 117  -1.810  -0.774  -4.435
  895   3HB   ALA 117          3HB       ALA 117  -1.449  -1.791  -5.829
  896    H    LEU 118           H        LEU 118   0.716   1.770  -4.470
  897    HA   LEU 118           HA       LEU 118   2.156   1.028  -2.057
  898   1HB   LEU 118          1HB       LEU 118   3.093   2.727  -3.594
  899   2HB   LEU 118          2HB       LEU 118   1.706   3.753  -3.279
  900    HG   LEU 118           HG       LEU 118   2.382   3.862  -0.887
  901   1HD1  LEU 118          1HD1      LEU 118   3.630   1.779  -0.757
  902   2HD1  LEU 118          2HD1      LEU 118   4.838   2.419  -1.871
  903   3HD1  LEU 118          3HD1      LEU 118   4.640   3.141  -0.274
  904   1HD2  LEU 118          1HD2      LEU 118   4.271   5.377  -1.242
  905   2HD2  LEU 118          2HD2      LEU 118   4.469   4.747  -2.878
  906   3HD2  LEU 118          3HD2      LEU 118   3.007   5.631  -2.444
  907    H    ALA 119           H        ALA 119   0.697   0.421  -0.553
  908    HA   ALA 119           HA       ALA 119  -1.544   2.158   0.100
  909   1HB   ALA 119          1HB       ALA 119  -0.611  -0.410   1.390
  910   2HB   ALA 119          2HB       ALA 119  -2.089   0.464   1.794
  911   3HB   ALA 119          3HB       ALA 119  -1.899  -0.257   0.195
  912    H    MET 120           H        MET 120  -0.682   4.013   0.890
  913    HA   MET 120           HA       MET 120   1.561   3.839   2.747
  914   1HB   MET 120          1HB       MET 120   1.449   5.365   0.658
  915   2HB   MET 120          2HB       MET 120   0.398   6.379   1.637
  916   1HG   MET 120          1HG       MET 120   2.572   7.274   1.809
  917   2HG   MET 120          2HG       MET 120   2.236   6.468   3.340
  918   1HE   MET 120          1HE       MET 120   6.127   6.012   2.633
  919   2HE   MET 120          2HE       MET 120   4.937   6.731   3.717
  920   3HE   MET 120          3HE       MET 120   5.141   7.366   2.084
  921    H    ILE 121           H        ILE 121   0.709   3.352   4.715
  922    HA   ILE 121           HA       ILE 121  -1.355   5.140   5.784
  923    HB   ILE 121           HB       ILE 121  -0.248   2.559   6.913
  924   1HG1  ILE 121          1HG1      ILE 121  -2.941   3.206   5.690
  925   2HG1  ILE 121          2HG1      ILE 121  -1.674   2.249   4.933
  926   1HG2  ILE 121          1HG2      ILE 121  -2.463   4.326   7.948
  927   2HG2  ILE 121          2HG2      ILE 121  -2.034   2.741   8.589
  928   3HG2  ILE 121          3HG2      ILE 121  -0.888   4.077   8.699
  929   1HD1  ILE 121          1HD1      ILE 121  -3.422   0.837   5.840
  930   2HD1  ILE 121          2HD1      ILE 121  -1.899   0.569   6.688
  931   3HD1  ILE 121          3HD1      ILE 121  -3.170   1.530   7.443
  932    H    VAL 122           H        VAL 122  -0.730   6.790   6.967
  933    HA   VAL 122           HA       VAL 122   2.031   6.972   7.838
  934    HB   VAL 122           HB       VAL 122  -0.203   9.006   8.009
  935   1HG1  VAL 122          1HG1      VAL 122   1.581   9.453   9.603
  936   2HG1  VAL 122          2HG1      VAL 122   2.776   9.342   8.312
  937   3HG1  VAL 122          3HG1      VAL 122   1.586  10.644   8.303
  938   1HG2  VAL 122          1HG2      VAL 122   0.283   8.384   5.702
  939   2HG2  VAL 122          2HG2      VAL 122   0.832  10.025   6.040
  940   3HG2  VAL 122          3HG2      VAL 122   1.998   8.704   5.968
  941    H    GLY 123           H        GLY 123   2.646   7.457  10.006
  942   1HA   GLY 123          1HA       GLY 123   1.410   5.865  11.955
  943   2HA   GLY 123          2HA       GLY 123   2.634   7.088  12.264
  944    H    GLY 124           H        GLY 124  -0.153   6.203  13.389
  945   1HA   GLY 124          1HA       GLY 124  -1.895   8.396  13.118
  946   2HA   GLY 124          2HA       GLY 124  -1.949   7.196  14.401
  947    H    LEU 125           H        LEU 125  -2.167  10.231  14.201
  948    HA   LEU 125           HA       LEU 125  -0.070  11.455  15.572
  949   1HB   LEU 125          1HB       LEU 125  -3.011  12.135  15.706
  950   2HB   LEU 125          2HB       LEU 125  -1.687  13.205  16.124
  951    HG   LEU 125           HG       LEU 125  -2.200  12.112  13.355
  952   1HD1  LEU 125          1HD1      LEU 125  -2.929  14.385  12.815
  953   2HD1  LEU 125          2HD1      LEU 125  -3.964  13.642  14.034
  954   3HD1  LEU 125          3HD1      LEU 125  -2.762  14.839  14.511
  955   1HD2  LEU 125          1HD2      LEU 125  -0.281  14.221  14.343
  956   2HD2  LEU 125          2HD2      LEU 125   0.150  12.607  13.778
  957   3HD2  LEU 125          3HD2      LEU 125  -0.549  13.775  12.657
  958    H    GLU 126           H        GLU 126  -2.842   9.643  16.730
  959    HA   GLU 126           HA       GLU 126  -2.504  10.291  19.471
  960   1HB   GLU 126          1HB       GLU 126  -4.032   8.137  18.050
  961   2HB   GLU 126          2HB       GLU 126  -3.924   8.178  19.804
  962   1HG   GLU 126          1HG       GLU 126  -4.818  10.526  19.689
  963   2HG   GLU 126          2HG       GLU 126  -5.152  10.221  17.983
  964    H    HIS 127           H        HIS 127  -1.590   9.198  21.092
  965    HA   HIS 127           HA       HIS 127  -0.126   6.745  20.605
  966   1HB   HIS 127          1HB       HIS 127   1.986   7.777  21.569
  967   2HB   HIS 127          2HB       HIS 127   1.578   8.273  19.931
  968    HD1  HIS 127           HD1      HIS 127   0.674  10.733  19.628
  969    HD2  HIS 127           HD2      HIS 127   2.051   9.817  23.450
  970    HE1  HIS 127           HE1      HIS 127   0.923  12.939  20.808
  971    HE2  HIS 127           HE2      HIS 127   1.822  12.375  23.095
  972    H    HIS 128           H        HIS 128  -1.178   9.310  22.749
  973    HA   HIS 128           HA       HIS 128  -1.652   9.415  24.957
  974   1HB   HIS 128          1HB       HIS 128  -2.119   6.452  24.547
  975   2HB   HIS 128          2HB       HIS 128  -2.577   7.333  26.002
  976    HD1  HIS 128           HD1      HIS 128  -4.760   8.614  25.944
  977    HD2  HIS 128           HD2      HIS 128  -3.593   7.231  22.200
  978    HE1  HIS 128           HE1      HIS 128  -6.716   9.044  24.420
  979    HE2  HIS 128           HE2      HIS 128  -5.941   8.316  22.131
  980    H    HIS 129           H        HIS 129  -1.131   7.629  27.095
  981    HA   HIS 129           HA       HIS 129   1.814   7.583  26.984
  982   1HB   HIS 129          1HB       HIS 129   0.659   9.185  28.615
  983   2HB   HIS 129          2HB       HIS 129   0.199   7.749  29.521
  984    HD1  HIS 129           HD1      HIS 129   2.868  10.168  29.162
  985    HD2  HIS 129           HD2      HIS 129   2.563   6.209  30.405
  986    HE1  HIS 129           HE1      HIS 129   4.970   9.697  30.457
  987    HE2  HIS 129           HE2      HIS 129   4.654   7.379  31.388
  988    H    HIS 130           H        HIS 130  -0.771   6.012  28.910
  989    HA   HIS 130           HA       HIS 130   0.610   3.456  28.401
  990   1HB   HIS 130          1HB       HIS 130   0.078   4.714  30.917
  991   2HB   HIS 130          2HB       HIS 130  -0.884   3.245  30.808
  992    HD1  HIS 130           HD1      HIS 130   0.314   1.040  31.112
  993    HD2  HIS 130           HD2      HIS 130   2.914   4.269  30.701
  994    HE1  HIS 130           HE1      HIS 130   2.601   0.154  31.666
  995    HE2  HIS 130           HE2      HIS 130   4.173   2.066  31.202
  996    H    HIS 131           H        HIS 131  -0.779   3.001  26.653
  997    HA   HIS 131           HA       HIS 131  -3.619   2.822  27.040
  998   1HB   HIS 131          1HB       HIS 131  -2.315   3.050  24.799
  999   2HB   HIS 131          2HB       HIS 131  -2.100   1.307  24.922
 1000    HD1  HIS 131           HD1      HIS 131  -3.589   2.054  22.528
 1001    HD2  HIS 131           HD2      HIS 131  -5.515   1.663  26.198
 1002    HE1  HIS 131           HE1      HIS 131  -6.025   1.720  21.990
 1003    HE2  HIS 131           HE2      HIS 131  -7.189   1.705  24.226
 1004    H    HIS 132           H        HIS 132  -0.872   0.864  27.618
 1005    HA   HIS 132           HA       HIS 132  -2.558  -1.017  29.063
 1006   1HB   HIS 132          1HB       HIS 132  -2.031  -2.172  26.956
 1007   2HB   HIS 132          2HB       HIS 132  -0.316  -1.857  27.199
 1008    HD1  HIS 132           HD1      HIS 132  -3.163  -3.876  28.664
 1009    HD2  HIS 132           HD2      HIS 132   0.996  -3.690  28.777
 1010    HE1  HIS 132           HE1      HIS 132  -2.420  -5.907  29.952
 1011    HE2  HIS 132           HE2      HIS 132   0.087  -5.702  30.128
  Start of MODEL   11
    1   1H    MET   1          1HT       MET   1 -12.925  22.314 -22.038
    2   2H    MET   1          2HT       MET   1 -13.559  21.050 -21.107
    3   3H    MET   1          3HT       MET   1 -11.929  21.015 -21.590
    4    HA   MET   1           HA       MET   1 -13.166  22.966 -19.729
    5   1HB   MET   1          1HB       MET   1 -11.154  20.750 -19.260
    6   2HB   MET   1          2HB       MET   1 -11.658  21.927 -18.057
    7   1HG   MET   1          1HG       MET   1 -13.961  21.068 -18.229
    8   2HG   MET   1          2HG       MET   1 -13.392  19.843 -19.362
    9   1HE   MET   1          1HE       MET   1 -13.292  21.156 -15.671
   10   2HE   MET   1          2HE       MET   1 -11.594  21.245 -16.135
   11   3HE   MET   1          3HE       MET   1 -12.119  20.070 -14.928
   12    HA   PRO   2           HA       PRO   2  -9.740  25.572 -20.798
   13   1HB   PRO   2          1HB       PRO   2  -9.842  26.785 -18.156
   14   2HB   PRO   2          2HB       PRO   2 -10.335  27.464 -19.709
   15   1HG   PRO   2          1HG       PRO   2 -12.104  26.813 -17.759
   16   2HG   PRO   2          2HG       PRO   2 -12.501  26.744 -19.485
   17   1HD   PRO   2          1HD       PRO   2 -11.743  24.519 -17.622
   18   2HD   PRO   2          2HD       PRO   2 -13.006  24.561 -18.874
   19    H    LEU   3           H        LEU   3  -8.891  23.035 -19.881
   20    HA   LEU   3           HA       LEU   3  -6.888  23.458 -17.835
   21   1HB   LEU   3          1HB       LEU   3  -7.369  21.087 -19.648
   22   2HB   LEU   3          2HB       LEU   3  -6.256  21.121 -18.295
   23    HG   LEU   3           HG       LEU   3  -9.256  21.407 -18.088
   24   1HD1  LEU   3          1HD1      LEU   3  -7.444  19.099 -17.403
   25   2HD1  LEU   3          2HD1      LEU   3  -9.173  19.188 -17.065
   26   3HD1  LEU   3          3HD1      LEU   3  -8.600  19.158 -18.733
   27   1HD2  LEU   3          1HD2      LEU   3  -8.878  21.193 -15.678
   28   2HD2  LEU   3          2HD2      LEU   3  -7.137  21.194 -15.952
   29   3HD2  LEU   3          3HD2      LEU   3  -8.090  22.629 -16.333
   30    H    ASN   4           H        ASN   4  -5.324  24.820 -18.486
   31    HA   ASN   4           HA       ASN   4  -4.272  24.550 -21.208
   32   1HB   ASN   4          1HB       ASN   4  -5.064  26.786 -20.484
   33   2HB   ASN   4          2HB       ASN   4  -3.856  26.780 -19.203
   34   1HD2  ASN   4          2HD2      ASN   4  -2.786  28.570 -19.959
   35   2HD2  ASN   4          1HD2      ASN   4  -1.839  28.550 -21.408
   36    H    GLN   5           H        GLN   5  -3.229  24.693 -17.823
   37    HA   GLN   5           HA       GLN   5  -0.479  24.181 -18.588
   38   1HB   GLN   5          1HB       GLN   5  -0.914  25.728 -16.748
   39   2HB   GLN   5          2HB       GLN   5  -1.741  24.459 -15.855
   40   1HG   GLN   5          1HG       GLN   5   0.334  23.191 -15.716
   41   2HG   GLN   5          2HG       GLN   5   1.168  24.445 -16.630
   42   1HE2  GLN   5          2HE2      GLN   5  -0.249  26.614 -15.294
   43   2HE2  GLN   5          1HE2      GLN   5   0.431  26.721 -13.710
   44    H    GLU   6           H        GLU   6   0.336  22.244 -18.840
   45    HA   GLU   6           HA       GLU   6  -0.968  19.815 -18.226
   46   1HB   GLU   6          1HB       GLU   6   1.966  20.405 -18.684
   47   2HB   GLU   6          2HB       GLU   6   1.272  18.792 -18.626
   48   1HG   GLU   6          1HG       GLU   6   0.392  20.871 -20.603
   49   2HG   GLU   6          2HG       GLU   6   1.722  19.756 -20.910
   50    H    HIS   7           H        HIS   7  -0.762  18.436 -16.453
   51    HA   HIS   7           HA       HIS   7  -0.006  19.556 -13.972
   52   1HB   HIS   7          1HB       HIS   7  -0.613  16.743 -14.848
   53   2HB   HIS   7          2HB       HIS   7  -0.033  17.071 -13.219
   54    HD1  HIS   7           HD1      HIS   7  -3.018  16.145 -14.380
   55    HD2  HIS   7           HD2      HIS   7  -1.858  19.721 -12.587
   56    HE1  HIS   7           HE1      HIS   7  -5.125  17.152 -13.432
   57    HE2  HIS   7           HE2      HIS   7  -4.382  19.265 -12.277
   58    HA   PRO   8           HA       PRO   8   4.360  19.786 -14.295
   59   1HB   PRO   8          1HB       PRO   8   4.115  19.030 -11.408
   60   2HB   PRO   8          2HB       PRO   8   5.098  20.295 -12.158
   61   1HG   PRO   8          1HG       PRO   8   2.808  20.901 -10.950
   62   2HG   PRO   8          2HG       PRO   8   3.291  21.712 -12.450
   63   1HD   PRO   8          1HD       PRO   8   1.192  19.665 -12.001
   64   2HD   PRO   8          2HD       PRO   8   1.286  20.937 -13.232
   65    H    ASP   9           H        ASP   9   5.523  18.274 -15.224
   66    HA   ASP   9           HA       ASP   9   5.227  15.491 -14.546
   67   1HB   ASP   9          1HB       ASP   9   5.557  16.070 -16.872
   68   2HB   ASP   9          2HB       ASP   9   7.069  16.890 -16.495
   69    H    TYR  10           H        TYR  10   6.021  14.954 -12.642
   70    HA   TYR  10           HA       TYR  10   8.898  14.930 -12.371
   71   1HB   TYR  10          1HB       TYR  10   8.050  17.049 -11.214
   72   2HB   TYR  10          2HB       TYR  10   7.233  15.983 -10.076
   73    HD1  TYR  10           HD1      TYR  10  10.343  17.537 -10.990
   74    HD2  TYR  10           HD2      TYR  10   8.635  14.409  -8.669
   75    HE1  TYR  10           HE1      TYR  10  12.410  17.398  -9.668
   76    HE2  TYR  10           HE2      TYR  10  10.697  14.263  -7.338
   77    HH   TYR  10           HH       TYR  10  13.226  14.851  -7.798
   78    H    THR  11           H        THR  11   9.352  12.894 -11.923
   79    HA   THR  11           HA       THR  11   7.434  10.950 -11.377
   80    HB   THR  11           HB       THR  11  10.383  10.710 -10.772
   81    HG1  THR  11           HG1      THR  11   8.957  10.836 -13.205
   82   1HG2  THR  11          1HG2      THR  11   9.001   8.831 -10.019
   83   2HG2  THR  11          2HG2      THR  11   8.314   8.682 -11.637
   84   3HG2  THR  11          3HG2      THR  11  10.028   8.356 -11.372
   85    H    TYR  12           H        TYR  12   6.247  10.879  -9.604
   86    HA   TYR  12           HA       TYR  12   7.150  11.856  -7.080
   87   1HB   TYR  12          1HB       TYR  12   4.904  10.717  -6.341
   88   2HB   TYR  12          2HB       TYR  12   4.876  12.182  -7.314
   89    HD1  TYR  12           HD1      TYR  12   4.196  12.112  -9.653
   90    HD2  TYR  12           HD2      TYR  12   4.184   8.586  -7.270
   91    HE1  TYR  12           HE1      TYR  12   2.808  10.984 -11.338
   92    HE2  TYR  12           HE2      TYR  12   2.799   7.448  -8.953
   93    HH   TYR  12           HH       TYR  12   2.326   8.665 -12.065
   94    H    ALA  13           H        ALA  13   8.632  10.802  -6.001
   95    HA   ALA  13           HA       ALA  13   8.228   7.927  -5.510
   96   1HB   ALA  13          1HB       ALA  13  10.654   7.634  -5.452
   97   2HB   ALA  13          2HB       ALA  13  10.131   8.252  -7.019
   98   3HB   ALA  13          3HB       ALA  13  10.877   9.338  -5.847
   99    H    LEU  14           H        LEU  14   7.472  10.437  -4.097
  100    HA   LEU  14           HA       LEU  14   7.280  11.233  -1.991
  101   1HB   LEU  14          1HB       LEU  14   8.619   8.619  -1.371
  102   2HB   LEU  14          2HB       LEU  14   8.331   9.796  -0.107
  103    HG   LEU  14           HG       LEU  14   6.578   8.170  -0.048
  104   1HD1  LEU  14          1HD1      LEU  14   5.917  10.456   0.418
  105   2HD1  LEU  14          2HD1      LEU  14   5.576  10.723  -1.292
  106   3HD1  LEU  14          3HD1      LEU  14   4.606   9.575  -0.367
  107   1HD2  LEU  14          1HD2      LEU  14   6.067   8.814  -2.948
  108   2HD2  LEU  14          2HD2      LEU  14   6.751   7.315  -2.322
  109   3HD2  LEU  14          3HD2      LEU  14   5.086   7.751  -1.939
  110    H    ARG  15           H        ARG  15   8.729  11.845   0.013
  111    HA   ARG  15           HA       ARG  15  11.514  12.192  -0.493
  112   1HB   ARG  15          1HB       ARG  15  10.720  13.911  -2.019
  113   2HB   ARG  15          2HB       ARG  15   9.706  14.605  -0.762
  114   1HG   ARG  15          1HG       ARG  15  11.701  15.199   0.519
  115   2HG   ARG  15          2HG       ARG  15  12.715  14.511  -0.750
  116   1HD   ARG  15          1HD       ARG  15  11.967  16.154  -2.325
  117   2HD   ARG  15          2HD       ARG  15  10.752  16.753  -1.195
  118    HE   ARG  15           HE       ARG  15  13.370  16.933  -0.092
  119   1HH1  ARG  15          1HH1      ARG  15  11.239  18.463  -2.417
  120   2HH1  ARG  15          2HH1      ARG  15  11.935  20.045  -2.212
  121   1HH2  ARG  15          1HH2      ARG  15  14.292  19.018   0.180
  122   2HH2  ARG  15          2HH2      ARG  15  13.649  20.366  -0.719
  123    H    ALA  16           H        ALA  16   9.011  14.134   1.145
  124    HA   ALA  16           HA       ALA  16  10.574  13.902   3.607
  125   1HB   ALA  16          1HB       ALA  16   9.308  15.815   4.405
  126   2HB   ALA  16          2HB       ALA  16  10.033  16.164   2.836
  127   3HB   ALA  16          3HB       ALA  16   8.314  15.785   2.949
  128    H    ALA  17           H        ALA  17   9.964  11.872   4.296
  129    HA   ALA  17           HA       ALA  17   7.289  11.754   5.467
  130   1HB   ALA  17          1HB       ALA  17   8.472   9.522   3.819
  131   2HB   ALA  17          2HB       ALA  17   6.955   9.455   4.717
  132   3HB   ALA  17          3HB       ALA  17   7.120  10.551   3.344
  133    H    ASP  18           H        ASP  18   7.257  10.833   7.446
  134    HA   ASP  18           HA       ASP  18   9.698   9.451   8.355
  135   1HB   ASP  18          1HB       ASP  18   9.584  10.533  10.491
  136   2HB   ASP  18          2HB       ASP  18   9.478  11.801   9.274
  137    H    GLY  19           H        GLY  19   6.241   9.916   8.698
  138   1HA   GLY  19          1HA       GLY  19   5.205   7.518   8.949
  139   2HA   GLY  19          2HA       GLY  19   6.044   7.627  10.493
  140    H    ARG  20           H        ARG  20   5.655  10.412  10.908
  141    HA   ARG  20           HA       ARG  20   2.818  10.397  11.607
  142   1HB   ARG  20          1HB       ARG  20   4.977  12.344  12.437
  143   2HB   ARG  20          2HB       ARG  20   3.338  12.276  13.070
  144   1HG   ARG  20          1HG       ARG  20   3.910   9.882  13.774
  145   2HG   ARG  20          2HG       ARG  20   5.589  10.345  13.490
  146   1HD   ARG  20          1HD       ARG  20   3.645  11.621  15.404
  147   2HD   ARG  20          2HD       ARG  20   5.056  10.649  15.817
  148    HE   ARG  20           HE       ARG  20   6.251  12.601  14.516
  149   1HH1  ARG  20          1HH1      ARG  20   3.566  12.804  16.731
  150   2HH1  ARG  20          2HH1      ARG  20   3.994  14.368  17.344
  151   1HH2  ARG  20          1HH2      ARG  20   6.862  14.667  15.319
  152   2HH2  ARG  20          2HH2      ARG  20   5.878  15.429  16.531
  153    H    HIS  21           H        HIS  21   4.959  11.754   9.307
  154    HA   HIS  21           HA       HIS  21   2.630  13.019   8.100
  155   1HB   HIS  21          1HB       HIS  21   3.464  15.144   7.887
  156   2HB   HIS  21          2HB       HIS  21   4.205  14.702   9.410
  157    HD1  HIS  21           HD1      HIS  21   6.791  13.585   8.967
  158    HD2  HIS  21           HD2      HIS  21   5.213  16.249   6.183
  159    HE1  HIS  21           HE1      HIS  21   8.764  14.494   7.692
  160    HE2  HIS  21           HE2      HIS  21   7.797  16.250   6.161
  161    H    ALA  22           H        ALA  22   2.932  13.461   5.817
  162    HA   ALA  22           HA       ALA  22   5.215  12.239   4.505
  163   1HB   ALA  22          1HB       ALA  22   3.860  10.759   3.114
  164   2HB   ALA  22          2HB       ALA  22   3.697  10.345   4.821
  165   3HB   ALA  22          3HB       ALA  22   2.413  11.235   4.003
  166    H    LYS  23           H        LYS  23   5.819  13.731   3.085
  167    HA   LYS  23           HA       LYS  23   3.760  15.419   1.846
  168   1HB   LYS  23          1HB       LYS  23   5.653  16.525   3.037
  169   2HB   LYS  23          2HB       LYS  23   6.760  15.805   1.877
  170   1HG   LYS  23          1HG       LYS  23   5.839  17.082   0.086
  171   2HG   LYS  23          2HG       LYS  23   4.517  17.657   1.106
  172   1HD   LYS  23          1HD       LYS  23   6.218  18.759   2.563
  173   2HD   LYS  23          2HD       LYS  23   7.451  18.303   1.388
  174   1HE   LYS  23          1HE       LYS  23   5.030  19.964   0.717
  175   2HE   LYS  23          2HE       LYS  23   6.585  20.650   1.177
  176   1HZ   LYS  23          1HZ       LYS  23   6.344  20.582  -1.215
  177   2HZ   LYS  23          2HZ       LYS  23   7.589  19.543  -0.728
  178   3HZ   LYS  23          3HZ       LYS  23   6.085  18.909  -1.180
  179    H    VAL  24           H        VAL  24   3.009  14.488   0.066
  180    HA   VAL  24           HA       VAL  24   4.776  12.965  -1.674
  181    HB   VAL  24           HB       VAL  24   1.823  13.505  -2.035
  182   1HG1  VAL  24          1HG1      VAL  24   2.958  12.774  -4.060
  183   2HG1  VAL  24          2HG1      VAL  24   3.631  11.389  -3.200
  184   3HG1  VAL  24          3HG1      VAL  24   1.890  11.509  -3.456
  185   1HG2  VAL  24          1HG2      VAL  24   1.445  11.296  -1.041
  186   2HG2  VAL  24          2HG2      VAL  24   3.167  11.170  -0.678
  187   3HG2  VAL  24          3HG2      VAL  24   2.189  12.409   0.106
  188    H    ASN  25           H        ASN  25   6.079  14.555  -2.515
  189    HA   ASN  25           HA       ASN  25   6.793  16.148  -3.943
  190   1HB   ASN  25          1HB       ASN  25   4.193  15.444  -5.299
  191   2HB   ASN  25          2HB       ASN  25   5.328  16.606  -5.977
  192   1HD2  ASN  25          2HD2      ASN  25   5.686  15.350  -7.788
  193   2HD2  ASN  25          1HD2      ASN  25   6.613  13.893  -7.741
  194    H    GLU  26           H        GLU  26   3.440  17.097  -4.439
  195    HA   GLU  26           HA       GLU  26   4.155  19.724  -3.346
  196   1HB   GLU  26          1HB       GLU  26   2.254  18.842  -5.484
  197   2HB   GLU  26          2HB       GLU  26   2.012  20.386  -4.677
  198   1HG   GLU  26          1HG       GLU  26   4.526  19.559  -6.110
  199   2HG   GLU  26          2HG       GLU  26   3.261  20.591  -6.779
  200    H    GLN  27           H        GLN  27   2.164  17.014  -2.700
  201    HA   GLN  27           HA       GLN  27   0.419  18.687  -1.015
  202   1HB   GLN  27          1HB       GLN  27  -0.152  15.954  -2.170
  203   2HB   GLN  27          2HB       GLN  27  -1.225  16.844  -1.100
  204   1HG   GLN  27          1HG       GLN  27  -1.178  18.680  -2.873
  205   2HG   GLN  27          2HG       GLN  27  -0.476  17.459  -3.933
  206   1HE2  GLN  27          2HE2      GLN  27  -2.036  15.321  -2.607
  207   2HE2  GLN  27          1HE2      GLN  27  -3.657  15.480  -3.204
  208    H    ILE  28           H        ILE  28   0.682  18.551   1.090
  209    HA   ILE  28           HA       ILE  28   2.185  16.348   2.255
  210    HB   ILE  28           HB       ILE  28   0.872  18.685   3.660
  211   1HG1  ILE  28          1HG1      ILE  28   3.755  18.347   2.796
  212   2HG1  ILE  28          2HG1      ILE  28   2.583  19.402   2.014
  213   1HG2  ILE  28          1HG2      ILE  28   2.402  18.124   5.496
  214   2HG2  ILE  28          2HG2      ILE  28   1.310  16.790   5.123
  215   3HG2  ILE  28          3HG2      ILE  28   2.986  16.736   4.576
  216   1HD1  ILE  28          1HD1      ILE  28   3.551  19.648   4.851
  217   2HD1  ILE  28          2HD1      ILE  28   4.067  20.642   3.488
  218   3HD1  ILE  28          3HD1      ILE  28   2.398  20.717   4.054
  219    H    LEU  29           H        LEU  29   1.053  14.506   2.454
  220    HA   LEU  29           HA       LEU  29  -1.784  14.701   3.172
  221   1HB   LEU  29          1HB       LEU  29  -0.283  12.378   1.961
  222   2HB   LEU  29          2HB       LEU  29  -2.008  12.441   2.270
  223    HG   LEU  29           HG       LEU  29  -0.508  14.166   0.293
  224   1HD1  LEU  29          1HD1      LEU  29  -0.715  11.838  -0.412
  225   2HD1  LEU  29          2HD1      LEU  29  -2.456  11.909  -0.138
  226   3HD1  LEU  29          3HD1      LEU  29  -1.720  12.903  -1.395
  227   1HD2  LEU  29          1HD2      LEU  29  -2.402  15.348   1.287
  228   2HD2  LEU  29          2HD2      LEU  29  -2.713  14.945  -0.400
  229   3HD2  LEU  29          3HD2      LEU  29  -3.461  13.997   0.885
  230    H    GLN  30           H        GLN  30  -1.827  14.745   5.339
  231    HA   GLN  30           HA       GLN  30  -0.372  12.693   6.832
  232   1HB   GLN  30          1HB       GLN  30  -0.255  15.092   7.577
  233   2HB   GLN  30          2HB       GLN  30  -1.979  15.024   7.907
  234   1HG   GLN  30          1HG       GLN  30  -1.632  13.334   9.595
  235   2HG   GLN  30          2HG       GLN  30   0.088  13.271   9.212
  236   1HE2  GLN  30          2HE2      GLN  30   0.697  13.820  11.288
  237   2HE2  GLN  30          1HE2      GLN  30   0.480  15.409  11.934
  238    H    GLN  31           H        GLN  31  -1.869  11.251   5.647
  239    HA   GLN  31           HA       GLN  31  -4.123  10.510   7.280
  240   1HB   GLN  31          1HB       GLN  31  -5.678  10.549   5.248
  241   2HB   GLN  31          2HB       GLN  31  -5.312  12.102   5.989
  242   1HG   GLN  31          1HG       GLN  31  -3.590  12.478   4.256
  243   2HG   GLN  31          2HG       GLN  31  -4.073  10.968   3.489
  244   1HE2  GLN  31          2HE2      GLN  31  -4.598  12.085   1.598
  245   2HE2  GLN  31          1HE2      GLN  31  -6.032  13.039   1.463
  246    H    SER  32           H        SER  32  -5.371   8.775   5.536
  247    HA   SER  32           HA       SER  32  -3.208   6.956   4.738
  248   1HB   SER  32          1HB       SER  32  -6.120   6.277   5.230
  249   2HB   SER  32          2HB       SER  32  -4.787   5.144   5.010
  250    HG   SER  32           HG       SER  32  -5.070   5.270   7.177
  251    H    PHE  33           H        PHE  33  -2.929   6.573   2.612
  252    HA   PHE  33           HA       PHE  33  -5.134   7.045   0.767
  253   1HB   PHE  33          1HB       PHE  33  -3.765   8.530  -0.666
  254   2HB   PHE  33          2HB       PHE  33  -4.109   9.239   0.907
  255    HD1  PHE  33           HD1      PHE  33  -2.334   9.480   2.575
  256    HD2  PHE  33           HD2      PHE  33  -1.533   7.969  -1.324
  257    HE1  PHE  33           HE1      PHE  33   0.067   9.892   2.913
  258    HE2  PHE  33           HE2      PHE  33   0.870   8.377  -0.991
  259    HZ   PHE  33           HZ       PHE  33   1.671   9.340   1.128
  260    H    ILE  34           H        ILE  34  -4.629   6.373  -1.444
  261    HA   ILE  34           HA       ILE  34  -2.702   4.140  -1.453
  262    HB   ILE  34           HB       ILE  34  -5.152   4.427  -3.200
  263   1HG1  ILE  34          1HG1      ILE  34  -4.809   2.658  -0.770
  264   2HG1  ILE  34          2HG1      ILE  34  -5.704   4.173  -0.767
  265   1HG2  ILE  34          1HG2      ILE  34  -4.766   2.051  -3.682
  266   2HG2  ILE  34          2HG2      ILE  34  -3.395   3.052  -4.164
  267   3HG2  ILE  34          3HG2      ILE  34  -3.312   2.093  -2.686
  268   1HD1  ILE  34          1HD1      ILE  34  -7.195   2.275  -0.950
  269   2HD1  ILE  34          2HD1      ILE  34  -7.253   3.252  -2.416
  270   3HD1  ILE  34          3HD1      ILE  34  -6.356   1.734  -2.405
  271    H    LEU  35           H        LEU  35  -0.972   4.499  -2.680
  272    HA   LEU  35           HA       LEU  35  -1.179   6.471  -4.849
  273   1HB   LEU  35          1HB       LEU  35   0.468   7.010  -3.143
  274   2HB   LEU  35          2HB       LEU  35   1.228   5.444  -3.345
  275    HG   LEU  35           HG       LEU  35   1.892   6.071  -5.639
  276   1HD1  LEU  35          1HD1      LEU  35   1.671   8.382  -6.383
  277   2HD1  LEU  35          2HD1      LEU  35   0.090   7.641  -6.127
  278   3HD1  LEU  35          3HD1      LEU  35   0.741   8.767  -4.935
  279   1HD2  LEU  35          1HD2      LEU  35   2.730   8.033  -3.508
  280   2HD2  LEU  35          2HD2      LEU  35   3.434   6.444  -3.796
  281   3HD2  LEU  35          3HD2      LEU  35   3.596   7.712  -5.010
  282    H    MET  36           H        MET  36  -1.361   5.684  -6.804
  283    HA   MET  36           HA       MET  36   0.065   3.199  -7.488
  284   1HB   MET  36          1HB       MET  36  -2.407   4.369  -8.800
  285   2HB   MET  36          2HB       MET  36  -1.598   2.884  -9.280
  286   1HG   MET  36          1HG       MET  36  -2.158   1.866  -7.147
  287   2HG   MET  36          2HG       MET  36  -2.932   3.361  -6.625
  288   1HE   MET  36          1HE       MET  36  -3.019   1.572 -10.152
  289   2HE   MET  36          2HE       MET  36  -4.503   0.632  -9.999
  290   3HE   MET  36          3HE       MET  36  -3.110   0.253  -8.985
  291    HA   PRO  37           HA       PRO  37   2.538   5.656 -10.162
  292   1HB   PRO  37          1HB       PRO  37   3.197   3.889 -12.106
  293   2HB   PRO  37          2HB       PRO  37   3.828   3.783 -10.458
  294   1HG   PRO  37          1HG       PRO  37   1.587   2.266 -11.734
  295   2HG   PRO  37          2HG       PRO  37   2.870   1.676 -10.662
  296   1HD   PRO  37          1HD       PRO  37   0.348   2.210  -9.802
  297   2HD   PRO  37          2HD       PRO  37   1.779   2.379  -8.765
  298    H    ASP  38           H        ASP  38  -0.289   5.988 -10.656
  299    HA   ASP  38           HA       ASP  38  -0.188   7.308 -13.136
  300   1HB   ASP  38          1HB       ASP  38  -1.664   6.039 -14.521
  301   2HB   ASP  38          2HB       ASP  38  -0.424   4.923 -13.962
  302    H    GLU  39           H        GLU  39  -2.083   5.916 -10.549
  303    HA   GLU  39           HA       GLU  39  -3.836   8.268 -10.637
  304   1HB   GLU  39          1HB       GLU  39  -5.089   6.420 -11.588
  305   2HB   GLU  39          2HB       GLU  39  -4.692   5.400 -10.213
  306   1HG   GLU  39          1HG       GLU  39  -6.028   6.739  -8.752
  307   2HG   GLU  39          2HG       GLU  39  -6.298   7.933 -10.021
  308    H    LEU  40           H        LEU  40  -4.404   9.119  -8.676
  309    HA   LEU  40           HA       LEU  40  -3.200   7.845  -6.315
  310   1HB   LEU  40          1HB       LEU  40  -2.061   9.912  -6.876
  311   2HB   LEU  40          2HB       LEU  40  -3.584  10.776  -6.931
  312    HG   LEU  40           HG       LEU  40  -3.870  10.407  -4.505
  313   1HD1  LEU  40          1HD1      LEU  40  -2.602   8.341  -4.280
  314   2HD1  LEU  40          2HD1      LEU  40  -1.109   9.201  -4.661
  315   3HD1  LEU  40          3HD1      LEU  40  -1.991   9.578  -3.180
  316   1HD2  LEU  40          1HD2      LEU  40  -2.110  11.948  -3.774
  317   2HD2  LEU  40          2HD2      LEU  40  -1.252  11.683  -5.291
  318   3HD2  LEU  40          3HD2      LEU  40  -2.836  12.460  -5.298
  319    H    VAL  41           H        VAL  41  -4.610   7.125  -4.891
  320    HA   VAL  41           HA       VAL  41  -7.289   8.319  -4.765
  321    HB   VAL  41           HB       VAL  41  -6.256   5.833  -3.377
  322   1HG1  VAL  41          1HG1      VAL  41  -8.112   6.869  -2.199
  323   2HG1  VAL  41          2HG1      VAL  41  -9.060   6.900  -3.686
  324   3HG1  VAL  41          3HG1      VAL  41  -8.622   5.357  -2.950
  325   1HG2  VAL  41          1HG2      VAL  41  -7.953   6.078  -5.858
  326   2HG2  VAL  41          2HG2      VAL  41  -6.280   5.525  -5.793
  327   3HG2  VAL  41          3HG2      VAL  41  -7.554   4.573  -5.030
  328    H    GLU  42           H        GLU  42  -7.243  10.086  -3.523
  329    HA   GLU  42           HA       GLU  42  -5.240  10.408  -1.483
  330   1HB   GLU  42          1HB       GLU  42  -7.521  12.197  -2.331
  331   2HB   GLU  42          2HB       GLU  42  -6.261  12.649  -1.193
  332   1HG   GLU  42          1HG       GLU  42  -4.581  12.393  -2.947
  333   2HG   GLU  42          2HG       GLU  42  -5.845  11.931  -4.086
  334    H    HIS  43           H        HIS  43  -8.661   9.663  -1.568
  335    HA   HIS  43           HA       HIS  43  -8.763  10.039   1.349
  336   1HB   HIS  43          1HB       HIS  43 -11.083   9.966  -0.590
  337   2HB   HIS  43          2HB       HIS  43 -11.175  10.299   1.137
  338    HD1  HIS  43           HD1      HIS  43  -9.952  12.586   1.919
  339    HD2  HIS  43           HD2      HIS  43 -10.636  12.144  -2.162
  340    HE1  HIS  43           HE1      HIS  43  -9.717  14.890   0.934
  341    HE2  HIS  43           HE2      HIS  43 -10.254  14.618  -1.515
  342    H    TRP  44           H        TRP  44  -7.963   8.046   1.953
  343    HA   TRP  44           HA       TRP  44  -9.965   5.912   1.716
  344   1HB   TRP  44          1HB       TRP  44  -8.002   5.416   0.248
  345   2HB   TRP  44          2HB       TRP  44  -6.969   5.462   1.671
  346    HD1  TRP  44           HD1      TRP  44 -10.281   3.563   0.878
  347    HE1  TRP  44           HE1      TRP  44  -9.947   1.096   1.545
  348    HE3  TRP  44           HE3      TRP  44  -5.442   3.819   2.515
  349    HZ2  TRP  44           HZ2      TRP  44  -7.893  -0.522   2.611
  350    HZ3  TRP  44           HZ3      TRP  44  -4.366   1.764   3.337
  351    HH2  TRP  44           HH2      TRP  44  -5.569  -0.359   3.383
  352    HA   PRO  45           HA       PRO  45  -9.156   7.185   6.062
  353   1HB   PRO  45          1HB       PRO  45 -11.951   6.346   6.424
  354   2HB   PRO  45          2HB       PRO  45 -11.186   7.896   6.785
  355   1HG   PRO  45          1HG       PRO  45 -12.898   7.616   4.737
  356   2HG   PRO  45          2HG       PRO  45 -11.494   8.695   4.640
  357   1HD   PRO  45          1HD       PRO  45 -11.844   5.939   3.516
  358   2HD   PRO  45          2HD       PRO  45 -11.117   7.375   2.764
  359    H    VAL  46           H        VAL  46  -7.780   5.361   6.317
  360    HA   VAL  46           HA       VAL  46  -9.083   3.246   7.876
  361    HB   VAL  46           HB       VAL  46  -6.938   2.807   5.783
  362   1HG1  VAL  46          1HG1      VAL  46  -6.945   0.453   6.473
  363   2HG1  VAL  46          2HG1      VAL  46  -6.397   1.510   7.774
  364   3HG1  VAL  46          3HG1      VAL  46  -8.032   0.851   7.804
  365   1HG2  VAL  46          1HG2      VAL  46  -9.719   1.674   6.076
  366   2HG2  VAL  46          2HG2      VAL  46  -9.209   2.887   4.902
  367   3HG2  VAL  46          3HG2      VAL  46  -8.561   1.248   4.814
  368    HA   PRO  47           HA       PRO  47  -5.823   5.027  10.462
  369   1HB   PRO  47          1HB       PRO  47  -7.375   4.123  12.723
  370   2HB   PRO  47          2HB       PRO  47  -7.080   5.775  12.182
  371   1HG   PRO  47          1HG       PRO  47  -9.527   4.556  12.074
  372   2HG   PRO  47          2HG       PRO  47  -9.030   5.869  10.993
  373   1HD   PRO  47          1HD       PRO  47  -9.091   2.916  10.487
  374   2HD   PRO  47          2HD       PRO  47  -9.548   4.254   9.410
  375    H    SER  48           H        SER  48  -4.201   3.562  10.109
  376    HA   SER  48           HA       SER  48  -2.712   1.933  10.636
  377   1HB   SER  48          1HB       SER  48  -4.392   1.593  13.135
  378   2HB   SER  48          2HB       SER  48  -2.751   0.989  12.898
  379    HG   SER  48           HG       SER  48  -3.423   3.731  12.683
  380    H    LEU  49           H        LEU  49  -2.809  -0.556  11.649
  381    HA   LEU  49           HA       LEU  49  -4.703  -1.922   9.905
  382   1HB   LEU  49          1HB       LEU  49  -2.487  -3.048  11.628
  383   2HB   LEU  49          2HB       LEU  49  -3.434  -3.946  10.457
  384    HG   LEU  49           HG       LEU  49  -1.466  -1.736   9.863
  385   1HD1  LEU  49          1HD1      LEU  49  -0.419  -3.854  10.407
  386   2HD1  LEU  49          2HD1      LEU  49  -1.437  -4.682   9.228
  387   3HD1  LEU  49          3HD1      LEU  49  -0.242  -3.500   8.689
  388   1HD2  LEU  49          1HD2      LEU  49  -1.929  -2.191   7.504
  389   2HD2  LEU  49          2HD2      LEU  49  -3.212  -3.306   7.971
  390   3HD2  LEU  49          3HD2      LEU  49  -3.358  -1.589   8.343
  391    H    GLY  50           H        GLY  50  -5.849  -3.861  10.839
  392   1HA   GLY  50          1HA       GLY  50  -6.599  -4.718  13.123
  393   2HA   GLY  50          2HA       GLY  50  -6.985  -3.030  13.429
  394    H    GLN  51           H        GLN  51  -8.555  -2.004  11.928
  395    HA   GLN  51           HA       GLN  51 -10.713  -3.870  11.402
  396   1HB   GLN  51          1HB       GLN  51 -12.005  -1.774  10.799
  397   2HB   GLN  51          2HB       GLN  51 -11.483  -1.927  12.465
  398   1HG   GLN  51          1HG       GLN  51 -11.217   0.338  11.736
  399   2HG   GLN  51          2HG       GLN  51  -9.633  -0.377  12.010
  400   1HE2  GLN  51          2HE2      GLN  51  -8.209  -0.517  10.353
  401   2HE2  GLN  51          1HE2      GLN  51  -8.512   0.113   8.770
  402    H    LEU  52           H        LEU  52  -8.135  -3.401   9.753
  403    HA   LEU  52           HA       LEU  52  -9.126  -2.762   7.143
  404   1HB   LEU  52          1HB       LEU  52  -6.766  -2.403   7.768
  405   2HB   LEU  52          2HB       LEU  52  -6.561  -4.133   7.965
  406    HG   LEU  52           HG       LEU  52  -7.013  -4.461   5.567
  407   1HD1  LEU  52          1HD1      LEU  52  -7.103  -1.450   5.466
  408   2HD1  LEU  52          2HD1      LEU  52  -7.089  -2.527   4.069
  409   3HD1  LEU  52          3HD1      LEU  52  -8.458  -2.544   5.182
  410   1HD2  LEU  52          1HD2      LEU  52  -4.930  -3.503   4.731
  411   2HD2  LEU  52          2HD2      LEU  52  -4.844  -2.449   6.143
  412   3HD2  LEU  52          3HD2      LEU  52  -4.715  -4.197   6.338
  413    H    GLN  53           H        GLN  53 -10.411  -4.040   6.068
  414    HA   GLN  53           HA       GLN  53  -9.971  -6.924   6.019
  415   1HB   GLN  53          1HB       GLN  53 -12.585  -5.583   6.750
  416   2HB   GLN  53          2HB       GLN  53 -12.458  -7.271   6.275
  417   1HG   GLN  53          1HG       GLN  53 -11.109  -7.764   8.198
  418   2HG   GLN  53          2HG       GLN  53 -11.041  -6.057   8.635
  419   1HE2  GLN  53          2HE2      GLN  53 -11.943  -6.459  10.649
  420   2HE2  GLN  53          1HE2      GLN  53 -13.624  -6.815  10.849
  421    HA   PRO  54           HA       PRO  54 -10.934  -6.715   1.701
  422   1HB   PRO  54          1HB       PRO  54 -13.281  -8.501   2.114
  423   2HB   PRO  54          2HB       PRO  54 -11.924  -8.665   0.995
  424   1HG   PRO  54          1HG       PRO  54 -12.055 -10.163   3.190
  425   2HG   PRO  54          2HG       PRO  54 -10.506  -9.501   2.631
  426   1HD   PRO  54          1HD       PRO  54 -12.252  -8.609   4.885
  427   2HD   PRO  54          2HD       PRO  54 -10.479  -8.654   4.777
  428    H    ALA  55           H        ALA  55 -13.549  -6.173   3.952
  429    HA   ALA  55           HA       ALA  55 -15.384  -5.012   2.116
  430   1HB   ALA  55          1HB       ALA  55 -15.169  -4.642   5.102
  431   2HB   ALA  55          2HB       ALA  55 -16.560  -4.226   4.100
  432   3HB   ALA  55          3HB       ALA  55 -16.077  -5.912   4.282
  433    H    HIS  56           H        HIS  56 -12.675  -3.780   3.947
  434    HA   HIS  56           HA       HIS  56 -13.362  -1.025   3.185
  435   1HB   HIS  56          1HB       HIS  56 -11.370  -2.076   5.210
  436   2HB   HIS  56          2HB       HIS  56 -11.579  -0.373   4.821
  437    HD1  HIS  56           HD1      HIS  56 -12.189  -2.056   7.606
  438    HD2  HIS  56           HD2      HIS  56 -14.892  -0.322   4.958
  439    HE1  HIS  56           HE1      HIS  56 -14.281  -1.649   8.938
  440    HE2  HIS  56           HE2      HIS  56 -15.921  -0.638   7.311
  441    H    MET  57           H        MET  57 -11.208  -3.609   2.573
  442    HA   MET  57           HA       MET  57  -9.277  -1.925   1.164
  443   1HB   MET  57          1HB       MET  57  -8.609  -3.809   2.736
  444   2HB   MET  57          2HB       MET  57  -9.232  -4.926   1.533
  445   1HG   MET  57          1HG       MET  57  -7.606  -4.136  -0.079
  446   2HG   MET  57          2HG       MET  57  -7.001  -2.957   1.086
  447   1HE   MET  57          1HE       MET  57  -4.046  -5.486   0.978
  448   2HE   MET  57          2HE       MET  57  -4.535  -3.797   0.843
  449   3HE   MET  57          3HE       MET  57  -5.048  -4.964  -0.376
  450    H    ASP  58           H        ASP  58 -12.176  -3.019   0.473
  451    HA   ASP  58           HA       ASP  58 -12.141  -4.711  -1.691
  452   1HB   ASP  58          1HB       ASP  58 -14.199  -4.005  -0.575
  453   2HB   ASP  58          2HB       ASP  58 -14.003  -2.375  -1.216
  454    H    ALA  59           H        ALA  59 -11.959  -1.166  -1.762
  455    HA   ALA  59           HA       ALA  59 -11.899  -0.804  -4.512
  456   1HB   ALA  59          1HB       ALA  59 -10.858   1.352  -4.062
  457   2HB   ALA  59          2HB       ALA  59 -12.156   1.028  -2.912
  458   3HB   ALA  59          3HB       ALA  59 -10.473   0.833  -2.421
  459    H    VAL  60           H        VAL  60  -9.244  -1.469  -2.275
  460    HA   VAL  60           HA       VAL  60  -7.120  -1.119  -4.087
  461    HB   VAL  60           HB       VAL  60  -7.189  -2.995  -1.716
  462   1HG1  VAL  60          1HG1      VAL  60  -5.286  -3.372  -3.173
  463   2HG1  VAL  60          2HG1      VAL  60  -4.882  -1.657  -3.119
  464   3HG1  VAL  60          3HG1      VAL  60  -4.767  -2.637  -1.656
  465   1HG2  VAL  60          1HG2      VAL  60  -6.453  -0.073  -1.825
  466   2HG2  VAL  60          2HG2      VAL  60  -7.875  -0.764  -1.041
  467   3HG2  VAL  60          3HG2      VAL  60  -6.263  -1.129  -0.425
  468    H    LEU  61           H        LEU  61  -9.022  -3.960  -3.190
  469    HA   LEU  61           HA       LEU  61  -7.545  -5.810  -4.756
  470   1HB   LEU  61          1HB       LEU  61 -10.397  -5.987  -3.780
  471   2HB   LEU  61          2HB       LEU  61  -9.434  -7.325  -4.376
  472    HG   LEU  61           HG       LEU  61  -8.859  -5.730  -1.877
  473   1HD1  LEU  61          1HD1      LEU  61 -10.828  -7.144  -1.643
  474   2HD1  LEU  61          2HD1      LEU  61  -9.911  -8.534  -2.226
  475   3HD1  LEU  61          3HD1      LEU  61  -9.481  -7.774  -0.693
  476   1HD2  LEU  61          1HD2      LEU  61  -6.819  -6.551  -2.930
  477   2HD2  LEU  61          2HD2      LEU  61  -7.159  -7.437  -1.443
  478   3HD2  LEU  61          3HD2      LEU  61  -7.500  -8.176  -3.007
  479    H    ALA  62           H        ALA  62 -10.200  -3.656  -5.417
  480    HA   ALA  62           HA       ALA  62 -10.974  -4.921  -7.878
  481   1HB   ALA  62          1HB       ALA  62 -12.473  -3.031  -8.148
  482   2HB   ALA  62          2HB       ALA  62 -12.576  -3.672  -6.508
  483   3HB   ALA  62          3HB       ALA  62 -11.675  -2.188  -6.819
  484    H    LEU  63           H        LEU  63  -8.605  -2.592  -6.956
  485    HA   LEU  63           HA       LEU  63  -8.406  -1.312  -9.520
  486   1HB   LEU  63          1HB       LEU  63  -6.550  -1.304  -7.141
  487   2HB   LEU  63          2HB       LEU  63  -6.329  -0.315  -8.572
  488    HG   LEU  63           HG       LEU  63  -8.706  -0.152  -6.716
  489   1HD1  LEU  63          1HD1      LEU  63  -7.743   1.967  -5.988
  490   2HD1  LEU  63          2HD1      LEU  63  -6.668   0.616  -5.629
  491   3HD1  LEU  63          3HD1      LEU  63  -6.327   1.675  -6.997
  492   1HD2  LEU  63          1HD2      LEU  63  -9.229   1.891  -7.950
  493   2HD2  LEU  63          2HD2      LEU  63  -7.869   1.591  -9.030
  494   3HD2  LEU  63          3HD2      LEU  63  -9.239   0.481  -9.010
  495    H    ASN  64           H        ASN  64  -7.497  -4.305  -8.436
  496    HA   ASN  64           HA       ASN  64  -6.269  -5.999  -9.304
  497   1HB   ASN  64          1HB       ASN  64  -7.126  -5.321 -11.492
  498   2HB   ASN  64          2HB       ASN  64  -5.841  -4.129 -11.646
  499   1HD2  ASN  64          2HD2      ASN  64  -6.630  -7.518 -11.673
  500   2HD2  ASN  64          1HD2      ASN  64  -5.159  -8.061 -12.403
  501    HA   PRO  65           HA       PRO  65  -2.254  -4.319  -8.041
  502   1HB   PRO  65          1HB       PRO  65  -2.197  -5.342  -5.551
  503   2HB   PRO  65          2HB       PRO  65  -3.045  -3.841  -5.932
  504   1HG   PRO  65          1HG       PRO  65  -4.142  -6.477  -5.248
  505   2HG   PRO  65          2HG       PRO  65  -4.923  -4.889  -5.198
  506   1HD   PRO  65          1HD       PRO  65  -5.086  -6.934  -7.250
  507   2HD   PRO  65          2HD       PRO  65  -5.998  -5.416  -7.120
  508    H    ALA  66           H        ALA  66  -0.366  -5.378  -8.344
  509    HA   ALA  66           HA       ALA  66  -0.390  -8.312  -8.372
  510   1HB   ALA  66          1HB       ALA  66   1.750  -8.136  -9.547
  511   2HB   ALA  66          2HB       ALA  66   0.499  -7.202 -10.366
  512   3HB   ALA  66          3HB       ALA  66   1.706  -6.381  -9.376
  513    H    VAL  67           H        VAL  67   1.099  -5.529  -6.875
  514    HA   VAL  67           HA       VAL  67   1.870  -7.194  -4.614
  515    HB   VAL  67           HB       VAL  67   3.927  -7.044  -5.916
  516   1HG1  VAL  67          1HG1      VAL  67   3.473  -5.025  -7.182
  517   2HG1  VAL  67          2HG1      VAL  67   3.606  -4.054  -5.715
  518   3HG1  VAL  67          3HG1      VAL  67   5.022  -4.898  -6.347
  519   1HG2  VAL  67          1HG2      VAL  67   5.392  -6.041  -4.216
  520   2HG2  VAL  67          2HG2      VAL  67   3.983  -5.292  -3.463
  521   3HG2  VAL  67          3HG2      VAL  67   4.132  -7.049  -3.503
  522    H    ILE  68           H        ILE  68   1.416  -6.240  -2.719
  523    HA   ILE  68           HA       ILE  68   0.549  -3.423  -2.808
  524    HB   ILE  68           HB       ILE  68  -0.456  -5.586  -0.945
  525   1HG1  ILE  68          1HG1      ILE  68  -1.841  -4.346  -3.333
  526   2HG1  ILE  68          2HG1      ILE  68  -1.114  -5.949  -3.324
  527   1HG2  ILE  68          1HG2      ILE  68  -2.198  -3.945  -0.386
  528   2HG2  ILE  68          2HG2      ILE  68  -0.583  -3.353   0.008
  529   3HG2  ILE  68          3HG2      ILE  68  -1.410  -2.766  -1.435
  530   1HD1  ILE  68          1HD1      ILE  68  -3.405  -5.047  -1.595
  531   2HD1  ILE  68          2HD1      ILE  68  -3.525  -6.052  -3.040
  532   3HD1  ILE  68          3HD1      ILE  68  -2.687  -6.658  -1.611
  533    H    LEU  69           H        LEU  69   1.605  -2.052  -1.546
  534    HA   LEU  69           HA       LEU  69   3.353  -3.151   0.554
  535   1HB   LEU  69          1HB       LEU  69   3.627  -0.581  -1.011
  536   2HB   LEU  69          2HB       LEU  69   4.695  -1.092   0.280
  537    HG   LEU  69           HG       LEU  69   4.335  -2.519  -2.358
  538   1HD1  LEU  69          1HD1      LEU  69   6.609  -0.837  -1.309
  539   2HD1  LEU  69          2HD1      LEU  69   6.606  -1.736  -2.825
  540   3HD1  LEU  69          3HD1      LEU  69   5.494  -0.387  -2.600
  541   1HD2  LEU  69          1HD2      LEU  69   4.878  -4.051  -0.537
  542   2HD2  LEU  69          2HD2      LEU  69   6.244  -3.865  -1.638
  543   3HD2  LEU  69          3HD2      LEU  69   6.245  -3.034  -0.083
  544    H    LEU  70           H        LEU  70   2.688  -2.770   2.542
  545    HA   LEU  70           HA       LEU  70   0.864  -0.529   3.041
  546   1HB   LEU  70          1HB       LEU  70   1.425  -3.119   4.396
  547   2HB   LEU  70          2HB       LEU  70   0.912  -1.779   5.395
  548    HG   LEU  70           HG       LEU  70  -0.974  -3.202   4.793
  549   1HD1  LEU  70          1HD1      LEU  70  -1.049  -0.507   3.449
  550   2HD1  LEU  70          2HD1      LEU  70  -2.457  -1.479   3.877
  551   3HD1  LEU  70          3HD1      LEU  70  -1.404  -0.845   5.142
  552   1HD2  LEU  70          1HD2      LEU  70  -0.311  -2.467   1.947
  553   2HD2  LEU  70          2HD2      LEU  70  -0.152  -4.066   2.674
  554   3HD2  LEU  70          3HD2      LEU  70  -1.748  -3.339   2.479
  555    H    GLY  71           H        GLY  71   1.625   1.271   3.916
  556   1HA   GLY  71          1HA       GLY  71   4.132   1.106   5.475
  557   2HA   GLY  71          2HA       GLY  71   3.616   2.528   4.575
  558    H    THR  72           H        THR  72   3.506   0.899   7.568
  559    HA   THR  72           HA       THR  72   1.269   2.551   8.486
  560    HB   THR  72           HB       THR  72   1.423   1.119  10.570
  561    HG1  THR  72           HG1      THR  72   3.455   0.231  10.422
  562   1HG2  THR  72          1HG2      THR  72   0.311  -0.799   9.521
  563   2HG2  THR  72          2HG2      THR  72  -0.255   0.725   8.836
  564   3HG2  THR  72          3HG2      THR  72   0.893  -0.270   7.942
  565    H    GLY  73           H        GLY  73   2.880   4.381   8.218
  566   1HA   GLY  73          1HA       GLY  73   4.108   6.036   9.234
  567   2HA   GLY  73          2HA       GLY  73   3.658   5.303  10.765
  568    H    GLU  74           H        GLU  74   5.459   5.122  11.923
  569    HA   GLU  74           HA       GLU  74   7.811   3.888  10.646
  570   1HB   GLU  74          1HB       GLU  74   8.174   6.259  11.301
  571   2HB   GLU  74          2HB       GLU  74   7.777   5.843  12.961
  572   1HG   GLU  74          1HG       GLU  74  10.205   6.065  12.525
  573   2HG   GLU  74          2HG       GLU  74   9.736   4.494  13.167
  574    H    ARG  75           H        ARG  75   5.546   2.562  11.830
  575    HA   ARG  75           HA       ARG  75   7.054   0.918  13.704
  576   1HB   ARG  75          1HB       ARG  75   5.731   2.426  15.133
  577   2HB   ARG  75          2HB       ARG  75   4.263   1.918  14.306
  578   1HG   ARG  75          1HG       ARG  75   4.559  -0.346  15.120
  579   2HG   ARG  75          2HG       ARG  75   6.072   0.117  15.899
  580   1HD   ARG  75          1HD       ARG  75   4.864   1.670  17.336
  581   2HD   ARG  75          2HD       ARG  75   3.349   1.235  16.543
  582    HE   ARG  75           HE       ARG  75   4.371  -1.141  17.441
  583   1HH1  ARG  75          1HH1      ARG  75   3.601   1.931  18.941
  584   2HH1  ARG  75          2HH1      ARG  75   3.123   1.217  20.454
  585   1HH2  ARG  75          1HH2      ARG  75   3.762  -2.076  19.440
  586   2HH2  ARG  75          2HH2      ARG  75   3.235  -1.054  20.743
  587    H    GLN  76           H        GLN  76   6.715  -1.211  13.393
  588    HA   GLN  76           HA       GLN  76   5.163  -1.925  11.062
  589   1HB   GLN  76          1HB       GLN  76   7.512  -2.846  12.122
  590   2HB   GLN  76          2HB       GLN  76   6.383  -4.082  12.655
  591   1HG   GLN  76          1HG       GLN  76   6.928  -3.224   9.826
  592   2HG   GLN  76          2HG       GLN  76   7.364  -4.757  10.580
  593   1HE2  GLN  76          2HE2      GLN  76   5.738  -6.272  11.011
  594   2HE2  GLN  76          1HE2      GLN  76   4.196  -6.195  10.225
  595    H    GLN  77           H        GLN  77   3.258  -2.974  11.032
  596    HA   GLN  77           HA       GLN  77   2.128  -3.859  13.607
  597   1HB   GLN  77          1HB       GLN  77   0.670  -2.494  11.330
  598   2HB   GLN  77          2HB       GLN  77  -0.089  -3.131  12.781
  599   1HG   GLN  77          1HG       GLN  77   1.103  -1.530  14.146
  600   2HG   GLN  77          2HG       GLN  77   1.958  -0.925  12.728
  601   1HE2  GLN  77          2HE2      GLN  77   1.190   1.150  13.003
  602   2HE2  GLN  77          1HE2      GLN  77  -0.452   1.586  12.689
  603    H    PHE  78           H        PHE  78   0.389  -5.515  13.331
  604    HA   PHE  78           HA       PHE  78   1.137  -7.317  11.151
  605   1HB   PHE  78          1HB       PHE  78   0.035  -9.094  12.498
  606   2HB   PHE  78          2HB       PHE  78   1.371  -8.319  13.337
  607    HD1  PHE  78           HD1      PHE  78   0.873  -6.660  15.145
  608    HD2  PHE  78           HD2      PHE  78  -2.141  -9.097  13.385
  609    HE1  PHE  78           HE1      PHE  78  -0.593  -6.233  17.075
  610    HE2  PHE  78           HE2      PHE  78  -3.613  -8.671  15.308
  611    HZ   PHE  78           HZ       PHE  78  -2.840  -7.238  17.158
  612    HA   PRO  79           HA       PRO  79  -2.639  -6.238   9.069
  613   1HB   PRO  79          1HB       PRO  79  -2.081  -8.713   7.548
  614   2HB   PRO  79          2HB       PRO  79  -2.275  -7.056   6.967
  615   1HG   PRO  79          1HG       PRO  79   0.125  -8.238   7.024
  616   2HG   PRO  79          2HG       PRO  79  -0.068  -6.512   7.382
  617   1HD   PRO  79          1HD       PRO  79   0.323  -8.806   9.263
  618   2HD   PRO  79          2HD       PRO  79   1.018  -7.172   9.319
  619    H    SER  80           H        SER  80  -4.744  -6.914   9.109
  620    HA   SER  80           HA       SER  80  -5.542  -8.812  11.012
  621   1HB   SER  80          1HB       SER  80  -7.211  -7.734   8.729
  622   2HB   SER  80          2HB       SER  80  -7.786  -8.329  10.288
  623    HG   SER  80           HG       SER  80  -7.687  -6.266  10.768
  624    H    THR  81           H        THR  81  -6.438 -10.864  10.798
  625    HA   THR  81           HA       THR  81  -5.217 -12.584   8.982
  626    HB   THR  81           HB       THR  81  -7.261 -14.099   9.814
  627    HG1  THR  81           HG1      THR  81  -8.505 -12.892  11.054
  628   1HG2  THR  81          1HG2      THR  81  -4.991 -13.166  11.579
  629   2HG2  THR  81          2HG2      THR  81  -5.918 -14.652  11.788
  630   3HG2  THR  81          3HG2      THR  81  -4.895 -14.445  10.368
  631    H    ASP  82           H        ASP  82  -8.291 -10.923   8.814
  632    HA   ASP  82           HA       ASP  82  -9.509 -12.343   6.734
  633   1HB   ASP  82          1HB       ASP  82  -9.679  -9.379   7.338
  634   2HB   ASP  82          2HB       ASP  82 -10.804 -10.282   6.328
  635    H    VAL  83           H        VAL  83  -7.263  -9.608   6.649
  636    HA   VAL  83           HA       VAL  83  -7.250  -9.324   3.825
  637    HB   VAL  83           HB       VAL  83  -5.115  -8.494   5.801
  638   1HG1  VAL  83          1HG1      VAL  83  -5.692  -7.529   3.001
  639   2HG1  VAL  83          2HG1      VAL  83  -4.480  -6.856   4.093
  640   3HG1  VAL  83          3HG1      VAL  83  -4.315  -8.510   3.500
  641   1HG2  VAL  83          1HG2      VAL  83  -6.203  -6.295   5.752
  642   2HG2  VAL  83          2HG2      VAL  83  -7.487  -6.961   4.745
  643   3HG2  VAL  83          3HG2      VAL  83  -7.269  -7.542   6.395
  644    H    LEU  84           H        LEU  84  -5.230 -11.068   6.130
  645    HA   LEU  84           HA       LEU  84  -3.223 -11.945   4.396
  646   1HB   LEU  84          1HB       LEU  84  -4.383 -13.333   6.815
  647   2HB   LEU  84          2HB       LEU  84  -2.881 -13.780   6.029
  648    HG   LEU  84           HG       LEU  84  -3.424 -11.148   7.407
  649   1HD1  LEU  84          1HD1      LEU  84  -1.823 -11.955   9.070
  650   2HD1  LEU  84          2HD1      LEU  84  -3.248 -12.990   8.976
  651   3HD1  LEU  84          3HD1      LEU  84  -1.735 -13.504   8.230
  652   1HD2  LEU  84          1HD2      LEU  84  -0.906 -12.235   6.150
  653   2HD2  LEU  84          2HD2      LEU  84  -1.880 -10.897   5.543
  654   3HD2  LEU  84          3HD2      LEU  84  -1.029 -10.742   7.080
  655    H    ALA  85           H        ALA  85  -6.362 -13.357   5.190
  656    HA   ALA  85           HA       ALA  85  -6.099 -15.748   3.755
  657   1HB   ALA  85          1HB       ALA  85  -8.531 -15.869   3.825
  658   2HB   ALA  85          2HB       ALA  85  -7.884 -15.347   5.380
  659   3HB   ALA  85          3HB       ALA  85  -8.614 -14.169   4.289
  660    H    ALA  86           H        ALA  86  -7.512 -12.635   2.758
  661    HA   ALA  86           HA       ALA  86  -8.158 -13.400   0.127
  662   1HB   ALA  86          1HB       ALA  86  -7.498 -10.646   1.169
  663   2HB   ALA  86          2HB       ALA  86  -8.333 -11.013  -0.341
  664   3HB   ALA  86          3HB       ALA  86  -9.088 -11.408   1.203
  665    H    CYS  87           H        CYS  87  -5.285 -11.888   1.502
  666    HA   CYS  87           HA       CYS  87  -3.810 -11.400  -0.793
  667   1HB   CYS  87          1HB       CYS  87  -3.003 -10.533   1.253
  668   2HB   CYS  87          2HB       CYS  87  -3.022 -12.113   2.025
  669    HG   CYS  87           HG       CYS  87  -0.854 -11.271  -0.490
  670    H    LEU  88           H        LEU  88  -3.697 -14.294   1.276
  671    HA   LEU  88           HA       LEU  88  -1.808 -15.642  -0.348
  672   1HB   LEU  88          1HB       LEU  88  -3.704 -16.756   1.718
  673   2HB   LEU  88          2HB       LEU  88  -2.321 -17.597   1.050
  674    HG   LEU  88           HG       LEU  88  -2.186 -15.074   2.702
  675   1HD1  LEU  88          1HD1      LEU  88  -1.525 -17.929   3.403
  676   2HD1  LEU  88          2HD1      LEU  88  -1.233 -16.522   4.426
  677   3HD1  LEU  88          3HD1      LEU  88  -2.884 -16.992   4.022
  678   1HD2  LEU  88          1HD2      LEU  88  -0.004 -16.865   1.638
  679   2HD2  LEU  88          2HD2      LEU  88  -0.368 -15.230   1.086
  680   3HD2  LEU  88          3HD2      LEU  88   0.223 -15.496   2.725
  681    H    THR  89           H        THR  89  -5.327 -15.731  -0.187
  682    HA   THR  89           HA       THR  89  -5.644 -18.064  -1.751
  683    HB   THR  89           HB       THR  89  -7.606 -15.803  -1.325
  684    HG1  THR  89           HG1      THR  89  -7.167 -16.647   0.660
  685   1HG2  THR  89          1HG2      THR  89  -8.223 -17.245  -3.212
  686   2HG2  THR  89          2HG2      THR  89  -8.063 -18.666  -2.180
  687   3HG2  THR  89          3HG2      THR  89  -9.320 -17.473  -1.849
  688    H    ARG  90           H        ARG  90  -5.524 -14.619  -2.607
  689    HA   ARG  90           HA       ARG  90  -6.077 -15.273  -5.382
  690   1HB   ARG  90          1HB       ARG  90  -5.515 -12.620  -4.060
  691   2HB   ARG  90          2HB       ARG  90  -5.881 -12.825  -5.768
  692   1HG   ARG  90          1HG       ARG  90  -8.000 -14.079  -4.748
  693   2HG   ARG  90          2HG       ARG  90  -7.661 -12.979  -3.410
  694   1HD   ARG  90          1HD       ARG  90  -9.221 -11.939  -4.928
  695   2HD   ARG  90          2HD       ARG  90  -7.675 -11.092  -5.003
  696    HE   ARG  90           HE       ARG  90  -8.039 -13.177  -6.987
  697   1HH1  ARG  90          1HH1      ARG  90  -8.379  -9.769  -6.256
  698   2HH1  ARG  90          2HH1      ARG  90  -8.393  -9.278  -7.925
  699   1HH2  ARG  90          1HH2      ARG  90  -8.053 -12.551  -9.165
  700   2HH2  ARG  90          2HH2      ARG  90  -8.202 -10.870  -9.589
  701    H    GLY  91           H        GLY  91  -3.337 -14.594  -3.364
  702   1HA   GLY  91          1HA       GLY  91  -1.119 -15.100  -3.900
  703   2HA   GLY  91          2HA       GLY  91  -1.592 -15.274  -5.585
  704    H    ILE  92           H        ILE  92  -1.885 -12.614  -3.256
  705    HA   ILE  92           HA       ILE  92  -0.412 -10.913  -5.165
  706    HB   ILE  92           HB       ILE  92  -2.533 -10.005  -3.203
  707   1HG1  ILE  92          1HG1      ILE  92  -2.726 -10.294  -6.213
  708   2HG1  ILE  92          2HG1      ILE  92  -3.466 -11.387  -5.048
  709   1HG2  ILE  92          1HG2      ILE  92  -2.402  -7.879  -4.420
  710   2HG2  ILE  92          2HG2      ILE  92  -0.854  -8.307  -3.692
  711   3HG2  ILE  92          3HG2      ILE  92  -1.110  -8.536  -5.422
  712   1HD1  ILE  92          1HD1      ILE  92  -4.109  -8.465  -5.392
  713   2HD1  ILE  92          2HD1      ILE  92  -5.096  -9.824  -5.930
  714   3HD1  ILE  92          3HD1      ILE  92  -4.842  -9.545  -4.207
  715    H    GLY  93           H        GLY  93   1.473 -10.166  -4.407
  716   1HA   GLY  93          1HA       GLY  93   2.489 -10.819  -1.883
  717   2HA   GLY  93          2HA       GLY  93   3.164  -9.604  -2.959
  718    H    LEU  94           H        LEU  94   2.323  -9.934   0.069
  719    HA   LEU  94           HA       LEU  94   1.180  -7.227   0.281
  720   1HB   LEU  94          1HB       LEU  94  -0.521  -8.953   0.769
  721   2HB   LEU  94          2HB       LEU  94   0.520  -9.609   2.017
  722    HG   LEU  94           HG       LEU  94   0.355  -7.387   3.194
  723   1HD1  LEU  94          1HD1      LEU  94  -1.509  -5.932   2.585
  724   2HD1  LEU  94          2HD1      LEU  94  -0.321  -6.037   1.287
  725   3HD1  LEU  94          3HD1      LEU  94  -1.832  -6.937   1.172
  726   1HD2  LEU  94          1HD2      LEU  94  -2.202  -8.922   2.744
  727   2HD2  LEU  94          2HD2      LEU  94  -0.933  -9.330   3.899
  728   3HD2  LEU  94          3HD2      LEU  94  -1.867  -7.848   4.103
  729    H    GLU  95           H        GLU  95   2.991  -6.134   0.863
  730    HA   GLU  95           HA       GLU  95   4.609  -7.255   3.049
  731   1HB   GLU  95          1HB       GLU  95   5.312  -5.186   0.964
  732   2HB   GLU  95          2HB       GLU  95   6.370  -5.670   2.281
  733   1HG   GLU  95          1HG       GLU  95   5.363  -7.438   0.065
  734   2HG   GLU  95          2HG       GLU  95   6.992  -6.784   0.228
  735    H    ALA  96           H        ALA  96   4.000  -6.485   4.955
  736    HA   ALA  96           HA       ALA  96   3.115  -3.716   5.205
  737   1HB   ALA  96          1HB       ALA  96   3.278  -5.897   7.286
  738   2HB   ALA  96          2HB       ALA  96   2.552  -4.305   7.506
  739   3HB   ALA  96          3HB       ALA  96   1.837  -5.451   6.372
  740    H    MET  97           H        MET  97   4.547  -2.184   5.555
  741    HA   MET  97           HA       MET  97   6.862  -2.681   7.273
  742   1HB   MET  97          1HB       MET  97   7.024  -1.581   4.457
  743   2HB   MET  97          2HB       MET  97   8.332  -1.485   5.625
  744   1HG   MET  97          1HG       MET  97   8.430  -3.930   5.705
  745   2HG   MET  97          2HG       MET  97   7.135  -4.011   4.512
  746   1HE   MET  97          1HE       MET  97   8.833  -2.444   1.349
  747   2HE   MET  97          2HE       MET  97   7.858  -1.613   2.560
  748   3HE   MET  97          3HE       MET  97   7.382  -3.214   1.994
  749    H    THR  98           H        THR  98   8.140  -0.318   6.979
  750    HA   THR  98           HA       THR  98   6.229   1.628   7.994
  751    HB   THR  98           HB       THR  98   8.286   2.970   8.474
  752    HG1  THR  98           HG1      THR  98  10.268   1.507   8.336
  753   1HG2  THR  98          1HG2      THR  98   9.093   1.515  10.287
  754   2HG2  THR  98          2HG2      THR  98   7.333   1.501  10.178
  755   3HG2  THR  98          3HG2      THR  98   8.266   0.144   9.548
  756    H    ASN  99           H        ASN  99   6.613   3.957   7.230
  757    HA   ASN  99           HA       ASN  99   6.085   4.093   4.462
  758   1HB   ASN  99          1HB       ASN  99   6.898   6.301   6.367
  759   2HB   ASN  99          2HB       ASN  99   6.293   6.558   4.734
  760   1HD2  ASN  99          2HD2      ASN  99   5.130   7.584   7.092
  761   2HD2  ASN  99          1HD2      ASN  99   3.553   6.897   7.241
  762    H    ALA 100           H        ALA 100   9.005   4.665   6.348
  763    HA   ALA 100           HA       ALA 100  10.593   5.649   4.223
  764   1HB   ALA 100          1HB       ALA 100  11.175   5.970   6.577
  765   2HB   ALA 100          2HB       ALA 100  11.471   4.240   6.740
  766   3HB   ALA 100          3HB       ALA 100  12.492   5.214   5.681
  767    H    ALA 101           H        ALA 101  10.104   2.394   5.535
  768    HA   ALA 101           HA       ALA 101  12.048   1.144   3.883
  769   1HB   ALA 101          1HB       ALA 101  11.056  -0.954   4.614
  770   2HB   ALA 101          2HB       ALA 101  11.259   0.146   5.977
  771   3HB   ALA 101          3HB       ALA 101   9.664  -0.086   5.263
  772    H    ALA 102           H        ALA 102   8.567   1.671   3.584
  773    HA   ALA 102           HA       ALA 102   8.191   0.102   1.265
  774   1HB   ALA 102          1HB       ALA 102   6.073   1.276   1.030
  775   2HB   ALA 102          2HB       ALA 102   6.346   0.814   2.709
  776   3HB   ALA 102          3HB       ALA 102   6.596   2.484   2.203
  777    H    ALA 103           H        ALA 103   9.188   3.426   1.764
  778    HA   ALA 103           HA       ALA 103   8.895   4.372  -0.858
  779   1HB   ALA 103          1HB       ALA 103  10.937   5.207   1.198
  780   2HB   ALA 103          2HB       ALA 103  10.463   6.125  -0.231
  781   3HB   ALA 103          3HB       ALA 103   9.295   5.837   1.058
  782    H    ARG 104           H        ARG 104  11.544   2.620   0.690
  783    HA   ARG 104           HA       ARG 104  13.418   2.912  -1.401
  784   1HB   ARG 104          1HB       ARG 104  13.220   0.555   0.477
  785   2HB   ARG 104          2HB       ARG 104  14.644   1.101  -0.392
  786   1HG   ARG 104          1HG       ARG 104  14.432   3.255   0.956
  787   2HG   ARG 104          2HG       ARG 104  13.303   2.356   1.973
  788   1HD   ARG 104          1HD       ARG 104  16.226   1.864   1.510
  789   2HD   ARG 104          2HD       ARG 104  15.373   2.092   3.035
  790    HE   ARG 104           HE       ARG 104  14.337  -0.212   1.880
  791   1HH1  ARG 104          1HH1      ARG 104  17.433   0.905   3.087
  792   2HH1  ARG 104          2HH1      ARG 104  17.999  -0.693   3.484
  793   1HH2  ARG 104          1HH2      ARG 104  15.085  -2.309   2.361
  794   2HH2  ARG 104          2HH2      ARG 104  16.667  -2.530   3.052
  795    H    THR 105           H        THR 105  11.061   0.363  -0.680
  796    HA   THR 105           HA       THR 105  11.734  -1.266  -2.900
  797    HB   THR 105           HB       THR 105   9.048  -1.200  -1.523
  798    HG1  THR 105           HG1      THR 105  11.425  -2.546  -0.657
  799   1HG2  THR 105          1HG2      THR 105   9.087  -3.612  -1.980
  800   2HG2  THR 105          2HG2      THR 105   9.241  -2.676  -3.467
  801   3HG2  THR 105          3HG2      THR 105  10.662  -3.438  -2.755
  802    H    TYR 106           H        TYR 106   9.582   1.429  -2.405
  803    HA   TYR 106           HA       TYR 106   7.919   1.121  -4.643
  804   1HB   TYR 106          1HB       TYR 106   7.297   2.580  -2.832
  805   2HB   TYR 106          2HB       TYR 106   8.722   3.579  -3.084
  806    HD1  TYR 106           HD1      TYR 106   5.862   2.322  -5.159
  807    HD2  TYR 106           HD2      TYR 106   8.319   5.613  -4.048
  808    HE1  TYR 106           HE1      TYR 106   4.568   3.787  -6.655
  809    HE2  TYR 106           HE2      TYR 106   7.036   7.081  -5.540
  810    HH   TYR 106           HH       TYR 106   5.596   7.032  -7.373
  811    H    ASN 107           H        ASN 107  10.979   2.942  -4.267
  812    HA   ASN 107           HA       ASN 107  10.881   4.096  -6.842
  813   1HB   ASN 107          1HB       ASN 107  12.849   5.090  -6.309
  814   2HB   ASN 107          2HB       ASN 107  12.476   4.508  -4.695
  815   1HD2  ASN 107          2HD2      ASN 107  14.488   4.122  -7.500
  816   2HD2  ASN 107          1HD2      ASN 107  15.619   3.013  -6.787
  817    H    VAL 108           H        VAL 108  11.885   0.974  -5.716
  818    HA   VAL 108           HA       VAL 108  13.282   0.237  -8.114
  819    HB   VAL 108           HB       VAL 108  12.153  -1.522  -5.926
  820   1HG1  VAL 108          1HG1      VAL 108  12.527  -2.763  -7.986
  821   2HG1  VAL 108          2HG1      VAL 108  14.173  -2.137  -8.079
  822   3HG1  VAL 108          3HG1      VAL 108  13.712  -3.216  -6.761
  823   1HG2  VAL 108          1HG2      VAL 108  14.933  -0.426  -6.323
  824   2HG2  VAL 108          2HG2      VAL 108  13.794   0.041  -5.060
  825   3HG2  VAL 108          3HG2      VAL 108  14.458  -1.592  -5.087
  826    H    LEU 109           H        LEU 109  10.082  -0.433  -6.737
  827    HA   LEU 109           HA       LEU 109   9.194  -2.080  -8.853
  828   1HB   LEU 109          1HB       LEU 109   7.623  -0.475  -6.839
  829   2HB   LEU 109          2HB       LEU 109   6.926  -1.671  -7.917
  830    HG   LEU 109           HG       LEU 109   8.980  -2.223  -5.773
  831   1HD1  LEU 109          1HD1      LEU 109   6.052  -2.913  -5.933
  832   2HD1  LEU 109          2HD1      LEU 109   7.167  -3.417  -4.663
  833   3HD1  LEU 109          3HD1      LEU 109   6.779  -1.708  -4.867
  834   1HD2  LEU 109          1HD2      LEU 109   7.529  -4.106  -7.628
  835   2HD2  LEU 109          2HD2      LEU 109   9.244  -3.701  -7.695
  836   3HD2  LEU 109          3HD2      LEU 109   8.599  -4.576  -6.306
  837    H    ALA 110           H        ALA 110   9.426   1.343  -8.520
  838    HA   ALA 110           HA       ALA 110   7.606   2.174 -10.483
  839   1HB   ALA 110          1HB       ALA 110  10.277   3.388  -9.770
  840   2HB   ALA 110          2HB       ALA 110   8.981   4.189 -10.659
  841   3HB   ALA 110          3HB       ALA 110   8.740   3.729  -8.975
  842    H    SER 111           H        SER 111  11.001   1.168 -10.736
  843    HA   SER 111           HA       SER 111  11.153   1.484 -13.558
  844   1HB   SER 111          1HB       SER 111  12.851  -0.171 -11.675
  845   2HB   SER 111          2HB       SER 111  13.249   0.176 -13.359
  846    HG   SER 111           HG       SER 111  13.253   2.406 -12.817
  847    H    GLU 112           H        GLU 112  10.225  -1.141 -11.435
  848    HA   GLU 112           HA       GLU 112  10.132  -3.210 -13.310
  849   1HB   GLU 112          1HB       GLU 112   8.480  -2.707 -10.831
  850   2HB   GLU 112          2HB       GLU 112   8.533  -4.219 -11.708
  851   1HG   GLU 112          1HG       GLU 112  10.903  -2.922 -10.404
  852   2HG   GLU 112          2HG       GLU 112   9.941  -4.216  -9.691
  853    H    GLY 113           H        GLY 113   7.850  -0.674 -12.434
  854   1HA   GLY 113          1HA       GLY 113   6.059   0.185 -13.595
  855   2HA   GLY 113          2HA       GLY 113   6.533  -0.819 -14.957
  856    H    ARG 114           H        ARG 114   5.963  -2.286 -11.884
  857    HA   ARG 114           HA       ARG 114   3.806  -3.833 -13.069
  858   1HB   ARG 114          1HB       ARG 114   5.074  -4.142 -10.340
  859   2HB   ARG 114          2HB       ARG 114   4.071  -5.318 -11.179
  860   1HG   ARG 114          1HG       ARG 114   5.782  -5.577 -12.890
  861   2HG   ARG 114          2HG       ARG 114   6.785  -4.376 -12.079
  862   1HD   ARG 114          1HD       ARG 114   6.754  -5.867 -10.057
  863   2HD   ARG 114          2HD       ARG 114   5.977  -7.093 -11.059
  864    HE   ARG 114           HE       ARG 114   8.730  -6.103 -11.333
  865   1HH1  ARG 114          1HH1      ARG 114   6.228  -8.380 -12.252
  866   2HH1  ARG 114          2HH1      ARG 114   7.308  -9.367 -13.196
  867   1HH2  ARG 114          1HH2      ARG 114  10.143  -7.390 -12.507
  868   2HH2  ARG 114          2HH2      ARG 114   9.559  -8.810 -13.337
  869    H    ARG 115           H        ARG 115   1.854  -4.299 -11.734
  870    HA   ARG 115           HA       ARG 115   0.682  -1.873 -10.802
  871   1HB   ARG 115          1HB       ARG 115  -0.230  -4.685 -11.100
  872   2HB   ARG 115          2HB       ARG 115  -1.121  -3.657  -9.988
  873   1HG   ARG 115          1HG       ARG 115  -0.621  -3.097 -12.904
  874   2HG   ARG 115          2HG       ARG 115  -2.141  -3.641 -12.186
  875   1HD   ARG 115          1HD       ARG 115  -2.218  -1.598 -10.831
  876   2HD   ARG 115          2HD       ARG 115  -0.716  -1.053 -11.573
  877    HE   ARG 115           HE       ARG 115  -2.886  -1.604 -13.414
  878   1HH1  ARG 115          1HH1      ARG 115  -1.137   0.766 -11.546
  879   2HH1  ARG 115          2HH1      ARG 115  -1.824   2.141 -12.366
  880   1HH2  ARG 115          1HH2      ARG 115  -3.776   0.180 -14.548
  881   2HH2  ARG 115          2HH2      ARG 115  -3.311   1.796 -14.093
  882    H    VAL 116           H        VAL 116   1.993  -1.193  -9.138
  883    HA   VAL 116           HA       VAL 116   1.974  -2.784  -6.690
  884    HB   VAL 116           HB       VAL 116   4.147  -1.916  -7.287
  885   1HG1  VAL 116          1HG1      VAL 116   2.898   0.829  -7.238
  886   2HG1  VAL 116          2HG1      VAL 116   4.614   0.479  -7.442
  887   3HG1  VAL 116          3HG1      VAL 116   3.458  -0.031  -8.673
  888   1HG2  VAL 116          1HG2      VAL 116   2.981  -0.375  -4.972
  889   2HG2  VAL 116          2HG2      VAL 116   3.645  -2.009  -4.912
  890   3HG2  VAL 116          3HG2      VAL 116   4.700  -0.640  -5.266
  891    H    ALA 117           H        ALA 117   0.685  -2.324  -5.044
  892    HA   ALA 117           HA       ALA 117  -0.839   0.190  -5.127
  893   1HB   ALA 117          1HB       ALA 117  -2.443  -0.912  -3.645
  894   2HB   ALA 117          2HB       ALA 117  -2.198  -1.848  -5.118
  895   3HB   ALA 117          3HB       ALA 117  -1.432  -2.357  -3.614
  896    H    LEU 118           H        LEU 118   0.469   1.628  -4.107
  897    HA   LEU 118           HA       LEU 118   1.785   0.863  -1.626
  898   1HB   LEU 118          1HB       LEU 118   2.984   2.199  -3.334
  899   2HB   LEU 118          2HB       LEU 118   1.823   3.494  -3.116
  900    HG   LEU 118           HG       LEU 118   2.562   3.716  -0.757
  901   1HD1  LEU 118          1HD1      LEU 118   4.678   1.728  -1.568
  902   2HD1  LEU 118          2HD1      LEU 118   4.630   2.626  -0.052
  903   3HD1  LEU 118          3HD1      LEU 118   3.374   1.442  -0.416
  904   1HD2  LEU 118          1HD2      LEU 118   4.719   4.764  -1.269
  905   2HD2  LEU 118          2HD2      LEU 118   4.731   3.960  -2.838
  906   3HD2  LEU 118          3HD2      LEU 118   3.492   5.161  -2.471
  907    H    ALA 119           H        ALA 119   0.366   0.755   0.004
  908    HA   ALA 119           HA       ALA 119  -1.598   2.903   0.320
  909   1HB   ALA 119          1HB       ALA 119  -2.444   0.609   0.432
  910   2HB   ALA 119          2HB       ALA 119  -1.362   0.274   1.784
  911   3HB   ALA 119          3HB       ALA 119  -2.665   1.450   1.966
  912    H    MET 120           H        MET 120  -0.572   4.590   1.216
  913    HA   MET 120           HA       MET 120   1.274   4.154   3.428
  914   1HB   MET 120          1HB       MET 120   0.556   6.587   1.805
  915   2HB   MET 120          2HB       MET 120   1.522   6.694   3.268
  916   1HG   MET 120          1HG       MET 120   2.225   5.108   0.810
  917   2HG   MET 120          2HG       MET 120   2.899   6.673   1.261
  918   1HE   MET 120          1HE       MET 120   5.390   5.910   1.188
  919   2HE   MET 120          2HE       MET 120   4.846   4.349   0.572
  920   3HE   MET 120          3HE       MET 120   5.983   4.416   1.917
  921    H    ILE 121           H        ILE 121   0.592   4.152   5.419
  922    HA   ILE 121           HA       ILE 121  -1.814   5.705   6.107
  923    HB   ILE 121           HB       ILE 121  -0.637   3.314   7.547
  924   1HG1  ILE 121          1HG1      ILE 121  -3.181   3.569   5.923
  925   2HG1  ILE 121          2HG1      ILE 121  -1.723   2.729   5.408
  926   1HG2  ILE 121          1HG2      ILE 121  -3.150   4.891   8.096
  927   2HG2  ILE 121          2HG2      ILE 121  -2.662   3.416   8.930
  928   3HG2  ILE 121          3HG2      ILE 121  -1.690   4.880   9.083
  929   1HD1  ILE 121          1HD1      ILE 121  -1.995   1.136   7.238
  930   2HD1  ILE 121          2HD1      ILE 121  -3.457   1.979   7.750
  931   3HD1  ILE 121          3HD1      ILE 121  -3.410   1.168   6.184
  932    H    VAL 122           H        VAL 122  -1.406   7.498   7.207
  933    HA   VAL 122           HA       VAL 122   1.212   7.868   8.397
  934    HB   VAL 122           HB       VAL 122  -1.112   9.754   7.990
  935   1HG1  VAL 122          1HG1      VAL 122   1.602  10.339   9.169
  936   2HG1  VAL 122          2HG1      VAL 122   0.380  11.541   8.751
  937   3HG1  VAL 122          3HG1      VAL 122   0.066  10.371  10.034
  938   1HG2  VAL 122          1HG2      VAL 122   1.631   9.605   6.732
  939   2HG2  VAL 122          2HG2      VAL 122   0.111   9.141   5.966
  940   3HG2  VAL 122          3HG2      VAL 122   0.406  10.828   6.388
  941    H    GLY 123           H        GLY 123   1.612   7.346  10.401
  942   1HA   GLY 123          1HA       GLY 123  -0.597   7.002  12.291
  943   2HA   GLY 123          2HA       GLY 123   1.035   6.382  12.480
  944    H    GLY 124           H        GLY 124  -0.812   9.362  12.363
  945   1HA   GLY 124          1HA       GLY 124   0.298  10.373  14.770
  946   2HA   GLY 124          2HA       GLY 124   1.061  11.138  13.380
  947    H    LEU 125           H        LEU 125  -2.250  10.086  14.090
  948    HA   LEU 125           HA       LEU 125  -3.202  12.539  12.820
  949   1HB   LEU 125          1HB       LEU 125  -4.704  10.057  13.661
  950   2HB   LEU 125          2HB       LEU 125  -5.382  11.406  12.770
  951    HG   LEU 125           HG       LEU 125  -3.201   9.571  11.769
  952   1HD1  LEU 125          1HD1      LEU 125  -4.913   8.743  10.230
  953   2HD1  LEU 125          2HD1      LEU 125  -5.351   8.440  11.912
  954   3HD1  LEU 125          3HD1      LEU 125  -6.118   9.758  11.024
  955   1HD2  LEU 125          1HD2      LEU 125  -4.704  11.789  10.384
  956   2HD2  LEU 125          2HD2      LEU 125  -3.010  11.832  10.871
  957   3HD2  LEU 125          3HD2      LEU 125  -3.542  10.700   9.628
  958    H    GLU 126           H        GLU 126  -3.009  14.103  14.395
  959    HA   GLU 126           HA       GLU 126  -4.191  13.827  16.992
  960   1HB   GLU 126          1HB       GLU 126  -2.401  15.484  16.466
  961   2HB   GLU 126          2HB       GLU 126  -3.540  16.348  15.443
  962   1HG   GLU 126          1HG       GLU 126  -4.997  16.560  17.514
  963   2HG   GLU 126          2HG       GLU 126  -3.580  16.035  18.423
  964    H    HIS 127           H        HIS 127  -6.349  13.525  17.198
  965    HA   HIS 127           HA       HIS 127  -8.118  15.005  15.377
  966   1HB   HIS 127          1HB       HIS 127  -9.446  12.977  14.938
  967   2HB   HIS 127          2HB       HIS 127  -7.797  12.819  14.351
  968    HD1  HIS 127           HD1      HIS 127  -6.170  11.359  15.979
  969    HD2  HIS 127           HD2      HIS 127 -10.267  10.939  16.557
  970    HE1  HIS 127           HE1      HIS 127  -6.455   9.233  17.277
  971    HE2  HIS 127           HE2      HIS 127  -8.941   8.875  17.391
  972    H    HIS 128           H        HIS 128  -9.623  16.031  16.437
  973    HA   HIS 128           HA       HIS 128 -11.238  16.590  17.918
  974   1HB   HIS 128          1HB       HIS 128 -12.088  14.369  16.993
  975   2HB   HIS 128          2HB       HIS 128 -11.516  13.640  18.489
  976    HD1  HIS 128           HD1      HIS 128 -13.876  16.404  17.389
  977    HD2  HIS 128           HD2      HIS 128 -13.349  13.690  20.493
  978    HE1  HIS 128           HE1      HIS 128 -15.892  16.669  18.869
  979    HE2  HIS 128           HE2      HIS 128 -15.411  15.210  20.868
  980    H    HIS 129           H        HIS 129  -8.744  16.881  18.965
  981    HA   HIS 129           HA       HIS 129  -8.663  15.645  21.591
  982   1HB   HIS 129          1HB       HIS 129  -6.619  16.237  20.139
  983   2HB   HIS 129          2HB       HIS 129  -6.902  17.902  20.635
  984    HD1  HIS 129           HD1      HIS 129  -6.202  18.568  23.004
  985    HD2  HIS 129           HD2      HIS 129  -5.761  14.505  22.210
  986    HE1  HIS 129           HE1      HIS 129  -4.841  17.645  24.909
  987    HE2  HIS 129           HE2      HIS 129  -4.473  15.214  24.342
  988    H    HIS 130           H        HIS 130 -10.252  16.366  22.894
  989    HA   HIS 130           HA       HIS 130 -10.863  19.245  22.854
  990   1HB   HIS 130          1HB       HIS 130 -13.083  18.664  23.724
  991   2HB   HIS 130          2HB       HIS 130 -12.754  17.845  22.205
  992    HD1  HIS 130           HD1      HIS 130 -13.830  17.243  25.631
  993    HD2  HIS 130           HD2      HIS 130 -12.083  15.016  22.581
  994    HE1  HIS 130           HE1      HIS 130 -14.180  14.832  26.259
  995    HE2  HIS 130           HE2      HIS 130 -12.948  13.513  24.499
  996    H    HIS 131           H        HIS 131  -9.827  16.628  24.875
  997    HA   HIS 131           HA       HIS 131 -10.125  18.314  27.254
  998   1HB   HIS 131          1HB       HIS 131 -10.937  16.042  27.533
  999   2HB   HIS 131          2HB       HIS 131  -9.391  15.388  27.000
 1000    HD1  HIS 131           HD1      HIS 131 -10.890  17.350  29.880
 1001    HD2  HIS 131           HD2      HIS 131  -7.535  15.057  28.986
 1002    HE1  HIS 131           HE1      HIS 131  -9.641  17.098  32.048
 1003    HE2  HIS 131           HE2      HIS 131  -7.519  15.886  31.431
 1004    H    HIS 132           H        HIS 132  -8.480  19.386  28.061
 1005    HA   HIS 132           HA       HIS 132  -5.763  18.466  27.482
 1006   1HB   HIS 132          1HB       HIS 132  -5.023  20.777  27.006
 1007   2HB   HIS 132          2HB       HIS 132  -6.194  20.202  25.830
 1008    HD1  HIS 132           HD1      HIS 132  -5.399  23.092  27.705
 1009    HD2  HIS 132           HD2      HIS 132  -8.958  21.223  26.644
 1010    HE1  HIS 132           HE1      HIS 132  -7.186  24.841  27.967
 1011    HE2  HIS 132           HE2      HIS 132  -9.348  23.619  27.544
  Start of MODEL   12
    1   1H    MET   1          1HT       MET   1  -6.249  29.765 -11.918
    2   2H    MET   1          2HT       MET   1  -5.947  30.317 -10.346
    3   3H    MET   1          3HT       MET   1  -6.746  28.839 -10.590
    4    HA   MET   1           HA       MET   1  -4.463  28.485  -9.939
    5   1HB   MET   1          1HB       MET   1  -3.871  26.918 -11.656
    6   2HB   MET   1          2HB       MET   1  -5.623  26.924 -11.536
    7   1HG   MET   1          1HG       MET   1  -4.012  28.374 -13.626
    8   2HG   MET   1          2HG       MET   1  -4.837  26.834 -13.853
    9   1HE   MET   1          1HE       MET   1  -5.963  27.969 -16.030
   10   2HE   MET   1          2HE       MET   1  -5.180  29.507 -15.666
   11   3HE   MET   1          3HE       MET   1  -6.918  29.451 -15.964
   12    HA   PRO   2           HA       PRO   2  -1.580  31.427 -11.598
   13   1HB   PRO   2          1HB       PRO   2   0.606  30.195 -10.278
   14   2HB   PRO   2          2HB       PRO   2  -0.356  31.558  -9.705
   15   1HG   PRO   2          1HG       PRO   2  -0.276  29.007  -8.566
   16   2HG   PRO   2          2HG       PRO   2  -1.489  30.255  -8.242
   17   1HD   PRO   2          1HD       PRO   2  -1.649  27.867 -10.015
   18   2HD   PRO   2          2HD       PRO   2  -2.924  28.666  -9.069
   19    H    LEU   3           H        LEU   3  -1.411  30.952 -13.768
   20    HA   LEU   3           HA       LEU   3   0.158  28.684 -14.648
   21   1HB   LEU   3          1HB       LEU   3  -1.826  29.501 -15.919
   22   2HB   LEU   3          2HB       LEU   3  -0.952  30.981 -16.267
   23    HG   LEU   3           HG       LEU   3   0.739  29.672 -17.509
   24   1HD1  LEU   3          1HD1      LEU   3   0.268  27.333 -18.066
   25   2HD1  LEU   3          2HD1      LEU   3   0.515  27.555 -16.333
   26   3HD1  LEU   3          3HD1      LEU   3  -1.117  27.357 -16.972
   27   1HD2  LEU   3          1HD2      LEU   3  -2.105  29.226 -18.405
   28   2HD2  LEU   3          2HD2      LEU   3  -1.142  30.675 -18.693
   29   3HD2  LEU   3          3HD2      LEU   3  -0.674  29.143 -19.432
   30    H    ASN   4           H        ASN   4   1.991  29.398 -13.357
   31    HA   ASN   4           HA       ASN   4   3.416  31.755 -14.335
   32   1HB   ASN   4          1HB       ASN   4   3.134  31.551 -11.922
   33   2HB   ASN   4          2HB       ASN   4   3.893  29.964 -11.943
   34   1HD2  ASN   4          2HD2      ASN   4   5.526  30.482 -10.578
   35   2HD2  ASN   4          1HD2      ASN   4   6.817  31.564 -11.000
   36    H    GLN   5           H        GLN   5   4.162  28.362 -13.542
   37    HA   GLN   5           HA       GLN   5   6.554  28.534 -15.211
   38   1HB   GLN   5          1HB       GLN   5   5.652  26.332 -13.344
   39   2HB   GLN   5          2HB       GLN   5   7.198  26.408 -14.176
   40   1HG   GLN   5          1HG       GLN   5   7.744  28.451 -12.926
   41   2HG   GLN   5          2HG       GLN   5   6.215  28.308 -12.060
   42   1HE2  GLN   5          2HE2      GLN   5   8.191  25.575 -12.967
   43   2HE2  GLN   5          1HE2      GLN   5   8.671  25.139 -11.364
   44    H    GLU   6           H        GLU   6   6.269  28.030 -17.292
   45    HA   GLU   6           HA       GLU   6   4.269  26.141 -18.144
   46   1HB   GLU   6          1HB       GLU   6   5.018  28.083 -19.543
   47   2HB   GLU   6          2HB       GLU   6   6.575  27.288 -19.733
   48   1HG   GLU   6          1HG       GLU   6   5.093  26.967 -21.665
   49   2HG   GLU   6          2HG       GLU   6   5.551  25.447 -20.895
   50    H    HIS   7           H        HIS   7   4.707  24.090 -19.111
   51    HA   HIS   7           HA       HIS   7   5.506  21.975 -18.919
   52   1HB   HIS   7          1HB       HIS   7   7.418  22.796 -20.221
   53   2HB   HIS   7          2HB       HIS   7   8.200  23.358 -18.749
   54    HD1  HIS   7           HD1      HIS   7  10.258  21.866 -18.998
   55    HD2  HIS   7           HD2      HIS   7   6.675  19.745 -18.965
   56    HE1  HIS   7           HE1      HIS   7  10.903  19.446 -18.781
   57    HE2  HIS   7           HE2      HIS   7   8.731  18.167 -18.850
   58    HA   PRO   8           HA       PRO   8   5.444  22.415 -14.397
   59   1HB   PRO   8          1HB       PRO   8   3.552  20.564 -13.927
   60   2HB   PRO   8          2HB       PRO   8   3.153  22.177 -14.528
   61   1HG   PRO   8          1HG       PRO   8   3.386  19.600 -16.030
   62   2HG   PRO   8          2HG       PRO   8   2.163  20.876 -16.178
   63   1HD   PRO   8          1HD       PRO   8   4.286  20.608 -17.878
   64   2HD   PRO   8          2HD       PRO   8   3.487  22.155 -17.539
   65    H    ASP   9           H        ASP   9   5.096  20.367 -12.749
   66    HA   ASP   9           HA       ASP   9   7.458  18.721 -13.217
   67   1HB   ASP   9          1HB       ASP   9   7.291  19.926 -11.084
   68   2HB   ASP   9          2HB       ASP   9   5.758  19.135 -10.741
   69    H    TYR  10           H        TYR  10   7.294  16.393 -12.443
   70    HA   TYR  10           HA       TYR  10   5.326  15.005 -13.910
   71   1HB   TYR  10          1HB       TYR  10   7.632  14.173 -13.305
   72   2HB   TYR  10          2HB       TYR  10   7.038  13.903 -11.672
   73    HD1  TYR  10           HD1      TYR  10   6.739  12.835 -15.185
   74    HD2  TYR  10           HD2      TYR  10   5.698  11.988 -11.150
   75    HE1  TYR  10           HE1      TYR  10   5.968  10.602 -15.860
   76    HE2  TYR  10           HE2      TYR  10   4.922   9.750 -11.816
   77    HH   TYR  10           HH       TYR  10   4.021   8.690 -14.053
   78    H    THR  11           H        THR  11   5.445  16.212 -10.696
   79    HA   THR  11           HA       THR  11   3.960  16.475  -9.060
   80    HB   THR  11           HB       THR  11   1.559  16.226  -9.396
   81    HG1  THR  11           HG1      THR  11   2.361  14.859 -11.728
   82   1HG2  THR  11          1HG2      THR  11   2.634  18.263 -10.132
   83   2HG2  THR  11          2HG2      THR  11   2.994  17.540 -11.700
   84   3HG2  THR  11          3HG2      THR  11   1.321  17.845 -11.232
   85    H    TYR  12           H        TYR  12   3.628  13.283 -10.584
   86    HA   TYR  12           HA       TYR  12   2.833  12.067  -8.093
   87   1HB   TYR  12          1HB       TYR  12   3.764  10.821 -10.688
   88   2HB   TYR  12          2HB       TYR  12   3.163   9.918  -9.305
   89    HD1  TYR  12           HD1      TYR  12   2.296  11.675 -12.300
   90    HD2  TYR  12           HD2      TYR  12   0.755  10.318  -8.573
   91    HE1  TYR  12           HE1      TYR  12   0.011  11.850 -13.186
   92    HE2  TYR  12           HE2      TYR  12  -1.536  10.491  -9.449
   93    HH   TYR  12           HH       TYR  12  -2.203  10.859 -12.755
   94    H    ALA  13           H        ALA  13   4.590  12.891  -6.793
   95    HA   ALA  13           HA       ALA  13   6.825  11.037  -6.756
   96   1HB   ALA  13          1HB       ALA  13   7.651  12.842  -8.181
   97   2HB   ALA  13          2HB       ALA  13   7.269  14.017  -6.923
   98   3HB   ALA  13          3HB       ALA  13   8.516  12.800  -6.645
   99    H    LEU  14           H        LEU  14   7.147  10.412  -4.729
  100    HA   LEU  14           HA       LEU  14   5.986  11.946  -2.547
  101   1HB   LEU  14          1HB       LEU  14   5.727   9.472  -2.687
  102   2HB   LEU  14          2HB       LEU  14   7.460   9.304  -2.503
  103    HG   LEU  14           HG       LEU  14   7.372  10.131  -0.248
  104   1HD1  LEU  14          1HD1      LEU  14   5.271  10.777   0.821
  105   2HD1  LEU  14          2HD1      LEU  14   5.645  11.834  -0.540
  106   3HD1  LEU  14          3HD1      LEU  14   4.426  10.572  -0.714
  107   1HD2  LEU  14          1HD2      LEU  14   6.878   7.768  -0.575
  108   2HD2  LEU  14          2HD2      LEU  14   5.990   8.421   0.802
  109   3HD2  LEU  14          3HD2      LEU  14   5.162   8.144  -0.731
  110    H    ARG  15           H        ARG  15   7.170  13.635  -1.927
  111    HA   ARG  15           HA       ARG  15   9.971  13.745  -2.573
  112   1HB   ARG  15          1HB       ARG  15   8.364  15.644  -2.893
  113   2HB   ARG  15          2HB       ARG  15   8.292  15.811  -1.147
  114   1HG   ARG  15          1HG       ARG  15  10.644  16.362  -1.062
  115   2HG   ARG  15          2HG       ARG  15  10.796  16.087  -2.798
  116   1HD   ARG  15          1HD       ARG  15   9.067  18.191  -1.496
  117   2HD   ARG  15          2HD       ARG  15  10.634  18.477  -2.252
  118    HE   ARG  15           HE       ARG  15   9.244  17.349  -4.252
  119   1HH1  ARG  15          1HH1      ARG  15   8.522  20.025  -2.102
  120   2HH1  ARG  15          2HH1      ARG  15   7.440  20.802  -3.228
  121   1HH2  ARG  15          1HH2      ARG  15   7.858  18.402  -5.752
  122   2HH2  ARG  15          2HH2      ARG  15   7.086  19.892  -5.293
  123    H    ALA  16           H        ALA  16   8.049  13.405   0.347
  124    HA   ALA  16           HA       ALA  16  10.379  12.574   1.813
  125   1HB   ALA  16          1HB       ALA  16   8.941  15.071   2.709
  126   2HB   ALA  16          2HB       ALA  16  10.227  14.241   3.586
  127   3HB   ALA  16          3HB       ALA  16  10.570  15.007   2.035
  128    H    ALA  17           H        ALA  17   9.853  11.711   3.910
  129    HA   ALA  17           HA       ALA  17   7.109  11.522   4.748
  130   1HB   ALA  17          1HB       ALA  17   6.934   9.094   4.593
  131   2HB   ALA  17          2HB       ALA  17   7.168   9.799   2.994
  132   3HB   ALA  17          3HB       ALA  17   8.516   9.016   3.818
  133    H    ASP  18           H        ASP  18   7.400  11.950   6.845
  134    HA   ASP  18           HA       ASP  18   9.856  11.057   8.156
  135   1HB   ASP  18          1HB       ASP  18   9.222  12.583   9.976
  136   2HB   ASP  18          2HB       ASP  18   9.266  13.407   8.422
  137    H    GLY  19           H        GLY  19   6.885   9.792   7.694
  138   1HA   GLY  19          1HA       GLY  19   6.374   7.667   8.706
  139   2HA   GLY  19          2HA       GLY  19   7.083   8.261  10.201
  140    H    ARG  20           H        ARG  20   5.818  10.792  10.257
  141    HA   ARG  20           HA       ARG  20   3.069   9.934  10.877
  142   1HB   ARG  20          1HB       ARG  20   4.712  12.200  12.018
  143   2HB   ARG  20          2HB       ARG  20   3.039  11.863  12.442
  144   1HG   ARG  20          1HG       ARG  20   3.671   9.716  13.367
  145   2HG   ARG  20          2HG       ARG  20   5.345   9.972  12.870
  146   1HD   ARG  20          1HD       ARG  20   3.804  11.649  14.847
  147   2HD   ARG  20          2HD       ARG  20   5.044  10.459  15.243
  148    HE   ARG  20           HE       ARG  20   6.433  12.050  13.651
  149   1HH1  ARG  20          1HH1      ARG  20   4.209  12.852  16.234
  150   2HH1  ARG  20          2HH1      ARG  20   4.963  14.372  16.598
  151   1HH2  ARG  20          1HH2      ARG  20   7.441  14.040  14.120
  152   2HH2  ARG  20          2HH2      ARG  20   6.822  15.042  15.393
  153    H    HIS  21           H        HIS  21   4.996  12.099   9.013
  154    HA   HIS  21           HA       HIS  21   2.512  13.054   7.745
  155   1HB   HIS  21          1HB       HIS  21   5.071  14.658   7.963
  156   2HB   HIS  21          2HB       HIS  21   3.561  15.184   7.233
  157    HD1  HIS  21           HD1      HIS  21   1.523  15.516   8.983
  158    HD2  HIS  21           HD2      HIS  21   5.338  15.256  10.591
  159    HE1  HIS  21           HE1      HIS  21   1.331  16.430  11.310
  160    HE2  HIS  21           HE2      HIS  21   3.695  16.476  12.175
  161    H    ALA  22           H        ALA  22   2.492  12.990   5.520
  162    HA   ALA  22           HA       ALA  22   4.945  12.014   4.209
  163   1HB   ALA  22          1HB       ALA  22   2.082  11.499   3.397
  164   2HB   ALA  22          2HB       ALA  22   3.518  10.914   2.559
  165   3HB   ALA  22          3HB       ALA  22   3.152  10.342   4.186
  166    H    LYS  23           H        LYS  23   5.813  13.359   2.782
  167    HA   LYS  23           HA       LYS  23   4.283  15.762   2.110
  168   1HB   LYS  23          1HB       LYS  23   6.428  16.114   3.240
  169   2HB   LYS  23          2HB       LYS  23   7.257  15.237   1.961
  170   1HG   LYS  23          1HG       LYS  23   7.572  17.573   1.598
  171   2HG   LYS  23          2HG       LYS  23   6.481  16.966   0.352
  172   1HD   LYS  23          1HD       LYS  23   5.566  19.019   1.087
  173   2HD   LYS  23          2HD       LYS  23   4.576  17.754   1.816
  174   1HE   LYS  23          1HE       LYS  23   5.013  19.425   3.479
  175   2HE   LYS  23          2HE       LYS  23   5.929  17.976   3.892
  176   1HZ   LYS  23          1HZ       LYS  23   7.248  19.990   4.160
  177   2HZ   LYS  23          2HZ       LYS  23   7.907  18.992   2.956
  178   3HZ   LYS  23          3HZ       LYS  23   7.027  20.377   2.522
  179    H    VAL  24           H        VAL  24   3.098  15.171   0.350
  180    HA   VAL  24           HA       VAL  24   4.571  14.324  -2.040
  181    HB   VAL  24           HB       VAL  24   1.590  14.766  -1.728
  182   1HG1  VAL  24          1HG1      VAL  24   1.417  13.507  -3.821
  183   2HG1  VAL  24          2HG1      VAL  24   2.373  14.975  -4.026
  184   3HG1  VAL  24          3HG1      VAL  24   3.177  13.409  -3.907
  185   1HG2  VAL  24          1HG2      VAL  24   3.159  12.190  -1.657
  186   2HG2  VAL  24          2HG2      VAL  24   2.335  12.945  -0.292
  187   3HG2  VAL  24          3HG2      VAL  24   1.399  12.325  -1.652
  188    H    ASN  25           H        ASN  25   5.603  16.016  -2.882
  189    HA   ASN  25           HA       ASN  25   6.102  18.085  -3.647
  190   1HB   ASN  25          1HB       ASN  25   3.103  18.411  -3.904
  191   2HB   ASN  25          2HB       ASN  25   4.318  19.447  -4.648
  192   1HD2  ASN  25          2HD2      ASN  25   2.200  17.793  -5.822
  193   2HD2  ASN  25          1HD2      ASN  25   2.992  16.729  -6.931
  194    H    GLU  26           H        GLU  26   3.227  19.653  -2.606
  195    HA   GLU  26           HA       GLU  26   4.608  20.558  -0.161
  196   1HB   GLU  26          1HB       GLU  26   2.761  22.088  -1.994
  197   2HB   GLU  26          2HB       GLU  26   3.179  22.642  -0.382
  198   1HG   GLU  26          1HG       GLU  26   4.623  23.815  -1.758
  199   2HG   GLU  26          2HG       GLU  26   5.613  22.480  -1.169
  200    H    GLN  27           H        GLN  27   2.286  18.583  -1.171
  201    HA   GLN  27           HA       GLN  27   0.246  19.356   0.766
  202   1HB   GLN  27          1HB       GLN  27   0.331  17.238  -1.385
  203   2HB   GLN  27          2HB       GLN  27  -0.981  17.362  -0.224
  204   1HG   GLN  27          1HG       GLN  27  -1.698  18.428  -2.205
  205   2HG   GLN  27          2HG       GLN  27  -1.368  19.696  -1.030
  206   1HE2  GLN  27          2HE2      GLN  27  -1.094  21.269  -2.563
  207   2HE2  GLN  27          1HE2      GLN  27   0.276  21.322  -3.632
  208    H    ILE  28           H        ILE  28   0.410  18.641   2.782
  209    HA   ILE  28           HA       ILE  28   1.999  16.263   3.330
  210    HB   ILE  28           HB       ILE  28   0.646  18.145   5.273
  211   1HG1  ILE  28          1HG1      ILE  28   3.530  17.945   4.377
  212   2HG1  ILE  28          2HG1      ILE  28   2.425  19.273   4.046
  213   1HG2  ILE  28          1HG2      ILE  28   2.064  17.063   6.960
  214   2HG2  ILE  28          2HG2      ILE  28   0.942  15.926   6.213
  215   3HG2  ILE  28          3HG2      ILE  28   2.640  15.932   5.738
  216   1HD1  ILE  28          1HD1      ILE  28   3.454  18.454   6.756
  217   2HD1  ILE  28          2HD1      ILE  28   3.977  19.851   5.813
  218   3HD1  ILE  28          3HD1      ILE  28   2.329  19.777   6.437
  219    H    LEU  29           H        LEU  29   0.900  14.469   2.875
  220    HA   LEU  29           HA       LEU  29  -1.879  14.180   3.663
  221   1HB   LEU  29          1HB       LEU  29   0.041  12.217   2.398
  222   2HB   LEU  29          2HB       LEU  29  -1.673  11.937   2.647
  223    HG   LEU  29           HG       LEU  29  -0.504  14.087   0.873
  224   1HD1  LEU  29          1HD1      LEU  29  -1.861  11.497   0.149
  225   2HD1  LEU  29          2HD1      LEU  29  -1.332  12.745  -0.978
  226   3HD1  LEU  29          3HD1      LEU  29  -0.143  11.850  -0.033
  227   1HD2  LEU  29          1HD2      LEU  29  -2.647  14.731   1.836
  228   2HD2  LEU  29          2HD2      LEU  29  -2.808  14.394   0.112
  229   3HD2  LEU  29          3HD2      LEU  29  -3.358  13.210   1.297
  230    H    GLN  30           H        GLN  30  -2.334  13.721   5.707
  231    HA   GLN  30           HA       GLN  30  -0.158  12.700   7.371
  232   1HB   GLN  30          1HB       GLN  30  -2.675  14.178   8.139
  233   2HB   GLN  30          2HB       GLN  30  -1.412  13.676   9.254
  234   1HG   GLN  30          1HG       GLN  30   0.186  15.098   8.031
  235   2HG   GLN  30          2HG       GLN  30  -1.136  15.647   7.002
  236   1HE2  GLN  30          2HE2      GLN  30  -3.054  15.652   9.216
  237   2HE2  GLN  30          1HE2      GLN  30  -2.676  17.048  10.171
  238    H    GLN  31           H        GLN  31  -2.693  11.287   5.869
  239    HA   GLN  31           HA       GLN  31  -2.887   9.308   7.996
  240   1HB   GLN  31          1HB       GLN  31  -5.346  10.496   6.704
  241   2HB   GLN  31          2HB       GLN  31  -5.338   9.107   7.781
  242   1HG   GLN  31          1HG       GLN  31  -4.301  10.627   9.515
  243   2HG   GLN  31          2HG       GLN  31  -4.689  11.965   8.438
  244   1HE2  GLN  31          2HE2      GLN  31  -5.912   9.592  10.621
  245   2HE2  GLN  31          1HE2      GLN  31  -7.536  10.188  10.685
  246    H    SER  32           H        SER  32  -5.011   9.445   5.175
  247    HA   SER  32           HA       SER  32  -3.842   6.847   4.428
  248   1HB   SER  32          1HB       SER  32  -6.691   7.670   3.916
  249   2HB   SER  32          2HB       SER  32  -6.008   6.045   3.961
  250    HG   SER  32           HG       SER  32  -5.645   6.384   6.227
  251    H    PHE  33           H        PHE  33  -3.133   6.566   2.410
  252    HA   PHE  33           HA       PHE  33  -4.635   7.459   0.176
  253   1HB   PHE  33          1HB       PHE  33  -3.058   8.923  -0.913
  254   2HB   PHE  33          2HB       PHE  33  -3.413   9.579   0.678
  255    HD1  PHE  33           HD1      PHE  33  -1.720   9.230   2.523
  256    HD2  PHE  33           HD2      PHE  33  -0.876   8.460  -1.578
  257    HE1  PHE  33           HE1      PHE  33   0.689   9.378   2.996
  258    HE2  PHE  33           HE2      PHE  33   1.536   8.597  -1.109
  259    HZ   PHE  33           HZ       PHE  33   2.321   9.062   1.179
  260    H    ILE  34           H        ILE  34  -3.949   6.456  -1.788
  261    HA   ILE  34           HA       ILE  34  -1.782   4.482  -1.412
  262    HB   ILE  34           HB       ILE  34  -4.236   4.041  -3.117
  263   1HG1  ILE  34          1HG1      ILE  34  -3.595   2.818  -0.431
  264   2HG1  ILE  34          2HG1      ILE  34  -4.768   4.106  -0.680
  265   1HG2  ILE  34          1HG2      ILE  34  -2.272   2.849  -3.891
  266   2HG2  ILE  34          2HG2      ILE  34  -2.019   2.185  -2.276
  267   3HG2  ILE  34          3HG2      ILE  34  -3.446   1.724  -3.206
  268   1HD1  ILE  34          1HD1      ILE  34  -5.862   1.953  -0.498
  269   2HD1  ILE  34          2HD1      ILE  34  -6.080   2.627  -2.113
  270   3HD1  ILE  34          3HD1      ILE  34  -4.908   1.338  -1.848
  271    H    LEU  35           H        LEU  35  -0.212   4.518  -2.885
  272    HA   LEU  35           HA       LEU  35  -0.620   6.201  -5.268
  273   1HB   LEU  35          1HB       LEU  35   1.067   7.041  -3.692
  274   2HB   LEU  35          2HB       LEU  35   1.941   5.527  -3.816
  275    HG   LEU  35           HG       LEU  35   2.374   5.988  -6.205
  276   1HD1  LEU  35          1HD1      LEU  35   1.050   8.634  -5.619
  277   2HD1  LEU  35          2HD1      LEU  35   1.916   8.221  -7.098
  278   3HD1  LEU  35          3HD1      LEU  35   0.429   7.370  -6.682
  279   1HD2  LEU  35          1HD2      LEU  35   3.996   6.640  -4.485
  280   2HD2  LEU  35          2HD2      LEU  35   4.012   7.752  -5.855
  281   3HD2  LEU  35          3HD2      LEU  35   3.214   8.216  -4.352
  282    H    MET  36           H        MET  36  -0.677   5.198  -7.145
  283    HA   MET  36           HA       MET  36   0.818   2.678  -7.465
  284   1HB   MET  36          1HB       MET  36  -1.871   3.405  -8.661
  285   2HB   MET  36          2HB       MET  36  -0.954   1.959  -9.055
  286   1HG   MET  36          1HG       MET  36  -1.138   1.222  -6.724
  287   2HG   MET  36          2HG       MET  36  -2.093   2.659  -6.359
  288   1HE   MET  36          1HE       MET  36  -1.938  -0.724  -8.320
  289   2HE   MET  36          2HE       MET  36  -2.202   0.442  -9.617
  290   3HE   MET  36          3HE       MET  36  -3.469  -0.711  -9.196
  291    HA   PRO  37           HA       PRO  37   2.931   4.317 -10.987
  292   1HB   PRO  37          1HB       PRO  37   1.610   2.267 -12.702
  293   2HB   PRO  37          2HB       PRO  37   3.326   2.657 -12.531
  294   1HG   PRO  37          1HG       PRO  37   2.317   0.476 -11.389
  295   2HG   PRO  37          2HG       PRO  37   3.535   1.458 -10.553
  296   1HD   PRO  37          1HD       PRO  37   0.592   1.288 -10.092
  297   2HD   PRO  37          2HD       PRO  37   1.909   1.504  -8.921
  298    H    ASP  38           H        ASP  38   2.035   6.279 -11.358
  299    HA   ASP  38           HA       ASP  38   0.890   7.943 -12.372
  300   1HB   ASP  38          1HB       ASP  38   0.340   5.767 -14.390
  301   2HB   ASP  38          2HB       ASP  38  -0.196   7.430 -14.604
  302    H    GLU  39           H        GLU  39  -0.403   6.015 -10.460
  303    HA   GLU  39           HA       GLU  39  -3.183   6.805 -11.008
  304   1HB   GLU  39          1HB       GLU  39  -2.349   4.230 -11.239
  305   2HB   GLU  39          2HB       GLU  39  -2.770   4.277  -9.533
  306   1HG   GLU  39          1HG       GLU  39  -4.718   3.560 -10.548
  307   2HG   GLU  39          2HG       GLU  39  -4.994   5.287 -10.322
  308    H    LEU  40           H        LEU  40  -3.464   8.361  -9.475
  309    HA   LEU  40           HA       LEU  40  -2.466   7.845  -6.770
  310   1HB   LEU  40          1HB       LEU  40  -1.968  10.037  -7.786
  311   2HB   LEU  40          2HB       LEU  40  -3.685  10.350  -7.939
  312    HG   LEU  40           HG       LEU  40  -3.906  10.307  -5.483
  313   1HD1  LEU  40          1HD1      LEU  40  -0.906  10.013  -5.517
  314   2HD1  LEU  40          2HD1      LEU  40  -1.893  10.330  -4.090
  315   3HD1  LEU  40          3HD1      LEU  40  -2.067   8.808  -4.961
  316   1HD2  LEU  40          1HD2      LEU  40  -3.557  12.427  -6.610
  317   2HD2  LEU  40          2HD2      LEU  40  -2.736  12.418  -5.048
  318   3HD2  LEU  40          3HD2      LEU  40  -1.810  12.202  -6.534
  319    H    VAL  41           H        VAL  41  -3.798   6.908  -5.371
  320    HA   VAL  41           HA       VAL  41  -6.678   7.011  -5.901
  321    HB   VAL  41           HB       VAL  41  -5.247   5.310  -3.870
  322   1HG1  VAL  41          1HG1      VAL  41  -7.291   3.957  -3.935
  323   2HG1  VAL  41          2HG1      VAL  41  -7.615   5.613  -3.423
  324   3HG1  VAL  41          3HG1      VAL  41  -8.004   5.107  -5.066
  325   1HG2  VAL  41          1HG2      VAL  41  -4.406   4.770  -6.086
  326   2HG2  VAL  41          2HG2      VAL  41  -5.434   3.470  -5.486
  327   3HG2  VAL  41          3HG2      VAL  41  -6.057   4.602  -6.686
  328    H    GLU  42           H        GLU  42  -7.514   8.792  -5.069
  329    HA   GLU  42           HA       GLU  42  -6.840   9.570  -2.321
  330   1HB   GLU  42          1HB       GLU  42  -6.722  11.202  -4.299
  331   2HB   GLU  42          2HB       GLU  42  -8.473  11.129  -4.335
  332   1HG   GLU  42          1HG       GLU  42  -6.999  11.913  -1.849
  333   2HG   GLU  42          2HG       GLU  42  -7.341  13.080  -3.123
  334    H    HIS  43           H        HIS  43  -8.525   9.906  -0.812
  335    HA   HIS  43           HA       HIS  43 -10.476   9.551   0.264
  336   1HB   HIS  43          1HB       HIS  43 -11.691  10.541  -1.572
  337   2HB   HIS  43          2HB       HIS  43 -11.600   9.048  -2.498
  338    HD1  HIS  43           HD1      HIS  43 -13.159  10.346   0.722
  339    HD2  HIS  43           HD2      HIS  43 -13.730   7.397  -2.157
  340    HE1  HIS  43           HE1      HIS  43 -15.354   9.255   1.291
  341    HE2  HIS  43           HE2      HIS  43 -15.787   7.658  -0.614
  342    H    TRP  44           H        TRP  44  -9.490   7.870   1.304
  343    HA   TRP  44           HA       TRP  44 -10.899   5.393   1.087
  344   1HB   TRP  44          1HB       TRP  44  -9.054   5.103  -0.599
  345   2HB   TRP  44          2HB       TRP  44  -7.893   5.322   0.704
  346    HD1  TRP  44           HD1      TRP  44 -10.895   2.942   0.001
  347    HE1  TRP  44           HE1      TRP  44 -10.222   0.582   0.791
  348    HE3  TRP  44           HE3      TRP  44  -6.240   4.000   1.835
  349    HZ2  TRP  44           HZ2      TRP  44  -8.006  -0.658   2.021
  350    HZ3  TRP  44           HZ3      TRP  44  -4.907   2.170   2.798
  351    HH2  TRP  44           HH2      TRP  44  -5.774  -0.110   2.888
  352    HA   PRO  45           HA       PRO  45  -9.780   7.118   5.184
  353   1HB   PRO  45          1HB       PRO  45 -12.262   5.772   6.018
  354   2HB   PRO  45          2HB       PRO  45 -11.791   7.467   6.179
  355   1HG   PRO  45          1HG       PRO  45 -13.664   6.699   4.425
  356   2HG   PRO  45          2HG       PRO  45 -12.531   8.014   4.061
  357   1HD   PRO  45          1HD       PRO  45 -12.484   5.160   3.144
  358   2HD   PRO  45          2HD       PRO  45 -12.141   6.643   2.227
  359    H    VAL  46           H        VAL  46  -8.045   5.818   5.684
  360    HA   VAL  46           HA       VAL  46  -8.734   3.711   7.594
  361    HB   VAL  46           HB       VAL  46  -6.464   3.371   5.612
  362   1HG1  VAL  46          1HG1      VAL  46  -7.523   1.525   7.751
  363   2HG1  VAL  46          2HG1      VAL  46  -6.246   1.136   6.598
  364   3HG1  VAL  46          3HG1      VAL  46  -5.995   2.405   7.796
  365   1HG2  VAL  46          1HG2      VAL  46  -7.741   1.488   4.701
  366   2HG2  VAL  46          2HG2      VAL  46  -9.091   1.895   5.761
  367   3HG2  VAL  46          3HG2      VAL  46  -8.596   3.015   4.492
  368    HA   PRO  47           HA       PRO  47  -5.993   7.066   9.193
  369   1HB   PRO  47          1HB       PRO  47  -6.923   6.886  11.766
  370   2HB   PRO  47          2HB       PRO  47  -7.664   7.888  10.516
  371   1HG   PRO  47          1HG       PRO  47  -8.463   5.177  11.494
  372   2HG   PRO  47          2HG       PRO  47  -9.484   6.566  11.077
  373   1HD   PRO  47          1HD       PRO  47  -9.152   4.474   9.408
  374   2HD   PRO  47          2HD       PRO  47  -9.364   6.133   8.811
  375    H    SER  48           H        SER  48  -6.643   3.894  10.559
  376    HA   SER  48           HA       SER  48  -3.821   3.520  11.079
  377   1HB   SER  48          1HB       SER  48  -5.860   3.200  13.300
  378   2HB   SER  48          2HB       SER  48  -4.128   2.878  13.416
  379    HG   SER  48           HG       SER  48  -4.305   5.318  12.523
  380    H    LEU  49           H        LEU  49  -3.310   1.253  11.478
  381    HA   LEU  49           HA       LEU  49  -4.967  -0.476   9.932
  382   1HB   LEU  49          1HB       LEU  49  -2.483  -0.645  10.029
  383   2HB   LEU  49          2HB       LEU  49  -2.618  -1.202  11.685
  384    HG   LEU  49           HG       LEU  49  -3.822  -3.199  10.937
  385   1HD1  LEU  49          1HD1      LEU  49  -4.015  -3.701   8.550
  386   2HD1  LEU  49          2HD1      LEU  49  -4.932  -2.259   8.985
  387   3HD1  LEU  49          3HD1      LEU  49  -3.379  -2.102   8.164
  388   1HD2  LEU  49          1HD2      LEU  49  -1.973  -4.303   9.797
  389   2HD2  LEU  49          2HD2      LEU  49  -1.261  -2.735   9.415
  390   3HD2  LEU  49          3HD2      LEU  49  -1.385  -3.262  11.094
  391    H    GLY  50           H        GLY  50  -6.902  -0.786  10.815
  392   1HA   GLY  50          1HA       GLY  50  -7.284  -2.717  12.803
  393   2HA   GLY  50          2HA       GLY  50  -7.479  -1.130  13.543
  394    H    GLN  51           H        GLN  51  -8.579   0.227  11.362
  395    HA   GLN  51           HA       GLN  51 -11.270  -0.886  11.311
  396   1HB   GLN  51          1HB       GLN  51 -10.210   1.751  10.268
  397   2HB   GLN  51          2HB       GLN  51 -11.899   1.274  10.262
  398   1HG   GLN  51          1HG       GLN  51 -11.716   2.670  12.103
  399   2HG   GLN  51          2HG       GLN  51 -11.660   1.052  12.796
  400   1HE2  GLN  51          2HE2      GLN  51  -8.979   2.523  11.106
  401   2HE2  GLN  51          1HE2      GLN  51  -7.959   2.699  12.489
  402    H    LEU  52           H        LEU  52  -8.737  -1.688   9.683
  403    HA   LEU  52           HA       LEU  52  -9.715  -1.333   6.970
  404   1HB   LEU  52          1HB       LEU  52  -7.323  -1.019   7.396
  405   2HB   LEU  52          2HB       LEU  52  -7.203  -2.663   7.995
  406    HG   LEU  52           HG       LEU  52  -7.752  -3.529   5.768
  407   1HD1  LEU  52          1HD1      LEU  52  -7.776  -0.631   4.940
  408   2HD1  LEU  52          2HD1      LEU  52  -7.856  -2.016   3.850
  409   3HD1  LEU  52          3HD1      LEU  52  -9.167  -1.714   4.990
  410   1HD2  LEU  52          1HD2      LEU  52  -5.515  -1.507   5.732
  411   2HD2  LEU  52          2HD2      LEU  52  -5.413  -3.150   6.366
  412   3HD2  LEU  52          3HD2      LEU  52  -5.688  -2.884   4.645
  413    H    GLN  53           H        GLN  53 -11.479  -2.593   6.802
  414    HA   GLN  53           HA       GLN  53 -11.264  -5.448   7.401
  415   1HB   GLN  53          1HB       GLN  53 -13.630  -3.754   6.563
  416   2HB   GLN  53          2HB       GLN  53 -13.703  -5.472   6.934
  417   1HG   GLN  53          1HG       GLN  53 -13.080  -5.050   9.222
  418   2HG   GLN  53          2HG       GLN  53 -12.852  -3.336   8.875
  419   1HE2  GLN  53          2HE2      GLN  53 -14.640  -2.024   8.581
  420   2HE2  GLN  53          1HE2      GLN  53 -16.234  -2.509   9.053
  421    HA   PRO  54           HA       PRO  54 -10.646  -6.780   3.218
  422   1HB   PRO  54          1HB       PRO  54 -13.031  -8.530   3.535
  423   2HB   PRO  54          2HB       PRO  54 -11.381  -8.948   3.060
  424   1HG   PRO  54          1HG       PRO  54 -12.291  -9.532   5.494
  425   2HG   PRO  54          2HG       PRO  54 -10.621  -8.989   5.247
  426   1HD   PRO  54          1HD       PRO  54 -12.968  -7.484   6.317
  427   2HD   PRO  54          2HD       PRO  54 -11.261  -7.406   6.798
  428    H    ALA  55           H        ALA  55 -13.913  -5.955   4.212
  429    HA   ALA  55           HA       ALA  55 -14.983  -5.644   1.597
  430   1HB   ALA  55          1HB       ALA  55 -15.924  -4.463   4.210
  431   2HB   ALA  55          2HB       ALA  55 -16.856  -4.547   2.714
  432   3HB   ALA  55          3HB       ALA  55 -16.399  -6.029   3.553
  433    H    HIS  56           H        HIS  56 -12.992  -3.698   3.605
  434    HA   HIS  56           HA       HIS  56 -13.603  -1.276   2.069
  435   1HB   HIS  56          1HB       HIS  56 -13.515  -1.244   4.607
  436   2HB   HIS  56          2HB       HIS  56 -11.782  -1.512   4.468
  437    HD1  HIS  56           HD1      HIS  56 -14.343   1.000   3.177
  438    HD2  HIS  56           HD2      HIS  56 -10.377   0.792   4.424
  439    HE1  HIS  56           HE1      HIS  56 -13.501   3.372   3.169
  440    HE2  HIS  56           HE2      HIS  56 -11.179   3.234   4.143
  441    H    MET  57           H        MET  57 -11.097  -3.616   2.722
  442    HA   MET  57           HA       MET  57  -9.054  -2.313   1.176
  443   1HB   MET  57          1HB       MET  57  -8.661  -4.025   2.997
  444   2HB   MET  57          2HB       MET  57  -9.288  -5.245   1.899
  445   1HG   MET  57          1HG       MET  57  -6.895  -5.302   1.873
  446   2HG   MET  57          2HG       MET  57  -7.478  -4.708   0.318
  447   1HE   MET  57          1HE       MET  57  -4.083  -2.781   0.876
  448   2HE   MET  57          2HE       MET  57  -4.973  -3.873  -0.185
  449   3HE   MET  57          3HE       MET  57  -4.450  -4.424   1.407
  450    H    ASP  58           H        ASP  58 -11.872  -3.951   0.507
  451    HA   ASP  58           HA       ASP  58 -11.455  -5.422  -1.787
  452   1HB   ASP  58          1HB       ASP  58 -13.564  -5.408  -0.588
  453   2HB   ASP  58          2HB       ASP  58 -13.819  -3.715  -0.990
  454    H    ALA  59           H        ALA  59 -11.709  -1.942  -1.410
  455    HA   ALA  59           HA       ALA  59 -12.052  -1.188  -4.077
  456   1HB   ALA  59          1HB       ALA  59 -11.137   0.972  -3.417
  457   2HB   ALA  59          2HB       ALA  59 -12.254   0.366  -2.194
  458   3HB   ALA  59          3HB       ALA  59 -10.513   0.265  -1.927
  459    H    VAL  60           H        VAL  60  -9.104  -1.836  -2.234
  460    HA   VAL  60           HA       VAL  60  -7.284  -1.183  -4.301
  461    HB   VAL  60           HB       VAL  60  -6.827  -3.146  -2.049
  462   1HG1  VAL  60          1HG1      VAL  60  -4.481  -2.458  -2.269
  463   2HG1  VAL  60          2HG1      VAL  60  -5.097  -3.172  -3.759
  464   3HG1  VAL  60          3HG1      VAL  60  -4.918  -1.424  -3.628
  465   1HG2  VAL  60          1HG2      VAL  60  -5.994  -1.248  -0.747
  466   2HG2  VAL  60          2HG2      VAL  60  -6.486  -0.150  -2.036
  467   3HG2  VAL  60          3HG2      VAL  60  -7.702  -1.065  -1.144
  468    H    LEU  61           H        LEU  61  -8.923  -4.136  -3.321
  469    HA   LEU  61           HA       LEU  61  -7.589  -5.889  -5.096
  470   1HB   LEU  61          1HB       LEU  61 -10.361  -6.102  -3.914
  471   2HB   LEU  61          2HB       LEU  61  -9.485  -7.409  -4.689
  472    HG   LEU  61           HG       LEU  61  -8.655  -6.015  -2.142
  473   1HD1  LEU  61          1HD1      LEU  61  -9.812  -8.760  -2.608
  474   2HD1  LEU  61          2HD1      LEU  61  -9.208  -8.146  -1.069
  475   3HD1  LEU  61          3HD1      LEU  61 -10.620  -7.404  -1.821
  476   1HD2  LEU  61          1HD2      LEU  61  -6.954  -7.761  -1.988
  477   2HD2  LEU  61          2HD2      LEU  61  -7.457  -8.396  -3.554
  478   3HD2  LEU  61          3HD2      LEU  61  -6.740  -6.789  -3.444
  479    H    ALA  62           H        ALA  62 -10.374  -3.784  -5.434
  480    HA   ALA  62           HA       ALA  62 -11.295  -4.779  -7.924
  481   1HB   ALA  62          1HB       ALA  62 -12.682  -3.405  -6.441
  482   2HB   ALA  62          2HB       ALA  62 -11.633  -2.021  -6.749
  483   3HB   ALA  62          3HB       ALA  62 -12.581  -2.719  -8.062
  484    H    LEU  63           H        LEU  63  -8.865  -2.421  -7.013
  485    HA   LEU  63           HA       LEU  63  -8.403  -1.430  -9.650
  486   1HB   LEU  63          1HB       LEU  63  -6.590  -1.444  -7.235
  487   2HB   LEU  63          2HB       LEU  63  -6.323  -0.512  -8.695
  488    HG   LEU  63           HG       LEU  63  -8.658  -0.158  -6.812
  489   1HD1  LEU  63          1HD1      LEU  63  -6.556   0.547  -5.806
  490   2HD1  LEU  63          2HD1      LEU  63  -6.197   1.532  -7.224
  491   3HD1  LEU  63          3HD1      LEU  63  -7.569   1.937  -6.194
  492   1HD2  LEU  63          1HD2      LEU  63  -9.200   0.405  -9.130
  493   2HD2  LEU  63          2HD2      LEU  63  -9.127   1.847  -8.118
  494   3HD2  LEU  63          3HD2      LEU  63  -7.791   1.464  -9.205
  495    H    ASN  64           H        ASN  64  -7.592  -4.281  -8.017
  496    HA   ASN  64           HA       ASN  64  -6.438  -6.146  -8.522
  497   1HB   ASN  64          1HB       ASN  64  -6.525  -4.992 -11.311
  498   2HB   ASN  64          2HB       ASN  64  -5.886  -6.589 -10.936
  499   1HD2  ASN  64          2HD2      ASN  64  -8.697  -4.656 -11.312
  500   2HD2  ASN  64          1HD2      ASN  64  -9.865  -5.927 -11.148
  501    HA   PRO  65           HA       PRO  65  -2.255  -4.390  -8.482
  502   1HB   PRO  65          1HB       PRO  65  -1.681  -4.782  -5.900
  503   2HB   PRO  65          2HB       PRO  65  -2.649  -3.398  -6.419
  504   1HG   PRO  65          1HG       PRO  65  -3.495  -5.890  -5.054
  505   2HG   PRO  65          2HG       PRO  65  -4.207  -4.271  -4.984
  506   1HD   PRO  65          1HD       PRO  65  -5.067  -6.480  -6.567
  507   2HD   PRO  65          2HD       PRO  65  -5.701  -4.823  -6.590
  508    H    ALA  66           H        ALA  66  -0.213  -5.547  -7.689
  509    HA   ALA  66           HA       ALA  66  -0.599  -8.472  -7.613
  510   1HB   ALA  66          1HB       ALA  66   0.392  -7.780  -9.745
  511   2HB   ALA  66          2HB       ALA  66   1.694  -6.966  -8.879
  512   3HB   ALA  66          3HB       ALA  66   1.533  -8.720  -8.784
  513    H    VAL  67           H        VAL  67   1.530  -5.787  -6.738
  514    HA   VAL  67           HA       VAL  67   2.123  -7.194  -4.227
  515    HB   VAL  67           HB       VAL  67   4.137  -7.275  -5.556
  516   1HG1  VAL  67          1HG1      VAL  67   5.261  -5.243  -6.355
  517   2HG1  VAL  67          2HG1      VAL  67   3.693  -5.489  -7.121
  518   3HG1  VAL  67          3HG1      VAL  67   3.870  -4.289  -5.841
  519   1HG2  VAL  67          1HG2      VAL  67   4.348  -5.149  -3.429
  520   2HG2  VAL  67          2HG2      VAL  67   4.454  -6.891  -3.183
  521   3HG2  VAL  67          3HG2      VAL  67   5.702  -6.053  -4.106
  522    H    ILE  68           H        ILE  68   1.870  -6.023  -2.399
  523    HA   ILE  68           HA       ILE  68   1.127  -3.189  -2.717
  524    HB   ILE  68           HB       ILE  68  -0.173  -5.169  -0.835
  525   1HG1  ILE  68          1HG1      ILE  68  -1.306  -3.785  -3.279
  526   2HG1  ILE  68          2HG1      ILE  68  -0.853  -5.484  -3.194
  527   1HG2  ILE  68          1HG2      ILE  68  -1.702  -3.325  -0.302
  528   2HG2  ILE  68          2HG2      ILE  68  -0.034  -2.936   0.119
  529   3HG2  ILE  68          3HG2      ILE  68  -0.759  -2.253  -1.338
  530   1HD1  ILE  68          1HD1      ILE  68  -3.255  -5.188  -2.977
  531   2HD1  ILE  68          2HD1      ILE  68  -2.563  -5.859  -1.500
  532   3HD1  ILE  68          3HD1      ILE  68  -3.009  -4.154  -1.570
  533    H    LEU  69           H        LEU  69   2.525  -1.965  -1.679
  534    HA   LEU  69           HA       LEU  69   3.993  -3.029   0.606
  535   1HB   LEU  69          1HB       LEU  69   4.268  -0.510  -1.027
  536   2HB   LEU  69          2HB       LEU  69   5.185  -0.787   0.443
  537    HG   LEU  69           HG       LEU  69   5.288  -2.666  -1.911
  538   1HD1  LEU  69          1HD1      LEU  69   6.026  -0.469  -2.643
  539   2HD1  LEU  69          2HD1      LEU  69   7.108  -0.354  -1.255
  540   3HD1  LEU  69          3HD1      LEU  69   7.397  -1.568  -2.501
  541   1HD2  LEU  69          1HD2      LEU  69   7.347  -3.420  -0.861
  542   2HD2  LEU  69          2HD2      LEU  69   7.135  -2.243   0.435
  543   3HD2  LEU  69          3HD2      LEU  69   5.990  -3.571   0.256
  544    H    LEU  70           H        LEU  70   3.008  -2.882   2.487
  545    HA   LEU  70           HA       LEU  70   1.117  -0.702   2.965
  546   1HB   LEU  70          1HB       LEU  70   0.378  -3.013   3.401
  547   2HB   LEU  70          2HB       LEU  70   1.674  -3.206   4.564
  548    HG   LEU  70           HG       LEU  70   0.652  -1.429   5.959
  549   1HD1  LEU  70          1HD1      LEU  70  -0.513  -0.200   4.216
  550   2HD1  LEU  70          2HD1      LEU  70  -1.582  -1.574   3.940
  551   3HD1  LEU  70          3HD1      LEU  70  -1.638  -0.709   5.476
  552   1HD2  LEU  70          1HD2      LEU  70  -1.178  -3.728   5.277
  553   2HD2  LEU  70          2HD2      LEU  70   0.180  -3.782   6.402
  554   3HD2  LEU  70          3HD2      LEU  70  -1.222  -2.774   6.760
  555    H    GLY  71           H        GLY  71   2.097   1.071   3.689
  556   1HA   GLY  71          1HA       GLY  71   4.353   0.834   5.536
  557   2HA   GLY  71          2HA       GLY  71   3.802   2.309   4.751
  558    H    THR  72           H        THR  72   3.504   0.244   7.498
  559    HA   THR  72           HA       THR  72   1.186   1.620   8.544
  560    HB   THR  72           HB       THR  72   1.765   0.169  10.617
  561    HG1  THR  72           HG1      THR  72   3.903  -0.374   9.921
  562   1HG2  THR  72          1HG2      THR  72  -0.099  -0.287   9.103
  563   2HG2  THR  72          2HG2      THR  72   0.995  -1.115   7.994
  564   3HG2  THR  72          3HG2      THR  72   0.691  -1.786   9.596
  565    H    GLY  73           H        GLY  73   2.577   3.667   8.269
  566   1HA   GLY  73          1HA       GLY  73   3.585   5.463   9.266
  567   2HA   GLY  73          2HA       GLY  73   3.100   4.743  10.794
  568    H    GLU  74           H        GLU  74   4.804   4.838  12.071
  569    HA   GLU  74           HA       GLU  74   7.471   4.270  11.024
  570   1HB   GLU  74          1HB       GLU  74   6.402   5.619  13.466
  571   2HB   GLU  74          2HB       GLU  74   8.020   4.931  13.519
  572   1HG   GLU  74          1HG       GLU  74   7.105   6.899  11.440
  573   2HG   GLU  74          2HG       GLU  74   7.925   7.347  12.936
  574    H    ARG  75           H        ARG  75   5.124   2.365  11.893
  575    HA   ARG  75           HA       ARG  75   6.833   0.593  13.515
  576   1HB   ARG  75          1HB       ARG  75   3.826   0.889  13.576
  577   2HB   ARG  75          2HB       ARG  75   4.704  -0.399  14.382
  578   1HG   ARG  75          1HG       ARG  75   5.868   1.282  15.750
  579   2HG   ARG  75          2HG       ARG  75   4.911   2.545  14.969
  580   1HD   ARG  75          1HD       ARG  75   2.864   1.539  15.801
  581   2HD   ARG  75          2HD       ARG  75   3.782   0.222  16.524
  582    HE   ARG  75           HE       ARG  75   4.821   2.523  17.624
  583   1HH1  ARG  75          1HH1      ARG  75   1.664   1.021  17.440
  584   2HH1  ARG  75          2HH1      ARG  75   1.121   1.647  18.967
  585   1HH2  ARG  75          1HH2      ARG  75   4.126   3.334  19.662
  586   2HH2  ARG  75          2HH2      ARG  75   2.534   2.937  20.239
  587    H    GLN  76           H        GLN  76   6.432  -1.713  13.173
  588    HA   GLN  76           HA       GLN  76   5.268  -2.295  10.543
  589   1HB   GLN  76          1HB       GLN  76   7.350  -3.760  12.149
  590   2HB   GLN  76          2HB       GLN  76   6.498  -4.513  10.804
  591   1HG   GLN  76          1HG       GLN  76   7.271  -2.704   9.344
  592   2HG   GLN  76          2HG       GLN  76   8.200  -2.044  10.687
  593   1HE2  GLN  76          2HE2      GLN  76   8.849  -4.744  11.679
  594   2HE2  GLN  76          1HE2      GLN  76  10.085  -5.345  10.619
  595    H    GLN  77           H        GLN  77   3.264  -2.874  10.714
  596    HA   GLN  77           HA       GLN  77   2.472  -4.484  13.054
  597   1HB   GLN  77          1HB       GLN  77   1.639  -2.125  13.103
  598   2HB   GLN  77          2HB       GLN  77   0.750  -2.455  11.623
  599   1HG   GLN  77          1HG       GLN  77  -0.494  -4.226  12.808
  600   2HG   GLN  77          2HG       GLN  77   0.351  -3.791  14.292
  601   1HE2  GLN  77          2HE2      GLN  77  -2.489  -3.745  13.672
  602   2HE2  GLN  77          1HE2      GLN  77  -3.018  -2.121  13.939
  603    H    PHE  78           H        PHE  78   1.192  -6.223  12.720
  604    HA   PHE  78           HA       PHE  78   0.888  -7.129   9.986
  605   1HB   PHE  78          1HB       PHE  78   0.200  -8.500  12.598
  606   2HB   PHE  78          2HB       PHE  78   0.166  -9.253  11.008
  607    HD1  PHE  78           HD1      PHE  78   2.277  -9.628   9.777
  608    HD2  PHE  78           HD2      PHE  78   2.230  -8.229  13.796
  609    HE1  PHE  78           HE1      PHE  78   4.642 -10.259  10.021
  610    HE2  PHE  78           HE2      PHE  78   4.597  -8.855  14.045
  611    HZ   PHE  78           HZ       PHE  78   5.806  -9.871  12.156
  612    HA   PRO  79           HA       PRO  79  -3.337  -5.780   9.821
  613   1HB   PRO  79          1HB       PRO  79  -4.033  -6.975   7.503
  614   2HB   PRO  79          2HB       PRO  79  -2.979  -5.558   7.558
  615   1HG   PRO  79          1HG       PRO  79  -2.266  -8.442   7.232
  616   2HG   PRO  79          2HG       PRO  79  -1.596  -7.020   6.411
  617   1HD   PRO  79          1HD       PRO  79  -0.377  -8.280   8.516
  618   2HD   PRO  79          2HD       PRO  79  -0.149  -6.563   8.128
  619    H    SER  80           H        SER  80  -5.523  -6.895   9.224
  620    HA   SER  80           HA       SER  80  -5.964  -8.899  11.170
  621   1HB   SER  80          1HB       SER  80  -7.641  -7.182  10.504
  622   2HB   SER  80          2HB       SER  80  -7.804  -7.984   8.944
  623    HG   SER  80           HG       SER  80  -9.266  -9.129   9.908
  624    H    THR  81           H        THR  81  -6.713 -11.057  10.854
  625    HA   THR  81           HA       THR  81  -5.169 -12.530   9.024
  626    HB   THR  81           HB       THR  81  -7.639 -13.516  10.462
  627    HG1  THR  81           HG1      THR  81  -6.459 -12.846  12.134
  628   1HG2  THR  81          1HG2      THR  81  -6.726 -15.064   8.792
  629   2HG2  THR  81          2HG2      THR  81  -5.138 -14.946   9.549
  630   3HG2  THR  81          3HG2      THR  81  -6.482 -15.674  10.429
  631    H    ASP  82           H        ASP  82  -8.495 -11.409   8.928
  632    HA   ASP  82           HA       ASP  82  -9.295 -12.842   6.631
  633   1HB   ASP  82          1HB       ASP  82 -11.002 -10.896   6.452
  634   2HB   ASP  82          2HB       ASP  82 -11.080 -11.971   7.843
  635    H    VAL  83           H        VAL  83  -7.653  -9.763   7.055
  636    HA   VAL  83           HA       VAL  83  -7.664  -9.031   4.305
  637    HB   VAL  83           HB       VAL  83  -5.669  -8.257   6.447
  638   1HG1  VAL  83          1HG1      VAL  83  -5.240  -6.298   5.024
  639   2HG1  VAL  83          2HG1      VAL  83  -4.825  -7.809   4.215
  640   3HG1  VAL  83          3HG1      VAL  83  -6.318  -6.966   3.799
  641   1HG2  VAL  83          1HG2      VAL  83  -8.206  -6.883   5.568
  642   2HG2  VAL  83          2HG2      VAL  83  -7.929  -7.676   7.118
  643   3HG2  VAL  83          3HG2      VAL  83  -7.024  -6.222   6.698
  644    H    LEU  84           H        LEU  84  -5.468 -10.852   6.376
  645    HA   LEU  84           HA       LEU  84  -3.444 -11.327   4.477
  646   1HB   LEU  84          1HB       LEU  84  -4.319 -12.972   6.851
  647   2HB   LEU  84          2HB       LEU  84  -2.856 -13.268   5.932
  648    HG   LEU  84           HG       LEU  84  -3.447 -10.747   7.487
  649   1HD1  LEU  84          1HD1      LEU  84  -1.711 -11.553   9.017
  650   2HD1  LEU  84          2HD1      LEU  84  -3.092 -12.648   8.962
  651   3HD1  LEU  84          3HD1      LEU  84  -1.608 -13.056   8.101
  652   1HD2  LEU  84          1HD2      LEU  84  -2.017 -10.348   5.551
  653   2HD2  LEU  84          2HD2      LEU  84  -1.100 -10.208   7.053
  654   3HD2  LEU  84          3HD2      LEU  84  -0.950 -11.658   6.059
  655    H    ALA  85           H        ALA  85  -6.506 -12.911   5.117
  656    HA   ALA  85           HA       ALA  85  -6.166 -15.198   3.536
  657   1HB   ALA  85          1HB       ALA  85  -8.598 -15.299   3.429
  658   2HB   ALA  85          2HB       ALA  85  -8.057 -14.904   5.062
  659   3HB   ALA  85          3HB       ALA  85  -8.703 -13.638   4.016
  660    H    ALA  86           H        ALA  86  -7.515 -12.014   2.683
  661    HA   ALA  86           HA       ALA  86  -7.989 -12.528  -0.027
  662   1HB   ALA  86          1HB       ALA  86  -8.861 -10.558   1.136
  663   2HB   ALA  86          2HB       ALA  86  -7.226  -9.906   1.259
  664   3HB   ALA  86          3HB       ALA  86  -7.979 -10.104  -0.323
  665    H    CYS  87           H        CYS  87  -5.101 -11.456   1.657
  666    HA   CYS  87           HA       CYS  87  -3.449 -10.957  -0.554
  667   1HB   CYS  87          1HB       CYS  87  -2.825 -10.250   1.677
  668   2HB   CYS  87          2HB       CYS  87  -2.799 -11.913   2.243
  669    HG   CYS  87           HG       CYS  87  -0.709 -11.596  -0.283
  670    H    LEU  88           H        LEU  88  -4.195 -13.926   1.195
  671    HA   LEU  88           HA       LEU  88  -2.283 -15.523  -0.214
  672   1HB   LEU  88          1HB       LEU  88  -3.258 -15.924   2.112
  673   2HB   LEU  88          2HB       LEU  88  -4.698 -16.503   1.302
  674    HG   LEU  88           HG       LEU  88  -1.993 -17.736   0.805
  675   1HD1  LEU  88          1HD1      LEU  88  -2.438 -17.828   3.197
  676   2HD1  LEU  88          2HD1      LEU  88  -4.030 -18.520   2.884
  677   3HD1  LEU  88          3HD1      LEU  88  -2.577 -19.427   2.464
  678   1HD2  LEU  88          1HD2      LEU  88  -3.754 -18.255  -0.818
  679   2HD2  LEU  88          2HD2      LEU  88  -3.321 -19.675   0.136
  680   3HD2  LEU  88          3HD2      LEU  88  -4.807 -18.790   0.491
  681    H    THR  89           H        THR  89  -5.802 -15.099  -0.384
  682    HA   THR  89           HA       THR  89  -6.420 -17.099  -2.190
  683    HB   THR  89           HB       THR  89  -7.789 -14.408  -2.010
  684    HG1  THR  89           HG1      THR  89  -8.182 -16.779  -0.471
  685   1HG2  THR  89          1HG2      THR  89  -9.796 -15.675  -2.632
  686   2HG2  THR  89          2HG2      THR  89  -8.557 -15.781  -3.883
  687   3HG2  THR  89          3HG2      THR  89  -8.824 -17.138  -2.788
  688    H    ARG  90           H        ARG  90  -5.436 -13.745  -2.916
  689    HA   ARG  90           HA       ARG  90  -5.569 -14.386  -5.769
  690   1HB   ARG  90          1HB       ARG  90  -5.283 -11.784  -4.289
  691   2HB   ARG  90          2HB       ARG  90  -5.033 -11.904  -6.024
  692   1HG   ARG  90          1HG       ARG  90  -7.347 -12.859  -6.192
  693   2HG   ARG  90          2HG       ARG  90  -7.561 -12.440  -4.491
  694   1HD   ARG  90          1HD       ARG  90  -8.461 -10.726  -6.029
  695   2HD   ARG  90          2HD       ARG  90  -7.193 -10.106  -4.973
  696    HE   ARG  90           HE       ARG  90  -5.702 -10.570  -7.020
  697   1HH1  ARG  90          1HH1      ARG  90  -9.049  -9.553  -7.218
  698   2HH1  ARG  90          2HH1      ARG  90  -8.827  -8.690  -8.706
  699   1HH2  ARG  90          1HH2      ARG  90  -5.420  -9.455  -9.005
  700   2HH2  ARG  90          2HH2      ARG  90  -6.780  -8.650  -9.728
  701    H    GLY  91           H        GLY  91  -3.319 -14.675  -3.407
  702   1HA   GLY  91          1HA       GLY  91  -1.039 -14.983  -3.453
  703   2HA   GLY  91          2HA       GLY  91  -1.154 -14.986  -5.208
  704    H    ILE  92           H        ILE  92  -1.956 -12.452  -2.886
  705    HA   ILE  92           HA       ILE  92  -0.549 -10.511  -4.509
  706    HB   ILE  92           HB       ILE  92  -2.129 -10.158  -1.955
  707   1HG1  ILE  92          1HG1      ILE  92  -3.515 -10.958  -3.808
  708   2HG1  ILE  92          2HG1      ILE  92  -3.906  -9.289  -3.413
  709   1HG2  ILE  92          1HG2      ILE  92  -1.085  -8.098  -3.892
  710   2HG2  ILE  92          2HG2      ILE  92  -2.171  -7.771  -2.541
  711   3HG2  ILE  92          3HG2      ILE  92  -0.535  -8.357  -2.237
  712   1HD1  ILE  92          1HD1      ILE  92  -2.206 -10.214  -5.719
  713   2HD1  ILE  92          2HD1      ILE  92  -3.866  -9.628  -5.811
  714   3HD1  ILE  92          3HD1      ILE  92  -2.571  -8.536  -5.320
  715    H    GLY  93           H        GLY  93   1.319  -9.472  -3.968
  716   1HA   GLY  93          1HA       GLY  93   2.844 -10.518  -1.730
  717   2HA   GLY  93          2HA       GLY  93   3.407  -9.362  -2.932
  718    H    LEU  94           H        LEU  94   1.556  -9.747   0.029
  719    HA   LEU  94           HA       LEU  94   1.340  -6.867   0.371
  720   1HB   LEU  94          1HB       LEU  94  -0.549  -8.308   1.003
  721   2HB   LEU  94          2HB       LEU  94   0.468  -9.134   2.167
  722    HG   LEU  94           HG       LEU  94   0.693  -7.028   3.444
  723   1HD1  LEU  94          1HD1      LEU  94   0.378  -5.443   1.624
  724   2HD1  LEU  94          2HD1      LEU  94  -1.300  -5.958   1.451
  725   3HD1  LEU  94          3HD1      LEU  94  -0.775  -5.143   2.925
  726   1HD2  LEU  94          1HD2      LEU  94  -2.151  -7.881   2.912
  727   2HD2  LEU  94          2HD2      LEU  94  -1.030  -8.653   4.034
  728   3HD2  LEU  94          3HD2      LEU  94  -1.582  -7.005   4.332
  729    H    GLU  95           H        GLU  95   3.139  -5.889   0.954
  730    HA   GLU  95           HA       GLU  95   4.913  -7.192   2.910
  731   1HB   GLU  95          1HB       GLU  95   5.392  -5.936   0.416
  732   2HB   GLU  95          2HB       GLU  95   6.089  -4.899   1.652
  733   1HG   GLU  95          1HG       GLU  95   7.654  -6.563   0.700
  734   2HG   GLU  95          2HG       GLU  95   7.477  -6.653   2.452
  735    H    ALA  96           H        ALA  96   4.393  -6.483   4.899
  736    HA   ALA  96           HA       ALA  96   3.548  -3.717   5.280
  737   1HB   ALA  96          1HB       ALA  96   2.932  -4.400   7.532
  738   2HB   ALA  96          2HB       ALA  96   2.232  -5.496   6.340
  739   3HB   ALA  96          3HB       ALA  96   3.652  -5.988   7.264
  740    H    MET  97           H        MET  97   5.012  -2.233   5.675
  741    HA   MET  97           HA       MET  97   7.187  -2.755   7.544
  742   1HB   MET  97          1HB       MET  97   7.618  -1.814   4.703
  743   2HB   MET  97          2HB       MET  97   8.811  -1.600   5.974
  744   1HG   MET  97          1HG       MET  97   8.937  -4.028   6.253
  745   2HG   MET  97          2HG       MET  97   7.754  -4.233   4.963
  746   1HE   MET  97          1HE       MET  97   9.720  -2.811   1.867
  747   2HE   MET  97          2HE       MET  97   8.631  -1.933   2.941
  748   3HE   MET  97          3HE       MET  97   8.221  -3.562   2.410
  749    H    THR  98           H        THR  98   8.545  -0.425   7.401
  750    HA   THR  98           HA       THR  98   6.683   1.548   8.311
  751    HB   THR  98           HB       THR  98   8.813   3.006   8.294
  752    HG1  THR  98           HG1      THR  98  10.600   2.103   7.581
  753   1HG2  THR  98          1HG2      THR  98   7.901   1.986  10.319
  754   2HG2  THR  98          2HG2      THR  98   8.737   0.479   9.947
  755   3HG2  THR  98          3HG2      THR  98   9.664   1.930  10.331
  756    H    ASN  99           H        ASN  99   6.227   3.568   7.318
  757    HA   ASN  99           HA       ASN  99   5.755   3.301   4.550
  758   1HB   ASN  99          1HB       ASN  99   4.996   5.701   4.666
  759   2HB   ASN  99          2HB       ASN  99   4.192   4.595   5.767
  760   1HD2  ASN  99          2HD2      ASN  99   3.541   6.248   7.096
  761   2HD2  ASN  99          1HD2      ASN  99   4.632   7.090   8.141
  762    H    ALA 100           H        ALA 100   8.358   4.806   6.312
  763    HA   ALA 100           HA       ALA 100   9.421   6.332   4.186
  764   1HB   ALA 100          1HB       ALA 100  11.470   6.408   5.495
  765   2HB   ALA 100          2HB       ALA 100  10.062   6.678   6.522
  766   3HB   ALA 100          3HB       ALA 100  10.872   5.111   6.531
  767    H    ALA 101           H        ALA 101   9.978   2.999   5.243
  768    HA   ALA 101           HA       ALA 101  11.989   2.488   3.259
  769   1HB   ALA 101          1HB       ALA 101  10.420   0.560   4.969
  770   2HB   ALA 101          2HB       ALA 101  11.841   0.162   4.003
  771   3HB   ALA 101          3HB       ALA 101  11.986   1.267   5.371
  772    H    ALA 102           H        ALA 102   8.526   2.025   3.551
  773    HA   ALA 102           HA       ALA 102   8.133   0.364   1.314
  774   1HB   ALA 102          1HB       ALA 102   6.248   2.410   2.484
  775   2HB   ALA 102          2HB       ALA 102   5.806   1.089   1.403
  776   3HB   ALA 102          3HB       ALA 102   6.417   0.739   3.020
  777    H    ALA 103           H        ALA 103   8.294   3.872   1.651
  778    HA   ALA 103           HA       ALA 103   7.505   4.609  -0.926
  779   1HB   ALA 103          1HB       ALA 103   7.746   6.185   0.936
  780   2HB   ALA 103          2HB       ALA 103   9.498   5.994   0.864
  781   3HB   ALA 103          3HB       ALA 103   8.633   6.720  -0.491
  782    H    ARG 104           H        ARG 104  10.702   3.779   0.337
  783    HA   ARG 104           HA       ARG 104  12.117   4.365  -2.052
  784   1HB   ARG 104          1HB       ARG 104  13.221   4.264   0.131
  785   2HB   ARG 104          2HB       ARG 104  12.851   2.550   0.252
  786   1HG   ARG 104          1HG       ARG 104  14.252   2.123  -1.715
  787   2HG   ARG 104          2HG       ARG 104  14.650   3.840  -1.784
  788   1HD   ARG 104          1HD       ARG 104  15.649   3.704   0.438
  789   2HD   ARG 104          2HD       ARG 104  15.231   1.995   0.527
  790    HE   ARG 104           HE       ARG 104  16.710   2.084  -1.710
  791   1HH1  ARG 104          1HH1      ARG 104  17.241   3.367   1.513
  792   2HH1  ARG 104          2HH1      ARG 104  18.976   3.241   1.412
  793   1HH2  ARG 104          1HH2      ARG 104  18.979   1.897  -1.837
  794   2HH2  ARG 104          2HH2      ARG 104  19.967   2.408  -0.499
  795    H    THR 105           H        THR 105  10.914   1.350  -0.639
  796    HA   THR 105           HA       THR 105  11.867  -0.378  -2.639
  797    HB   THR 105           HB       THR 105   9.411  -0.800  -0.924
  798    HG1  THR 105           HG1      THR 105  11.017  -0.358   0.520
  799   1HG2  THR 105          1HG2      THR 105  10.014  -3.171  -1.104
  800   2HG2  THR 105          2HG2      THR 105   9.723  -2.466  -2.695
  801   3HG2  THR 105          3HG2      THR 105  11.375  -2.749  -2.144
  802    H    TYR 106           H        TYR 106   9.001   1.606  -2.415
  803    HA   TYR 106           HA       TYR 106   7.425   0.472  -4.417
  804   1HB   TYR 106          1HB       TYR 106   6.501   2.157  -2.977
  805   2HB   TYR 106          2HB       TYR 106   7.699   3.339  -3.496
  806    HD1  TYR 106           HD1      TYR 106   7.239   4.779  -5.274
  807    HD2  TYR 106           HD2      TYR 106   4.831   1.312  -4.740
  808    HE1  TYR 106           HE1      TYR 106   5.711   5.578  -7.023
  809    HE2  TYR 106           HE2      TYR 106   3.294   2.106  -6.488
  810    HH   TYR 106           HH       TYR 106   4.070   4.668  -8.580
  811    H    ASN 107           H        ASN 107  10.031   2.856  -4.628
  812    HA   ASN 107           HA       ASN 107   9.707   3.458  -7.363
  813   1HB   ASN 107          1HB       ASN 107  11.021   4.863  -5.818
  814   2HB   ASN 107          2HB       ASN 107  12.228   3.587  -5.693
  815   1HD2  ASN 107          2HD2      ASN 107  10.863   6.051  -7.720
  816   2HD2  ASN 107          1HD2      ASN 107  12.111   6.055  -8.916
  817    H    VAL 108           H        VAL 108  11.572   1.006  -5.675
  818    HA   VAL 108           HA       VAL 108  13.030   0.014  -7.867
  819    HB   VAL 108           HB       VAL 108  12.085  -1.502  -5.426
  820   1HG1  VAL 108          1HG1      VAL 108  14.339  -2.070  -7.347
  821   2HG1  VAL 108          2HG1      VAL 108  14.025  -2.951  -5.851
  822   3HG1  VAL 108          3HG1      VAL 108  12.853  -3.004  -7.168
  823   1HG2  VAL 108          1HG2      VAL 108  13.313   0.497  -4.800
  824   2HG2  VAL 108          2HG2      VAL 108  14.275  -0.945  -4.477
  825   3HG2  VAL 108          3HG2      VAL 108  14.626   0.051  -5.890
  826    H    LEU 109           H        LEU 109   9.899  -0.940  -6.499
  827    HA   LEU 109           HA       LEU 109   9.473  -3.070  -8.339
  828   1HB   LEU 109          1HB       LEU 109   7.487  -1.540  -6.656
  829   2HB   LEU 109          2HB       LEU 109   7.165  -3.055  -7.478
  830    HG   LEU 109           HG       LEU 109   9.165  -2.669  -5.247
  831   1HD1  LEU 109          1HD1      LEU 109   6.873  -2.501  -4.454
  832   2HD1  LEU 109          2HD1      LEU 109   6.470  -4.017  -5.263
  833   3HD1  LEU 109          3HD1      LEU 109   7.613  -4.012  -3.920
  834   1HD2  LEU 109          1HD2      LEU 109   9.337  -5.109  -5.276
  835   2HD2  LEU 109          2HD2      LEU 109   8.272  -5.168  -6.679
  836   3HD2  LEU 109          3HD2      LEU 109   9.857  -4.405  -6.807
  837    H    ALA 110           H        ALA 110   8.764   0.345  -8.345
  838    HA   ALA 110           HA       ALA 110   6.970   0.272 -10.571
  839   1HB   ALA 110          1HB       ALA 110   6.902   2.084  -8.936
  840   2HB   ALA 110          2HB       ALA 110   8.519   2.591  -9.425
  841   3HB   ALA 110          3HB       ALA 110   7.177   2.702 -10.564
  842    H    SER 111           H        SER 111  10.371   0.128 -10.247
  843    HA   SER 111           HA       SER 111  11.164   1.363 -12.654
  844   1HB   SER 111          1HB       SER 111  12.515  -0.888 -11.144
  845   2HB   SER 111          2HB       SER 111  13.270   0.124 -12.375
  846    HG   SER 111           HG       SER 111  12.050   1.379 -10.183
  847    H    GLU 112           H        GLU 112  10.509  -2.060 -11.887
  848    HA   GLU 112           HA       GLU 112  10.807  -2.898 -14.605
  849   1HB   GLU 112          1HB       GLU 112  11.191  -4.461 -12.755
  850   2HB   GLU 112          2HB       GLU 112   9.509  -4.312 -12.264
  851   1HG   GLU 112          1HG       GLU 112   8.754  -5.400 -14.242
  852   2HG   GLU 112          2HG       GLU 112  10.364  -5.347 -14.953
  853    H    GLY 113           H        GLY 113   8.220  -1.670 -12.664
  854   1HA   GLY 113          1HA       GLY 113   6.322  -0.617 -13.515
  855   2HA   GLY 113          2HA       GLY 113   6.645  -1.350 -15.079
  856    H    ARG 114           H        ARG 114   6.297  -2.929 -11.935
  857    HA   ARG 114           HA       ARG 114   4.174  -4.583 -13.052
  858   1HB   ARG 114          1HB       ARG 114   5.577  -4.728 -10.377
  859   2HB   ARG 114          2HB       ARG 114   4.376  -5.875 -10.952
  860   1HG   ARG 114          1HG       ARG 114   5.898  -6.390 -12.864
  861   2HG   ARG 114          2HG       ARG 114   7.120  -5.385 -12.081
  862   1HD   ARG 114          1HD       ARG 114   7.497  -7.706 -11.525
  863   2HD   ARG 114          2HD       ARG 114   6.985  -6.826 -10.085
  864    HE   ARG 114           HE       ARG 114   4.680  -7.872 -11.187
  865   1HH1  ARG 114          1HH1      ARG 114   7.702  -9.151  -9.941
  866   2HH1  ARG 114          2HH1      ARG 114   6.997 -10.661  -9.429
  867   1HH2  ARG 114          1HH2      ARG 114   3.755  -9.855 -10.526
  868   2HH2  ARG 114          2HH2      ARG 114   4.749 -11.061  -9.764
  869    H    ARG 115           H        ARG 115   2.253  -5.015 -11.593
  870    HA   ARG 115           HA       ARG 115   1.057  -2.507 -10.913
  871   1HB   ARG 115          1HB       ARG 115   0.090  -5.352 -10.655
  872   2HB   ARG 115          2HB       ARG 115  -0.870  -3.970 -10.143
  873   1HG   ARG 115          1HG       ARG 115  -0.786  -3.086 -12.434
  874   2HG   ARG 115          2HG       ARG 115   0.127  -4.512 -12.933
  875   1HD   ARG 115          1HD       ARG 115  -1.712  -5.951 -12.398
  876   2HD   ARG 115          2HD       ARG 115  -2.609  -4.616 -11.677
  877    HE   ARG 115           HE       ARG 115  -2.246  -3.761 -14.196
  878   1HH1  ARG 115          1HH1      ARG 115  -3.420  -6.799 -12.904
  879   2HH1  ARG 115          2HH1      ARG 115  -4.474  -7.106 -14.255
  880   1HH2  ARG 115          1HH2      ARG 115  -3.625  -4.148 -15.959
  881   2HH2  ARG 115          2HH2      ARG 115  -4.579  -5.604 -16.003
  882    H    VAL 116           H        VAL 116   2.396  -1.710  -9.295
  883    HA   VAL 116           HA       VAL 116   2.272  -3.102  -6.716
  884    HB   VAL 116           HB       VAL 116   4.533  -2.567  -7.393
  885   1HG1  VAL 116          1HG1      VAL 116   3.636   0.306  -7.555
  886   2HG1  VAL 116          2HG1      VAL 116   5.294  -0.267  -7.722
  887   3HG1  VAL 116          3HG1      VAL 116   4.079  -0.723  -8.916
  888   1HG2  VAL 116          1HG2      VAL 116   5.266  -1.241  -5.470
  889   2HG2  VAL 116          2HG2      VAL 116   3.602  -0.724  -5.197
  890   3HG2  VAL 116          3HG2      VAL 116   4.038  -2.423  -5.018
  891    H    ALA 117           H        ALA 117   1.185  -2.278  -5.048
  892    HA   ALA 117           HA       ALA 117  -0.033   0.382  -5.392
  893   1HB   ALA 117          1HB       ALA 117  -1.844  -0.380  -3.951
  894   2HB   ALA 117          2HB       ALA 117  -1.668  -1.449  -5.343
  895   3HB   ALA 117          3HB       ALA 117  -1.055  -1.948  -3.765
  896    H    LEU 118           H        LEU 118   0.944   1.864  -4.190
  897    HA   LEU 118           HA       LEU 118   2.379   1.097  -1.782
  898   1HB   LEU 118          1HB       LEU 118   3.285   2.746  -3.450
  899   2HB   LEU 118          2HB       LEU 118   2.005   3.846  -2.979
  900    HG   LEU 118           HG       LEU 118   2.916   3.870  -0.671
  901   1HD1  LEU 118          1HD1      LEU 118   5.161   2.274  -1.894
  902   2HD1  LEU 118          2HD1      LEU 118   5.144   2.958  -0.268
  903   3HD1  LEU 118          3HD1      LEU 118   4.000   1.688  -0.704
  904   1HD2  LEU 118          1HD2      LEU 118   4.901   4.630  -2.819
  905   2HD2  LEU 118          2HD2      LEU 118   3.532   5.609  -2.292
  906   3HD2  LEU 118          3HD2      LEU 118   4.854   5.268  -1.174
  907    H    ALA 119           H        ALA 119   0.793   0.524  -0.336
  908    HA   ALA 119           HA       ALA 119  -1.433   2.312   0.182
  909   1HB   ALA 119          1HB       ALA 119  -2.179   0.597   1.753
  910   2HB   ALA 119          2HB       ALA 119  -1.814  -0.104   0.177
  911   3HB   ALA 119          3HB       ALA 119  -0.675  -0.290   1.511
  912    H    MET 120           H        MET 120  -0.929   4.089   1.274
  913    HA   MET 120           HA       MET 120   1.074   3.893   3.399
  914   1HB   MET 120          1HB       MET 120   0.086   6.196   1.747
  915   2HB   MET 120          2HB       MET 120   1.002   6.447   3.225
  916   1HG   MET 120          1HG       MET 120   1.942   4.893   0.828
  917   2HG   MET 120          2HG       MET 120   2.414   6.542   1.238
  918   1HE   MET 120          1HE       MET 120   4.985   6.086   1.260
  919   2HE   MET 120          2HE       MET 120   4.630   4.463   0.666
  920   3HE   MET 120          3HE       MET 120   5.723   4.682   2.033
  921    H    ILE 121           H        ILE 121   0.252   3.528   5.301
  922    HA   ILE 121           HA       ILE 121  -2.010   5.171   6.212
  923    HB   ILE 121           HB       ILE 121  -0.727   2.800   7.601
  924   1HG1  ILE 121          1HG1      ILE 121  -3.374   2.983   6.140
  925   2HG1  ILE 121          2HG1      ILE 121  -1.940   2.157   5.539
  926   1HG2  ILE 121          1HG2      ILE 121  -3.222   4.368   8.251
  927   2HG2  ILE 121          2HG2      ILE 121  -2.674   2.921   9.095
  928   3HG2  ILE 121          3HG2      ILE 121  -1.710   4.396   9.156
  929   1HD1  ILE 121          1HD1      ILE 121  -2.056   0.601   7.421
  930   2HD1  ILE 121          2HD1      ILE 121  -3.501   1.429   8.007
  931   3HD1  ILE 121          3HD1      ILE 121  -3.536   0.584   6.459
  932    H    VAL 122           H        VAL 122  -1.054   7.092   6.633
  933    HA   VAL 122           HA       VAL 122   1.533   7.098   8.025
  934    HB   VAL 122           HB       VAL 122   0.191   9.389   6.578
  935   1HG1  VAL 122          1HG1      VAL 122   1.873  10.077   8.195
  936   2HG1  VAL 122          2HG1      VAL 122   3.044   8.982   7.458
  937   3HG1  VAL 122          3HG1      VAL 122   2.433  10.363   6.548
  938   1HG2  VAL 122          1HG2      VAL 122   2.276   7.471   5.543
  939   2HG2  VAL 122          2HG2      VAL 122   0.596   7.567   5.015
  940   3HG2  VAL 122          3HG2      VAL 122   1.694   8.910   4.707
  941    H    GLY 123           H        GLY 123   1.837   8.246   9.910
  942   1HA   GLY 123          1HA       GLY 123   1.351   9.544  11.745
  943   2HA   GLY 123          2HA       GLY 123  -0.073  10.121  10.897
  944    H    GLY 124           H        GLY 124  -2.002   8.871  11.001
  945   1HA   GLY 124          1HA       GLY 124  -2.842   6.708  12.144
  946   2HA   GLY 124          2HA       GLY 124  -2.194   7.484  13.582
  947    H    LEU 125           H        LEU 125  -3.505   8.760  14.707
  948    HA   LEU 125           HA       LEU 125  -5.822   9.939  13.365
  949   1HB   LEU 125          1HB       LEU 125  -7.344   9.275  15.099
  950   2HB   LEU 125          2HB       LEU 125  -6.569   7.845  14.453
  951    HG   LEU 125           HG       LEU 125  -5.653   9.151  17.013
  952   1HD1  LEU 125          1HD1      LEU 125  -7.998   8.548  17.263
  953   2HD1  LEU 125          2HD1      LEU 125  -7.660   6.928  16.656
  954   3HD1  LEU 125          3HD1      LEU 125  -6.973   7.455  18.191
  955   1HD2  LEU 125          1HD2      LEU 125  -4.702   6.940  17.455
  956   2HD2  LEU 125          2HD2      LEU 125  -5.300   6.370  15.896
  957   3HD2  LEU 125          3HD2      LEU 125  -4.062   7.625  15.960
  958    H    GLU 126           H        GLU 126  -6.623  11.819  14.332
  959    HA   GLU 126           HA       GLU 126  -5.033  12.965  16.513
  960   1HB   GLU 126          1HB       GLU 126  -4.393  13.682  14.054
  961   2HB   GLU 126          2HB       GLU 126  -5.845  14.662  14.167
  962   1HG   GLU 126          1HG       GLU 126  -3.619  14.826  16.175
  963   2HG   GLU 126          2HG       GLU 126  -3.650  15.792  14.703
  964    H    HIS 127           H        HIS 127  -6.200  14.487  17.764
  965    HA   HIS 127           HA       HIS 127  -8.011  15.393  18.785
  966   1HB   HIS 127          1HB       HIS 127  -8.960  15.193  16.005
  967   2HB   HIS 127          2HB       HIS 127 -10.233  15.214  17.218
  968    HD1  HIS 127           HD1      HIS 127  -7.371  17.324  15.922
  969    HD2  HIS 127           HD2      HIS 127 -10.728  17.653  18.364
  970    HE1  HIS 127           HE1      HIS 127  -7.678  19.786  16.336
  971    HE2  HIS 127           HE2      HIS 127  -9.764  19.974  17.740
  972    H    HIS 128           H        HIS 128  -8.565  14.144  20.440
  973    HA   HIS 128           HA       HIS 128  -9.762  11.581  20.151
  974   1HB   HIS 128          1HB       HIS 128 -10.252  11.734  22.583
  975   2HB   HIS 128          2HB       HIS 128  -8.570  12.071  22.204
  976    HD1  HIS 128           HD1      HIS 128 -11.553  13.491  23.819
  977    HD2  HIS 128           HD2      HIS 128  -7.849  14.848  22.502
  978    HE1  HIS 128           HE1      HIS 128 -11.207  15.717  24.941
  979    HE2  HIS 128           HE2      HIS 128  -8.865  16.402  24.310
  980    H    HIS 129           H        HIS 129 -11.536  11.573  18.922
  981    HA   HIS 129           HA       HIS 129 -13.904  13.006  19.832
  982   1HB   HIS 129          1HB       HIS 129 -12.579  14.513  18.273
  983   2HB   HIS 129          2HB       HIS 129 -12.863  13.330  17.006
  984    HD1  HIS 129           HD1      HIS 129 -14.257  16.304  18.521
  985    HD2  HIS 129           HD2      HIS 129 -15.725  13.059  16.371
  986    HE1  HIS 129           HE1      HIS 129 -16.505  17.021  17.657
  987    HE2  HIS 129           HE2      HIS 129 -17.232  15.148  16.133
  988    H    HIS 130           H        HIS 130 -15.786  11.991  19.254
  989    HA   HIS 130           HA       HIS 130 -17.258  10.558  18.291
  990   1HB   HIS 130          1HB       HIS 130 -16.059  11.144  16.150
  991   2HB   HIS 130          2HB       HIS 130 -15.090   9.694  16.376
  992    HD1  HIS 130           HD1      HIS 130 -18.270  10.887  15.041
  993    HD2  HIS 130           HD2      HIS 130 -16.660   7.237  16.224
  994    HE1  HIS 130           HE1      HIS 130 -19.788   9.129  14.072
  995    HE2  HIS 130           HE2      HIS 130 -18.745   6.926  14.713
  996    H    HIS 131           H        HIS 131 -14.046   9.273  18.910
  997    HA   HIS 131           HA       HIS 131 -13.302   7.347  19.876
  998   1HB   HIS 131          1HB       HIS 131 -16.197   6.772  20.582
  999   2HB   HIS 131          2HB       HIS 131 -14.783   5.985  21.264
 1000    HD1  HIS 131           HD1      HIS 131 -16.924   7.443  22.995
 1001    HD2  HIS 131           HD2      HIS 131 -13.333   9.123  21.723
 1002    HE1  HIS 131           HE1      HIS 131 -16.434   9.308  24.613
 1003    HE2  HIS 131           HE2      HIS 131 -14.164  10.173  23.937
 1004    H    HIS 132           H        HIS 132 -14.048   4.759  19.805
 1005    HA   HIS 132           HA       HIS 132 -15.640   4.048  17.587
 1006   1HB   HIS 132          1HB       HIS 132 -13.964   3.014  16.130
 1007   2HB   HIS 132          2HB       HIS 132 -13.703   4.744  16.264
 1008    HD1  HIS 132           HD1      HIS 132 -11.676   5.394  18.018
 1009    HD2  HIS 132           HD2      HIS 132 -11.743   1.530  16.498
 1010    HE1  HIS 132           HE1      HIS 132  -9.353   4.494  18.364
 1011    HE2  HIS 132           HE2      HIS 132  -9.451   2.111  17.543
  Start of MODEL   13
    1   1H    MET   1          1HT       MET   1  10.139   7.964 -26.930
    2   2H    MET   1          2HT       MET   1  10.036   6.701 -28.056
    3   3H    MET   1          3HT       MET   1  10.750   6.433 -26.543
    4    HA   MET   1           HA       MET   1   8.521   5.500 -26.665
    5   1HB   MET   1          1HB       MET   1   8.702   7.905 -24.832
    6   2HB   MET   1          2HB       MET   1   7.646   6.517 -24.613
    7   1HG   MET   1          1HG       MET   1  10.651   6.537 -24.486
    8   2HG   MET   1          2HG       MET   1   9.531   6.345 -23.138
    9   1HE   MET   1          1HE       MET   1  11.268   2.826 -23.501
   10   2HE   MET   1          2HE       MET   1  10.988   4.206 -22.437
   11   3HE   MET   1          3HE       MET   1  12.012   4.384 -23.863
   12    HA   PRO   2           HA       PRO   2   5.726   7.768 -29.207
   13   1HB   PRO   2          1HB       PRO   2   3.553   6.136 -28.125
   14   2HB   PRO   2          2HB       PRO   2   4.226   6.159 -29.756
   15   1HG   PRO   2          1HG       PRO   2   4.585   4.080 -28.066
   16   2HG   PRO   2          2HG       PRO   2   5.794   4.549 -29.275
   17   1HD   PRO   2          1HD       PRO   2   5.735   5.111 -26.334
   18   2HD   PRO   2          2HD       PRO   2   7.107   4.654 -27.367
   19    H    LEU   3           H        LEU   3   5.522   9.803 -28.359
   20    HA   LEU   3           HA       LEU   3   3.726  10.227 -26.096
   21   1HB   LEU   3          1HB       LEU   3   5.845  11.481 -26.196
   22   2HB   LEU   3          2HB       LEU   3   5.350  12.192 -27.720
   23    HG   LEU   3           HG       LEU   3   3.459  13.298 -26.558
   24   1HD1  LEU   3          1HD1      LEU   3   3.450  13.379 -24.118
   25   2HD1  LEU   3          2HD1      LEU   3   3.206  11.733 -24.707
   26   3HD1  LEU   3          3HD1      LEU   3   4.779  12.220 -24.071
   27   1HD2  LEU   3          1HD2      LEU   3   6.181  13.878 -25.395
   28   2HD2  LEU   3          2HD2      LEU   3   5.570  14.473 -26.939
   29   3HD2  LEU   3          3HD2      LEU   3   4.808  14.986 -25.433
   30    H    ASN   4           H        ASN   4   1.608  10.285 -26.555
   31    HA   ASN   4           HA       ASN   4   0.808  11.395 -29.168
   32   1HB   ASN   4          1HB       ASN   4  -0.553   9.258 -27.516
   33   2HB   ASN   4          2HB       ASN   4  -1.221   9.959 -28.983
   34   1HD2  ASN   4          2HD2      ASN   4   1.266  10.111 -30.411
   35   2HD2  ASN   4          1HD2      ASN   4   1.712   8.482 -30.815
   36    H    GLN   5           H        GLN   5  -1.110  10.614 -26.293
   37    HA   GLN   5           HA       GLN   5  -2.342  13.248 -26.496
   38   1HB   GLN   5          1HB       GLN   5  -3.084  10.702 -25.095
   39   2HB   GLN   5          2HB       GLN   5  -3.821  12.220 -24.610
   40   1HG   GLN   5          1HG       GLN   5  -5.227  10.990 -26.171
   41   2HG   GLN   5          2HG       GLN   5  -4.714  12.536 -26.839
   42   1HE2  GLN   5          2HE2      GLN   5  -3.395  12.579 -28.619
   43   2HE2  GLN   5          1HE2      GLN   5  -3.030  11.168 -29.559
   44    H    GLU   6           H        GLU   6  -1.804  11.367 -23.556
   45    HA   GLU   6           HA       GLU   6  -1.104  11.983 -21.488
   46   1HB   GLU   6          1HB       GLU   6   0.970  13.143 -23.309
   47   2HB   GLU   6          2HB       GLU   6   1.051  13.493 -21.588
   48   1HG   GLU   6          1HG       GLU   6   2.446  11.570 -22.335
   49   2HG   GLU   6          2HG       GLU   6   1.311  11.199 -21.043
   50    H    HIS   7           H        HIS   7  -3.244  13.221 -21.742
   51    HA   HIS   7           HA       HIS   7  -3.125  16.054 -22.049
   52   1HB   HIS   7          1HB       HIS   7  -5.112  14.614 -22.593
   53   2HB   HIS   7          2HB       HIS   7  -5.382  14.434 -20.863
   54    HD1  HIS   7           HD1      HIS   7  -6.574  16.326 -19.667
   55    HD2  HIS   7           HD2      HIS   7  -5.553  17.251 -23.593
   56    HE1  HIS   7           HE1      HIS   7  -7.747  18.491 -20.184
   57    HE2  HIS   7           HE2      HIS   7  -7.254  18.938 -22.618
   58    HA   PRO   8           HA       PRO   8  -3.730  16.147 -17.224
   59   1HB   PRO   8          1HB       PRO   8  -2.690  13.532 -16.357
   60   2HB   PRO   8          2HB       PRO   8  -4.149  14.385 -15.845
   61   1HG   PRO   8          1HG       PRO   8  -4.273  12.188 -17.379
   62   2HG   PRO   8          2HG       PRO   8  -5.418  13.528 -17.574
   63   1HD   PRO   8          1HD       PRO   8  -2.998  12.850 -19.205
   64   2HD   PRO   8          2HD       PRO   8  -4.604  13.387 -19.744
   65    H    ASP   9           H        ASP   9  -2.081  17.534 -16.989
   66    HA   ASP   9           HA       ASP   9   0.655  16.591 -17.366
   67   1HB   ASP   9          1HB       ASP   9   1.275  18.955 -17.416
   68   2HB   ASP   9          2HB       ASP   9  -0.033  18.636 -18.547
   69    H    TYR  10           H        TYR  10  -1.525  17.386 -14.857
   70    HA   TYR  10           HA       TYR  10   0.537  18.000 -12.923
   71   1HB   TYR  10          1HB       TYR  10  -2.420  17.512 -12.503
   72   2HB   TYR  10          2HB       TYR  10  -1.300  18.162 -11.309
   73    HD1  TYR  10           HD1      TYR  10  -3.729  19.020 -13.659
   74    HD2  TYR  10           HD2      TYR  10   0.051  20.297 -12.185
   75    HE1  TYR  10           HE1      TYR  10  -4.175  21.288 -14.497
   76    HE2  TYR  10           HE2      TYR  10  -0.386  22.567 -13.014
   77    HH   TYR  10           HH       TYR  10  -1.800  23.593 -14.857
   78    H    THR  11           H        THR  11   1.833  16.286 -12.597
   79    HA   THR  11           HA       THR  11   0.622  13.662 -12.116
   80    HB   THR  11           HB       THR  11   3.548  14.316 -12.518
   81    HG1  THR  11           HG1      THR  11   1.635  14.498 -14.295
   82   1HG2  THR  11          1HG2      THR  11   2.025  11.714 -12.732
   83   2HG2  THR  11          2HG2      THR  11   3.745  11.933 -13.048
   84   3HG2  THR  11          3HG2      THR  11   3.113  12.164 -11.418
   85    H    TYR  12           H        TYR  12   0.548  12.809 -10.132
   86    HA   TYR  12           HA       TYR  12   1.738  14.136  -7.873
   87   1HB   TYR  12          1HB       TYR  12   0.389  11.425  -8.032
   88   2HB   TYR  12          2HB       TYR  12   0.779  12.296  -6.556
   89    HD1  TYR  12           HD1      TYR  12  -1.675  11.712  -9.069
   90    HD2  TYR  12           HD2      TYR  12  -0.377  14.570  -6.197
   91    HE1  TYR  12           HE1      TYR  12  -3.895  12.764  -9.123
   92    HE2  TYR  12           HE2      TYR  12  -2.596  15.630  -6.242
   93    HH   TYR  12           HH       TYR  12  -5.306  14.153  -7.677
   94    H    ALA  13           H        ALA  13   3.610  13.557  -6.811
   95    HA   ALA  13           HA       ALA  13   4.966  11.101  -7.627
   96   1HB   ALA  13          1HB       ALA  13   6.287  13.808  -7.784
   97   2HB   ALA  13          2HB       ALA  13   7.058  12.253  -8.090
   98   3HB   ALA  13          3HB       ALA  13   5.782  12.830  -9.161
   99    H    LEU  14           H        LEU  14   5.919  10.111  -5.955
  100    HA   LEU  14           HA       LEU  14   5.910  11.318  -3.354
  101   1HB   LEU  14          1HB       LEU  14   5.522   8.901  -3.690
  102   2HB   LEU  14          2HB       LEU  14   7.160   8.729  -4.288
  103    HG   LEU  14           HG       LEU  14   8.014   9.429  -2.065
  104   1HD1  LEU  14          1HD1      LEU  14   5.111   9.292  -1.268
  105   2HD1  LEU  14          2HD1      LEU  14   6.475   9.468  -0.163
  106   3HD1  LEU  14          3HD1      LEU  14   6.108  10.745  -1.324
  107   1HD2  LEU  14          1HD2      LEU  14   7.783   7.064  -2.639
  108   2HD2  LEU  14          2HD2      LEU  14   7.483   7.343  -0.923
  109   3HD2  LEU  14          3HD2      LEU  14   6.130   7.075  -2.022
  110    H    ARG  15           H        ARG  15   7.271  12.997  -3.178
  111    HA   ARG  15           HA       ARG  15   9.911  12.877  -4.377
  112   1HB   ARG  15          1HB       ARG  15  10.082  15.239  -3.670
  113   2HB   ARG  15          2HB       ARG  15   8.650  14.929  -4.641
  114   1HG   ARG  15          1HG       ARG  15   7.367  14.750  -2.482
  115   2HG   ARG  15          2HG       ARG  15   8.811  15.359  -1.671
  116   1HD   ARG  15          1HD       ARG  15   7.352  16.770  -3.898
  117   2HD   ARG  15          2HD       ARG  15   7.147  17.117  -2.183
  118    HE   ARG  15           HE       ARG  15   9.878  17.317  -2.848
  119   1HH1  ARG  15          1HH1      ARG  15   6.844  18.934  -3.510
  120   2HH1  ARG  15          2HH1      ARG  15   7.543  20.519  -3.587
  121   1HH2  ARG  15          1HH2      ARG  15  10.824  19.404  -2.969
  122   2HH2  ARG  15          2HH2      ARG  15   9.819  20.784  -3.302
  123    H    ALA  16           H        ALA  16   8.429  12.762  -1.218
  124    HA   ALA  16           HA       ALA  16  10.770  11.652  -0.037
  125   1HB   ALA  16          1HB       ALA  16   9.989  14.431   0.847
  126   2HB   ALA  16          2HB       ALA  16  11.193  13.401   1.621
  127   3HB   ALA  16          3HB       ALA  16  11.464  13.996  -0.016
  128    H    ALA  17           H        ALA  17  10.059  10.245   1.406
  129    HA   ALA  17           HA       ALA  17   7.470  10.756   2.722
  130   1HB   ALA  17          1HB       ALA  17   8.843   8.119   2.191
  131   2HB   ALA  17          2HB       ALA  17   7.284   8.331   2.986
  132   3HB   ALA  17          3HB       ALA  17   7.476   8.771   1.289
  133    H    ASP  18           H        ASP  18   7.489  11.049   4.861
  134    HA   ASP  18           HA       ASP  18   9.970  10.406   6.314
  135   1HB   ASP  18          1HB       ASP  18   9.229  12.881   6.017
  136   2HB   ASP  18          2HB       ASP  18   7.992  12.495   7.207
  137    H    GLY  19           H        GLY  19   9.476  10.141   8.761
  138   1HA   GLY  19          1HA       GLY  19   8.064   7.718   8.892
  139   2HA   GLY  19          2HA       GLY  19   8.685   8.609  10.268
  140    H    ARG  20           H        ARG  20   7.031  10.989   9.772
  141    HA   ARG  20           HA       ARG  20   4.510   9.798  10.730
  142   1HB   ARG  20          1HB       ARG  20   5.582  12.489  11.559
  143   2HB   ARG  20          2HB       ARG  20   4.278  11.569  12.301
  144   1HG   ARG  20          1HG       ARG  20   5.939   9.834  12.934
  145   2HG   ARG  20          2HG       ARG  20   7.211  10.887  12.313
  146   1HD   ARG  20          1HD       ARG  20   7.205  11.330  14.594
  147   2HD   ARG  20          2HD       ARG  20   6.245  12.647  13.919
  148    HE   ARG  20           HE       ARG  20   4.321  10.929  14.526
  149   1HH1  ARG  20          1HH1      ARG  20   7.138  11.866  16.387
  150   2HH1  ARG  20          2HH1      ARG  20   6.378  11.565  17.917
  151   1HH2  ARG  20          1HH2      ARG  20   3.330  10.522  16.536
  152   2HH2  ARG  20          2HH2      ARG  20   4.222  10.788  18.009
  153    H    HIS  21           H        HIS  21   5.750  11.437   8.156
  154    HA   HIS  21           HA       HIS  21   3.147  11.989   7.161
  155   1HB   HIS  21          1HB       HIS  21   3.498  14.423   6.682
  156   2HB   HIS  21          2HB       HIS  21   3.235  14.038   8.373
  157    HD1  HIS  21           HD1      HIS  21   6.507  14.066   6.409
  158    HD2  HIS  21           HD2      HIS  21   4.699  15.878   9.679
  159    HE1  HIS  21           HE1      HIS  21   8.246  15.597   7.378
  160    HE2  HIS  21           HE2      HIS  21   7.049  16.855   9.203
  161    H    ALA  22           H        ALA  22   3.081  12.206   4.937
  162    HA   ALA  22           HA       ALA  22   5.689  11.856   3.603
  163   1HB   ALA  22          1HB       ALA  22   4.583  10.416   1.985
  164   2HB   ALA  22          2HB       ALA  22   4.344   9.798   3.619
  165   3HB   ALA  22          3HB       ALA  22   3.038  10.656   2.800
  166    H    LYS  23           H        LYS  23   5.976  12.819   1.582
  167    HA   LYS  23           HA       LYS  23   4.102  15.029   1.054
  168   1HB   LYS  23          1HB       LYS  23   7.114  14.922   0.848
  169   2HB   LYS  23          2HB       LYS  23   6.146  16.236   0.191
  170   1HG   LYS  23          1HG       LYS  23   5.501  16.983   2.295
  171   2HG   LYS  23          2HG       LYS  23   5.900  15.449   3.068
  172   1HD   LYS  23          1HD       LYS  23   7.946  17.299   1.849
  173   2HD   LYS  23          2HD       LYS  23   7.490  17.324   3.554
  174   1HE   LYS  23          1HE       LYS  23   8.130  14.905   3.668
  175   2HE   LYS  23          2HE       LYS  23   8.759  15.055   2.029
  176   1HZ   LYS  23          1HZ       LYS  23   9.679  16.674   4.342
  177   2HZ   LYS  23          2HZ       LYS  23  10.478  15.300   3.753
  178   3HZ   LYS  23          3HZ       LYS  23  10.336  16.685   2.779
  179    H    VAL  24           H        VAL  24   2.960  14.539  -0.673
  180    HA   VAL  24           HA       VAL  24   4.295  13.266  -2.973
  181    HB   VAL  24           HB       VAL  24   1.331  13.428  -2.378
  182   1HG1  VAL  24          1HG1      VAL  24   2.843  11.902  -4.495
  183   2HG1  VAL  24          2HG1      VAL  24   1.110  11.781  -4.186
  184   3HG1  VAL  24          3HG1      VAL  24   1.801  13.301  -4.760
  185   1HG2  VAL  24          1HG2      VAL  24   3.241  11.113  -2.074
  186   2HG2  VAL  24          2HG2      VAL  24   2.448  11.993  -0.767
  187   3HG2  VAL  24          3HG2      VAL  24   1.489  11.026  -1.888
  188    H    ASN  25           H        ASN  25   4.717  14.522  -4.642
  189    HA   ASN  25           HA       ASN  25   4.799  16.276  -6.069
  190   1HB   ASN  25          1HB       ASN  25   2.463  15.699  -6.598
  191   2HB   ASN  25          2HB       ASN  25   1.909  16.719  -5.275
  192   1HD2  ASN  25          2HD2      ASN  25   3.214  16.644  -8.494
  193   2HD2  ASN  25          1HD2      ASN  25   2.965  18.319  -8.847
  194    H    GLU  26           H        GLU  26   2.507  17.813  -3.862
  195    HA   GLU  26           HA       GLU  26   4.616  19.308  -2.552
  196   1HB   GLU  26          1HB       GLU  26   4.034  20.543  -4.690
  197   2HB   GLU  26          2HB       GLU  26   2.420  20.773  -4.034
  198   1HG   GLU  26          1HG       GLU  26   3.885  22.734  -3.763
  199   2HG   GLU  26          2HG       GLU  26   3.272  22.101  -2.237
  200    H    GLN  27           H        GLN  27   2.328  17.369  -2.127
  201    HA   GLN  27           HA       GLN  27   0.746  18.908  -0.177
  202   1HB   GLN  27          1HB       GLN  27   0.029  16.286  -1.505
  203   2HB   GLN  27          2HB       GLN  27  -1.010  17.264  -0.479
  204   1HG   GLN  27          1HG       GLN  27  -1.174  18.966  -2.131
  205   2HG   GLN  27          2HG       GLN  27   0.084  18.215  -3.113
  206   1HE2  GLN  27          2HE2      GLN  27  -3.243  18.109  -2.138
  207   2HE2  GLN  27          1HE2      GLN  27  -3.761  16.940  -3.310
  208    H    ILE  28           H        ILE  28   1.145  18.460   1.904
  209    HA   ILE  28           HA       ILE  28   2.561  16.021   2.635
  210    HB   ILE  28           HB       ILE  28   1.557  18.294   4.368
  211   1HG1  ILE  28          1HG1      ILE  28   4.348  17.607   3.421
  212   2HG1  ILE  28          2HG1      ILE  28   3.364  18.939   2.825
  213   1HG2  ILE  28          1HG2      ILE  28   3.331  15.959   5.074
  214   2HG2  ILE  28          2HG2      ILE  28   2.952  17.317   6.132
  215   3HG2  ILE  28          3HG2      ILE  28   1.675  16.212   5.623
  216   1HD1  ILE  28          1HD1      ILE  28   4.400  18.629   5.635
  217   2HD1  ILE  28          2HD1      ILE  28   5.045  19.710   4.397
  218   3HD1  ILE  28          3HD1      ILE  28   3.421  19.967   5.034
  219    H    LEU  29           H        LEU  29   1.422  14.217   2.881
  220    HA   LEU  29           HA       LEU  29  -1.418  14.480   3.594
  221   1HB   LEU  29          1HB       LEU  29  -0.019  12.236   2.143
  222   2HB   LEU  29          2HB       LEU  29  -1.735  12.312   2.495
  223    HG   LEU  29           HG       LEU  29  -0.224  14.195   0.680
  224   1HD1  LEU  29          1HD1      LEU  29  -1.520  13.140  -1.104
  225   2HD1  LEU  29          2HD1      LEU  29  -0.488  11.973  -0.275
  226   3HD1  LEU  29          3HD1      LEU  29  -2.217  12.019   0.066
  227   1HD2  LEU  29          1HD2      LEU  29  -3.169  14.037   1.317
  228   2HD2  LEU  29          2HD2      LEU  29  -2.065  15.317   1.824
  229   3HD2  LEU  29          3HD2      LEU  29  -2.426  15.089   0.111
  230    H    GLN  30           H        GLN  30  -1.913  13.975   5.584
  231    HA   GLN  30           HA       GLN  30  -0.564  11.682   6.837
  232   1HB   GLN  30          1HB       GLN  30  -1.623  14.221   8.036
  233   2HB   GLN  30          2HB       GLN  30  -1.481  12.763   9.011
  234   1HG   GLN  30          1HG       GLN  30   0.895  12.656   8.549
  235   2HG   GLN  30          2HG       GLN  30   0.772  14.077   7.513
  236   1HE2  GLN  30          2HE2      GLN  30   2.293  13.529  10.001
  237   2HE2  GLN  30          1HE2      GLN  30   1.880  14.839  11.064
  238    H    GLN  31           H        GLN  31  -2.081  10.472   5.579
  239    HA   GLN  31           HA       GLN  31  -4.430   9.780   7.085
  240   1HB   GLN  31          1HB       GLN  31  -5.995  10.059   5.208
  241   2HB   GLN  31          2HB       GLN  31  -5.307  11.606   5.685
  242   1HG   GLN  31          1HG       GLN  31  -3.680  11.385   3.815
  243   2HG   GLN  31          2HG       GLN  31  -4.544   9.937   3.298
  244   1HE2  GLN  31          2HE2      GLN  31  -4.130  12.425   1.879
  245   2HE2  GLN  31          1HE2      GLN  31  -5.701  13.049   1.507
  246    H    SER  32           H        SER  32  -5.631   7.998   5.519
  247    HA   SER  32           HA       SER  32  -3.466   6.226   4.658
  248   1HB   SER  32          1HB       SER  32  -6.394   5.616   5.138
  249   2HB   SER  32          2HB       SER  32  -5.141   4.435   4.758
  250    HG   SER  32           HG       SER  32  -5.785   5.577   7.142
  251    H    PHE  33           H        PHE  33  -2.937   6.628   2.612
  252    HA   PHE  33           HA       PHE  33  -5.101   6.742   0.623
  253   1HB   PHE  33          1HB       PHE  33  -3.809   8.430  -0.645
  254   2HB   PHE  33          2HB       PHE  33  -4.294   9.022   0.939
  255    HD1  PHE  33           HD1      PHE  33  -2.600   9.162   2.763
  256    HD2  PHE  33           HD2      PHE  33  -1.536   8.276  -1.262
  257    HE1  PHE  33           HE1      PHE  33  -0.262   9.743   3.258
  258    HE2  PHE  33           HE2      PHE  33   0.804   8.856  -0.774
  259    HZ   PHE  33           HZ       PHE  33   1.446   9.583   1.491
  260    H    ILE  34           H        ILE  34  -4.493   6.019  -1.511
  261    HA   ILE  34           HA       ILE  34  -2.319   4.035  -1.374
  262    HB   ILE  34           HB       ILE  34  -4.596   4.075  -3.353
  263   1HG1  ILE  34          1HG1      ILE  34  -4.380   2.419  -0.828
  264   2HG1  ILE  34          2HG1      ILE  34  -5.393   3.851  -0.985
  265   1HG2  ILE  34          1HG2      ILE  34  -2.643   2.826  -4.068
  266   2HG2  ILE  34          2HG2      ILE  34  -2.640   1.927  -2.551
  267   3HG2  ILE  34          3HG2      ILE  34  -3.969   1.726  -3.692
  268   1HD1  ILE  34          1HD1      ILE  34  -5.658   1.333  -2.608
  269   2HD1  ILE  34          2HD1      ILE  34  -6.676   1.801  -1.246
  270   3HD1  ILE  34          3HD1      ILE  34  -6.687   2.761  -2.725
  271    H    LEU  35           H        LEU  35  -0.525   4.596  -2.382
  272    HA   LEU  35           HA       LEU  35  -0.697   6.439  -4.667
  273   1HB   LEU  35          1HB       LEU  35   0.684   7.209  -2.802
  274   2HB   LEU  35          2HB       LEU  35   1.639   5.742  -2.887
  275    HG   LEU  35           HG       LEU  35   2.427   6.404  -5.136
  276   1HD1  LEU  35          1HD1      LEU  35   0.922   8.955  -4.575
  277   2HD1  LEU  35          2HD1      LEU  35   2.036   8.690  -5.915
  278   3HD1  LEU  35          3HD1      LEU  35   0.535   7.770  -5.821
  279   1HD2  LEU  35          1HD2      LEU  35   2.866   8.451  -2.967
  280   2HD2  LEU  35          2HD2      LEU  35   3.756   6.943  -3.174
  281   3HD2  LEU  35          3HD2      LEU  35   3.891   8.220  -4.384
  282    H    MET  36           H        MET  36  -0.813   5.336  -6.516
  283    HA   MET  36           HA       MET  36   1.013   3.047  -6.867
  284   1HB   MET  36          1HB       MET  36  -1.725   3.494  -8.076
  285   2HB   MET  36          2HB       MET  36  -0.636   2.194  -8.540
  286   1HG   MET  36          1HG       MET  36  -0.704   1.374  -6.205
  287   2HG   MET  36          2HG       MET  36  -1.911   2.609  -5.850
  288   1HE   MET  36          1HE       MET  36  -1.538   0.565  -9.188
  289   2HE   MET  36          2HE       MET  36  -2.579  -0.821  -8.865
  290   3HE   MET  36          3HE       MET  36  -1.089  -0.605  -7.949
  291    HA   PRO  37           HA       PRO  37   2.697   5.155 -10.412
  292   1HB   PRO  37          1HB       PRO  37   3.124   3.085 -12.132
  293   2HB   PRO  37          2HB       PRO  37   4.145   3.402 -10.726
  294   1HG   PRO  37          1HG       PRO  37   1.921   1.428 -11.046
  295   2HG   PRO  37          2HG       PRO  37   3.499   1.222 -10.263
  296   1HD   PRO  37          1HD       PRO  37   1.227   1.659  -8.864
  297   2HD   PRO  37          2HD       PRO  37   2.809   2.252  -8.321
  298    H    ASP  38           H        ASP  38  -0.311   3.840 -10.335
  299    HA   ASP  38           HA       ASP  38  -1.002   4.507 -13.096
  300   1HB   ASP  38          1HB       ASP  38  -2.607   3.269 -10.847
  301   2HB   ASP  38          2HB       ASP  38  -3.297   3.702 -12.407
  302    H    GLU  39           H        GLU  39  -2.326   5.187  -9.856
  303    HA   GLU  39           HA       GLU  39  -2.378   8.020 -10.386
  304   1HB   GLU  39          1HB       GLU  39  -4.765   8.313 -10.105
  305   2HB   GLU  39          2HB       GLU  39  -4.474   7.225 -11.456
  306   1HG   GLU  39          1HG       GLU  39  -5.028   5.315 -10.096
  307   2HG   GLU  39          2HG       GLU  39  -5.195   6.340  -8.672
  308    H    LEU  40           H        LEU  40  -3.723   9.049  -8.426
  309    HA   LEU  40           HA       LEU  40  -2.742   7.732  -5.988
  310   1HB   LEU  40          1HB       LEU  40  -1.784   9.939  -6.367
  311   2HB   LEU  40          2HB       LEU  40  -3.385  10.635  -6.532
  312    HG   LEU  40           HG       LEU  40  -3.837  10.061  -4.154
  313   1HD1  LEU  40          1HD1      LEU  40  -1.960   9.459  -2.709
  314   2HD1  LEU  40          2HD1      LEU  40  -2.272   8.212  -3.917
  315   3HD1  LEU  40          3HD1      LEU  40  -0.916   9.320  -4.124
  316   1HD2  LEU  40          1HD2      LEU  40  -3.096  12.294  -4.765
  317   2HD2  LEU  40          2HD2      LEU  40  -2.418  11.821  -3.207
  318   3HD2  LEU  40          3HD2      LEU  40  -1.412  11.782  -4.656
  319    H    VAL  41           H        VAL  41  -4.256   6.750  -4.819
  320    HA   VAL  41           HA       VAL  41  -7.054   7.528  -5.142
  321    HB   VAL  41           HB       VAL  41  -5.941   5.254  -3.490
  322   1HG1  VAL  41          1HG1      VAL  41  -8.722   5.787  -4.527
  323   2HG1  VAL  41          2HG1      VAL  41  -8.213   4.359  -3.625
  324   3HG1  VAL  41          3HG1      VAL  41  -8.187   5.944  -2.854
  325   1HG2  VAL  41          1HG2      VAL  41  -5.307   4.957  -5.820
  326   2HG2  VAL  41          2HG2      VAL  41  -6.549   3.791  -5.363
  327   3HG2  VAL  41          3HG2      VAL  41  -6.977   5.209  -6.322
  328    H    GLU  42           H        GLU  42  -7.531   9.262  -3.982
  329    HA   GLU  42           HA       GLU  42  -6.338   9.723  -1.372
  330   1HB   GLU  42          1HB       GLU  42  -8.388  11.363  -2.870
  331   2HB   GLU  42          2HB       GLU  42  -7.410  11.891  -1.506
  332   1HG   GLU  42          1HG       GLU  42  -5.533  12.153  -2.771
  333   2HG   GLU  42          2HG       GLU  42  -6.018  10.928  -3.943
  334    H    HIS  43           H        HIS  43  -9.410   8.882  -2.809
  335    HA   HIS  43           HA       HIS  43 -10.829   9.076  -0.302
  336   1HB   HIS  43          1HB       HIS  43 -12.023   9.689  -2.318
  337   2HB   HIS  43          2HB       HIS  43 -11.704   8.113  -3.033
  338    HD1  HIS  43           HD1      HIS  43 -13.885   6.977  -3.169
  339    HD2  HIS  43           HD2      HIS  43 -13.373   8.906   0.482
  340    HE1  HIS  43           HE1      HIS  43 -15.899   6.363  -1.786
  341    HE2  HIS  43           HE2      HIS  43 -15.652   7.683   0.351
  342    H    TRP  44           H        TRP  44  -9.648   7.611   0.938
  343    HA   TRP  44           HA       TRP  44 -10.672   4.897   0.695
  344   1HB   TRP  44          1HB       TRP  44  -8.348   5.025  -0.365
  345   2HB   TRP  44          2HB       TRP  44  -7.736   5.381   1.244
  346    HD1  TRP  44           HD1      TRP  44 -10.121   2.620  -0.119
  347    HE1  TRP  44           HE1      TRP  44  -9.304   0.353   0.794
  348    HE3  TRP  44           HE3      TRP  44  -6.066   4.238   2.538
  349    HZ2  TRP  44           HZ2      TRP  44  -7.209  -0.614   2.425
  350    HZ3  TRP  44           HZ3      TRP  44  -4.705   2.582   3.741
  351    HH2  TRP  44           HH2      TRP  44  -5.267   0.206   3.686
  352    HA   PRO  45           HA       PRO  45 -11.251   6.963   4.710
  353   1HB   PRO  45          1HB       PRO  45 -13.431   5.008   5.006
  354   2HB   PRO  45          2HB       PRO  45 -13.485   6.772   5.058
  355   1HG   PRO  45          1HG       PRO  45 -14.481   5.404   2.980
  356   2HG   PRO  45          2HG       PRO  45 -13.670   6.968   2.762
  357   1HD   PRO  45          1HD       PRO  45 -12.609   4.200   2.302
  358   2HD   PRO  45          2HD       PRO  45 -12.415   5.661   1.308
  359    H    VAL  46           H        VAL  46  -9.295   6.049   5.528
  360    HA   VAL  46           HA       VAL  46  -9.940   4.068   7.593
  361    HB   VAL  46           HB       VAL  46  -7.299   4.086   6.104
  362   1HG1  VAL  46          1HG1      VAL  46  -8.357   2.231   8.235
  363   2HG1  VAL  46          2HG1      VAL  46  -6.825   2.051   7.382
  364   3HG1  VAL  46          3HG1      VAL  46  -7.086   3.436   8.441
  365   1HG2  VAL  46          1HG2      VAL  46  -9.539   2.066   5.976
  366   2HG2  VAL  46          2HG2      VAL  46  -9.066   3.175   4.688
  367   3HG2  VAL  46          3HG2      VAL  46  -7.959   1.905   5.209
  368    HA   PRO  47           HA       PRO  47  -8.375   8.052   9.346
  369   1HB   PRO  47          1HB       PRO  47  -9.966   7.051  11.635
  370   2HB   PRO  47          2HB       PRO  47  -9.983   8.639  10.860
  371   1HG   PRO  47          1HG       PRO  47 -11.989   6.916  10.502
  372   2HG   PRO  47          2HG       PRO  47 -11.420   7.950   9.177
  373   1HD   PRO  47          1HD       PRO  47 -10.880   5.048   9.685
  374   2HD   PRO  47          2HD       PRO  47 -11.212   5.882   8.151
  375    H    SER  48           H        SER  48  -8.633   4.894  10.943
  376    HA   SER  48           HA       SER  48  -5.880   5.091  11.799
  377   1HB   SER  48          1HB       SER  48  -8.124   4.826  13.818
  378   2HB   SER  48          2HB       SER  48  -6.410   4.621  14.178
  379    HG   SER  48           HG       SER  48  -6.844   6.947  12.873
  380    H    LEU  49           H        LEU  49  -5.280   3.016  13.049
  381    HA   LEU  49           HA       LEU  49  -5.874   0.802  11.414
  382   1HB   LEU  49          1HB       LEU  49  -3.769   1.069  12.683
  383   2HB   LEU  49          2HB       LEU  49  -4.654   0.834  14.177
  384    HG   LEU  49           HG       LEU  49  -5.237  -1.456  13.455
  385   1HD1  LEU  49          1HD1      LEU  49  -4.081  -2.434  11.527
  386   2HD1  LEU  49          2HD1      LEU  49  -5.171  -1.133  11.049
  387   3HD1  LEU  49          3HD1      LEU  49  -3.433  -0.847  11.116
  388   1HD2  LEU  49          1HD2      LEU  49  -3.003  -2.414  13.738
  389   2HD2  LEU  49          2HD2      LEU  49  -2.285  -0.833  13.423
  390   3HD2  LEU  49          3HD2      LEU  49  -3.282  -1.080  14.857
  391    H    GLY  50           H        GLY  50  -7.608  -0.413  11.394
  392   1HA   GLY  50          1HA       GLY  50  -8.995  -1.860  13.019
  393   2HA   GLY  50          2HA       GLY  50  -9.448  -0.293  13.683
  394    H    GLN  51           H        GLN  51  -9.357   0.985  11.057
  395    HA   GLN  51           HA       GLN  51 -11.974   0.234  10.082
  396   1HB   GLN  51          1HB       GLN  51 -10.000   2.356   9.232
  397   2HB   GLN  51          2HB       GLN  51 -11.560   2.117   8.458
  398   1HG   GLN  51          1HG       GLN  51 -11.214   2.730  11.381
  399   2HG   GLN  51          2HG       GLN  51 -11.485   3.952  10.139
  400   1HE2  GLN  51          2HE2      GLN  51 -12.899   1.424  12.030
  401   2HE2  GLN  51          1HE2      GLN  51 -14.539   1.699  11.539
  402    H    LEU  52           H        LEU  52  -8.940  -0.913   9.598
  403    HA   LEU  52           HA       LEU  52  -9.116  -1.316   6.738
  404   1HB   LEU  52          1HB       LEU  52  -6.945  -0.788   7.733
  405   2HB   LEU  52          2HB       LEU  52  -7.044  -2.221   8.738
  406    HG   LEU  52           HG       LEU  52  -6.966  -3.635   6.719
  407   1HD1  LEU  52          1HD1      LEU  52  -6.395  -2.636   4.561
  408   2HD1  LEU  52          2HD1      LEU  52  -7.968  -2.083   5.134
  409   3HD1  LEU  52          3HD1      LEU  52  -6.563  -1.026   5.262
  410   1HD2  LEU  52          1HD2      LEU  52  -4.617  -3.212   6.161
  411   2HD2  LEU  52          2HD2      LEU  52  -4.718  -1.637   6.945
  412   3HD2  LEU  52          3HD2      LEU  52  -4.905  -3.110   7.898
  413    H    GLN  53           H        GLN  53 -10.851  -2.639   6.476
  414    HA   GLN  53           HA       GLN  53 -10.343  -5.453   7.152
  415   1HB   GLN  53          1HB       GLN  53 -13.029  -4.043   7.215
  416   2HB   GLN  53          2HB       GLN  53 -12.828  -5.787   7.294
  417   1HG   GLN  53          1HG       GLN  53 -11.473  -5.455   9.365
  418   2HG   GLN  53          2HG       GLN  53 -11.915  -3.750   9.307
  419   1HE2  GLN  53          2HE2      GLN  53 -14.056  -6.362   8.376
  420   2HE2  GLN  53          1HE2      GLN  53 -15.165  -6.169   9.687
  421    HA   PRO  54           HA       PRO  54 -10.945  -6.611   2.889
  422   1HB   PRO  54          1HB       PRO  54 -13.572  -7.816   3.671
  423   2HB   PRO  54          2HB       PRO  54 -12.280  -8.489   2.668
  424   1HG   PRO  54          1HG       PRO  54 -12.556  -9.265   5.191
  425   2HG   PRO  54          2HG       PRO  54 -10.945  -9.003   4.497
  426   1HD   PRO  54          1HD       PRO  54 -12.469  -7.333   6.430
  427   2HD   PRO  54          2HD       PRO  54 -10.717  -7.559   6.263
  428    H    ALA  55           H        ALA  55 -13.790  -5.266   4.506
  429    HA   ALA  55           HA       ALA  55 -15.288  -4.488   2.296
  430   1HB   ALA  55          1HB       ALA  55 -15.052  -3.047   4.934
  431   2HB   ALA  55          2HB       ALA  55 -16.369  -2.889   3.772
  432   3HB   ALA  55          3HB       ALA  55 -16.108  -4.421   4.606
  433    H    HIS  56           H        HIS  56 -12.355  -3.110   3.554
  434    HA   HIS  56           HA       HIS  56 -12.593  -0.902   1.613
  435   1HB   HIS  56          1HB       HIS  56 -11.042  -1.065   4.199
  436   2HB   HIS  56          2HB       HIS  56 -10.742   0.178   2.991
  437    HD1  HIS  56           HD1      HIS  56 -12.887   1.751   2.449
  438    HD2  HIS  56           HD2      HIS  56 -13.026  -0.474   5.962
  439    HE1  HIS  56           HE1      HIS  56 -14.647   2.842   3.877
  440    HE2  HIS  56           HE2      HIS  56 -14.541   1.623   6.082
  441    H    MET  57           H        MET  57 -10.827  -3.702   2.542
  442    HA   MET  57           HA       MET  57  -8.398  -2.998   1.163
  443   1HB   MET  57          1HB       MET  57  -8.376  -4.429   3.172
  444   2HB   MET  57          2HB       MET  57  -9.293  -5.653   2.304
  445   1HG   MET  57          1HG       MET  57  -6.959  -6.255   2.392
  446   2HG   MET  57          2HG       MET  57  -7.437  -5.915   0.729
  447   1HE   MET  57          1HE       MET  57  -4.869  -5.749   0.035
  448   2HE   MET  57          2HE       MET  57  -4.403  -6.090   1.701
  449   3HE   MET  57          3HE       MET  57  -3.705  -4.710   0.856
  450    H    ASP  58           H        ASP  58 -11.287  -4.866   0.476
  451    HA   ASP  58           HA       ASP  58 -10.244  -6.311  -1.727
  452   1HB   ASP  58          1HB       ASP  58 -12.271  -6.983  -0.461
  453   2HB   ASP  58          2HB       ASP  58 -13.133  -5.615  -1.158
  454    H    ALA  59           H        ALA  59 -11.331  -3.070  -1.388
  455    HA   ALA  59           HA       ALA  59 -11.972  -2.498  -4.076
  456   1HB   ALA  59          1HB       ALA  59 -10.778  -0.681  -1.978
  457   2HB   ALA  59          2HB       ALA  59 -11.527  -0.160  -3.488
  458   3HB   ALA  59          3HB       ALA  59 -12.499  -0.960  -2.252
  459    H    VAL  60           H        VAL  60  -8.935  -2.456  -2.270
  460    HA   VAL  60           HA       VAL  60  -7.288  -1.592  -4.420
  461    HB   VAL  60           HB       VAL  60  -6.416  -3.310  -2.092
  462   1HG1  VAL  60          1HG1      VAL  60  -4.746  -3.025  -3.833
  463   2HG1  VAL  60          2HG1      VAL  60  -4.942  -1.273  -3.759
  464   3HG1  VAL  60          3HG1      VAL  60  -4.276  -2.145  -2.378
  465   1HG2  VAL  60          1HG2      VAL  60  -5.964  -1.211  -0.878
  466   2HG2  VAL  60          2HG2      VAL  60  -6.768  -0.315  -2.168
  467   3HG2  VAL  60          3HG2      VAL  60  -7.684  -1.459  -1.186
  468    H    LEU  61           H        LEU  61  -8.373  -4.689  -3.213
  469    HA   LEU  61           HA       LEU  61  -6.739  -6.329  -4.835
  470   1HB   LEU  61          1HB       LEU  61  -9.443  -6.959  -3.645
  471   2HB   LEU  61          2HB       LEU  61  -8.257  -8.124  -4.201
  472    HG   LEU  61           HG       LEU  61  -7.880  -6.238  -1.872
  473   1HD1  LEU  61          1HD1      LEU  61  -9.535  -7.949  -1.382
  474   2HD1  LEU  61          2HD1      LEU  61  -8.422  -9.203  -1.927
  475   3HD1  LEU  61          3HD1      LEU  61  -8.042  -8.250  -0.492
  476   1HD2  LEU  61          1HD2      LEU  61  -5.873  -7.565  -1.419
  477   2HD2  LEU  61          2HD2      LEU  61  -6.151  -8.488  -2.896
  478   3HD2  LEU  61          3HD2      LEU  61  -5.781  -6.766  -2.989
  479    H    ALA  62           H        ALA  62  -9.884  -4.833  -5.300
  480    HA   ALA  62           HA       ALA  62 -10.589  -6.151  -7.694
  481   1HB   ALA  62          1HB       ALA  62 -12.184  -4.343  -8.016
  482   2HB   ALA  62          2HB       ALA  62 -12.191  -4.882  -6.336
  483   3HB   ALA  62          3HB       ALA  62 -11.371  -3.385  -6.778
  484    H    LEU  63           H        LEU  63  -8.748  -3.208  -7.029
  485    HA   LEU  63           HA       LEU  63  -8.283  -2.441  -9.701
  486   1HB   LEU  63          1HB       LEU  63  -6.483  -2.085  -7.298
  487   2HB   LEU  63          2HB       LEU  63  -6.332  -1.225  -8.817
  488    HG   LEU  63           HG       LEU  63  -8.658  -1.009  -6.903
  489   1HD1  LEU  63          1HD1      LEU  63  -6.628   0.028  -6.042
  490   2HD1  LEU  63          2HD1      LEU  63  -6.439   0.927  -7.546
  491   3HD1  LEU  63          3HD1      LEU  63  -7.819   1.248  -6.496
  492   1HD2  LEU  63          1HD2      LEU  63  -9.383   0.835  -8.347
  493   2HD2  LEU  63          2HD2      LEU  63  -8.070   0.468  -9.466
  494   3HD2  LEU  63          3HD2      LEU  63  -9.365  -0.703  -9.209
  495    H    ASN  64           H        ASN  64  -6.867  -4.821  -7.634
  496    HA   ASN  64           HA       ASN  64  -5.413  -6.519  -7.920
  497   1HB   ASN  64          1HB       ASN  64  -7.118  -7.135  -9.622
  498   2HB   ASN  64          2HB       ASN  64  -6.161  -6.304 -10.841
  499   1HD2  ASN  64          2HD2      ASN  64  -4.841  -8.210  -8.200
  500   2HD2  ASN  64          1HD2      ASN  64  -4.191  -9.466  -9.188
  501    HA   PRO  65           HA       PRO  65  -1.834  -4.072  -9.428
  502   1HB   PRO  65          1HB       PRO  65  -0.558  -3.852  -7.079
  503   2HB   PRO  65          2HB       PRO  65  -1.850  -2.733  -7.533
  504   1HG   PRO  65          1HG       PRO  65  -1.946  -5.103  -5.713
  505   2HG   PRO  65          2HG       PRO  65  -2.693  -3.508  -5.513
  506   1HD   PRO  65          1HD       PRO  65  -4.025  -5.736  -6.411
  507   2HD   PRO  65          2HD       PRO  65  -4.508  -4.071  -6.779
  508    H    ALA  66           H        ALA  66   0.521  -4.738  -9.075
  509    HA   ALA  66           HA       ALA  66   0.678  -7.621  -9.314
  510   1HB   ALA  66          1HB       ALA  66   1.875  -6.174 -10.895
  511   2HB   ALA  66          2HB       ALA  66   2.843  -5.533  -9.567
  512   3HB   ALA  66          3HB       ALA  66   2.976  -7.234 -10.016
  513    H    VAL  67           H        VAL  67   1.569  -5.097  -7.072
  514    HA   VAL  67           HA       VAL  67   1.925  -7.067  -4.989
  515    HB   VAL  67           HB       VAL  67   4.187  -7.029  -5.891
  516   1HG1  VAL  67          1HG1      VAL  67   4.128  -4.057  -5.399
  517   2HG1  VAL  67          2HG1      VAL  67   5.542  -4.992  -5.889
  518   3HG1  VAL  67          3HG1      VAL  67   4.157  -4.856  -6.971
  519   1HG2  VAL  67          1HG2      VAL  67   3.982  -5.541  -3.277
  520   2HG2  VAL  67          2HG2      VAL  67   3.975  -7.291  -3.493
  521   3HG2  VAL  67          3HG2      VAL  67   5.426  -6.362  -3.873
  522    H    ILE  68           H        ILE  68   1.636  -6.188  -2.916
  523    HA   ILE  68           HA       ILE  68   0.858  -3.342  -2.897
  524    HB   ILE  68           HB       ILE  68  -0.273  -5.561  -1.178
  525   1HG1  ILE  68          1HG1      ILE  68  -1.530  -4.000  -3.448
  526   2HG1  ILE  68          2HG1      ILE  68  -1.020  -5.682  -3.527
  527   1HG2  ILE  68          1HG2      ILE  68  -1.875  -3.856  -0.421
  528   2HG2  ILE  68          2HG2      ILE  68  -0.214  -3.431  -0.004
  529   3HG2  ILE  68          3HG2      ILE  68  -1.011  -2.641  -1.365
  530   1HD1  ILE  68          1HD1      ILE  68  -2.677  -6.257  -1.826
  531   2HD1  ILE  68          2HD1      ILE  68  -3.191  -4.572  -1.765
  532   3HD1  ILE  68          3HD1      ILE  68  -3.418  -5.509  -3.241
  533    H    LEU  69           H        LEU  69   1.953  -2.057  -1.590
  534    HA   LEU  69           HA       LEU  69   3.601  -3.264   0.532
  535   1HB   LEU  69          1HB       LEU  69   3.895  -0.591  -0.844
  536   2HB   LEU  69          2HB       LEU  69   4.919  -1.173   0.451
  537    HG   LEU  69           HG       LEU  69   4.705  -2.361  -2.317
  538   1HD1  LEU  69          1HD1      LEU  69   7.018  -1.589  -2.543
  539   2HD1  LEU  69          2HD1      LEU  69   5.904  -0.250  -2.270
  540   3HD1  LEU  69          3HD1      LEU  69   6.917  -0.835  -0.952
  541   1HD2  LEU  69          1HD2      LEU  69   6.449  -3.157   0.013
  542   2HD2  LEU  69          2HD2      LEU  69   5.104  -4.090  -0.647
  543   3HD2  LEU  69          3HD2      LEU  69   6.547  -3.811  -1.623
  544    H    LEU  70           H        LEU  70   2.671  -3.113   2.453
  545    HA   LEU  70           HA       LEU  70   0.822  -0.914   2.995
  546   1HB   LEU  70          1HB       LEU  70   0.087  -3.194   3.524
  547   2HB   LEU  70          2HB       LEU  70   1.465  -3.401   4.587
  548    HG   LEU  70           HG       LEU  70   0.574  -1.595   6.041
  549   1HD1  LEU  70          1HD1      LEU  70  -0.727  -0.399   4.352
  550   2HD1  LEU  70          2HD1      LEU  70  -1.837  -1.765   4.239
  551   3HD1  LEU  70          3HD1      LEU  70  -1.723  -0.843   5.740
  552   1HD2  LEU  70          1HD2      LEU  70  -1.224  -2.923   7.010
  553   2HD2  LEU  70          2HD2      LEU  70  -1.321  -3.884   5.533
  554   3HD2  LEU  70          3HD2      LEU  70   0.131  -3.946   6.531
  555    H    GLY  71           H        GLY  71   1.776   0.879   3.702
  556   1HA   GLY  71          1HA       GLY  71   4.012   0.604   5.612
  557   2HA   GLY  71          2HA       GLY  71   3.763   1.990   4.558
  558    H    THR  72           H        THR  72   2.996   0.518   7.564
  559    HA   THR  72           HA       THR  72   0.784   2.298   8.130
  560    HB   THR  72           HB       THR  72   0.879   1.162  10.402
  561    HG1  THR  72           HG1      THR  72   2.708   0.140  10.704
  562   1HG2  THR  72          1HG2      THR  72   0.553  -0.576   7.951
  563   2HG2  THR  72          2HG2      THR  72  -0.087  -0.930   9.555
  564   3HG2  THR  72          3HG2      THR  72  -0.685   0.464   8.656
  565    H    GLY  73           H        GLY  73   2.582   4.014   7.629
  566   1HA   GLY  73          1HA       GLY  73   4.004   5.676   8.326
  567   2HA   GLY  73          2HA       GLY  73   2.915   5.712   9.698
  568    H    GLU  74           H        GLU  74   3.684   5.301  11.610
  569    HA   GLU  74           HA       GLU  74   6.534   4.998  11.918
  570   1HB   GLU  74          1HB       GLU  74   5.427   6.695  13.201
  571   2HB   GLU  74          2HB       GLU  74   4.265   5.538  13.831
  572   1HG   GLU  74          1HG       GLU  74   6.263   4.377  14.903
  573   2HG   GLU  74          2HG       GLU  74   7.160   5.849  14.529
  574    H    ARG  75           H        ARG  75   3.659   3.366  13.228
  575    HA   ARG  75           HA       ARG  75   5.345   1.224  14.262
  576   1HB   ARG  75          1HB       ARG  75   2.466   1.991  14.698
  577   2HB   ARG  75          2HB       ARG  75   3.113   0.459  15.262
  578   1HG   ARG  75          1HG       ARG  75   4.612   1.540  16.750
  579   2HG   ARG  75          2HG       ARG  75   4.278   3.120  16.037
  580   1HD   ARG  75          1HD       ARG  75   2.103   3.180  16.934
  581   2HD   ARG  75          2HD       ARG  75   2.131   1.462  17.320
  582    HE   ARG  75           HE       ARG  75   3.608   1.933  19.141
  583   1HH1  ARG  75          1HH1      ARG  75   2.395   4.816  17.564
  584   2HH1  ARG  75          2HH1      ARG  75   2.527   5.802  18.979
  585   1HH2  ARG  75          1HH2      ARG  75   3.765   3.228  21.018
  586   2HH2  ARG  75          2HH2      ARG  75   3.305   4.905  20.953
  587    H    GLN  76           H        GLN  76   5.826  -0.261  12.750
  588    HA   GLN  76           HA       GLN  76   4.014  -0.947  10.644
  589   1HB   GLN  76          1HB       GLN  76   5.643  -2.668  10.039
  590   2HB   GLN  76          2HB       GLN  76   6.432  -1.120  10.299
  591   1HG   GLN  76          1HG       GLN  76   7.146  -1.851  12.510
  592   2HG   GLN  76          2HG       GLN  76   6.341  -3.398  12.257
  593   1HE2  GLN  76          2HE2      GLN  76   7.111  -3.546   9.452
  594   2HE2  GLN  76          1HE2      GLN  76   8.791  -3.943   9.436
  595    H    GLN  77           H        GLN  77   2.589  -2.542  10.533
  596    HA   GLN  77           HA       GLN  77   2.481  -4.622  12.553
  597   1HB   GLN  77          1HB       GLN  77   0.867  -2.243  12.702
  598   2HB   GLN  77          2HB       GLN  77  -0.164  -3.637  12.418
  599   1HG   GLN  77          1HG       GLN  77   1.878  -3.482  14.620
  600   2HG   GLN  77          2HG       GLN  77   0.183  -3.043  14.814
  601   1HE2  GLN  77          2HE2      GLN  77  -0.725  -5.165  13.015
  602   2HE2  GLN  77          1HE2      GLN  77  -0.583  -6.636  13.907
  603    H    PHE  78           H        PHE  78   1.715  -6.463  11.707
  604    HA   PHE  78           HA       PHE  78   0.781  -6.504   8.986
  605   1HB   PHE  78          1HB       PHE  78   1.196  -8.668  11.054
  606   2HB   PHE  78          2HB       PHE  78   0.532  -8.996   9.458
  607    HD1  PHE  78           HD1      PHE  78   3.524  -7.790  11.262
  608    HD2  PHE  78           HD2      PHE  78   1.924  -9.158   7.562
  609    HE1  PHE  78           HE1      PHE  78   5.803  -7.993  10.355
  610    HE2  PHE  78           HE2      PHE  78   4.199  -9.362   6.649
  611    HZ   PHE  78           HZ       PHE  78   6.142  -8.780   8.046
  612    HA   PRO  79           HA       PRO  79  -3.505  -6.028   9.988
  613   1HB   PRO  79          1HB       PRO  79  -4.552  -7.157   7.722
  614   2HB   PRO  79          2HB       PRO  79  -3.908  -5.513   7.793
  615   1HG   PRO  79          1HG       PRO  79  -2.610  -8.015   6.798
  616   2HG   PRO  79          2HG       PRO  79  -2.570  -6.380   6.112
  617   1HD   PRO  79          1HD       PRO  79  -0.520  -7.386   7.543
  618   2HD   PRO  79          2HD       PRO  79  -0.949  -5.663   7.591
  619    H    SER  80           H        SER  80  -5.407  -7.314  10.388
  620    HA   SER  80           HA       SER  80  -4.877  -9.757  11.650
  621   1HB   SER  80          1HB       SER  80  -7.439  -9.920  11.651
  622   2HB   SER  80          2HB       SER  80  -6.730  -8.507  12.432
  623    HG   SER  80           HG       SER  80  -8.559  -8.336  10.745
  624    H    THR  81           H        THR  81  -5.862 -11.862  11.120
  625    HA   THR  81           HA       THR  81  -4.972 -12.740   8.616
  626    HB   THR  81           HB       THR  81  -5.123 -14.238  10.542
  627    HG1  THR  81           HG1      THR  81  -5.810 -16.021   9.400
  628   1HG2  THR  81          1HG2      THR  81  -8.113 -14.071  10.158
  629   2HG2  THR  81          2HG2      THR  81  -7.278 -15.177  11.249
  630   3HG2  THR  81          3HG2      THR  81  -7.203 -13.439  11.531
  631    H    ASP  82           H        ASP  82  -8.076 -11.527   9.627
  632    HA   ASP  82           HA       ASP  82  -9.656 -12.480   7.493
  633   1HB   ASP  82          1HB       ASP  82 -10.585 -11.497   9.552
  634   2HB   ASP  82          2HB       ASP  82  -9.936  -9.927   9.096
  635    H    VAL  83           H        VAL  83  -7.541  -9.697   7.810
  636    HA   VAL  83           HA       VAL  83  -8.352  -8.649   5.215
  637    HB   VAL  83           HB       VAL  83  -6.226  -7.597   7.089
  638   1HG1  VAL  83          1HG1      VAL  83  -5.984  -6.780   4.821
  639   2HG1  VAL  83          2HG1      VAL  83  -7.683  -6.306   4.785
  640   3HG1  VAL  83          3HG1      VAL  83  -6.563  -5.485   5.873
  641   1HG2  VAL  83          1HG2      VAL  83  -9.135  -6.831   6.872
  642   2HG2  VAL  83          2HG2      VAL  83  -8.364  -7.651   8.231
  643   3HG2  VAL  83          3HG2      VAL  83  -7.925  -5.988   7.840
  644    H    LEU  84           H        LEU  84  -5.539 -10.074   6.795
  645    HA   LEU  84           HA       LEU  84  -3.725  -9.750   4.666
  646   1HB   LEU  84          1HB       LEU  84  -3.253 -10.308   7.111
  647   2HB   LEU  84          2HB       LEU  84  -3.654 -11.964   6.710
  648    HG   LEU  84           HG       LEU  84  -1.484 -10.500   5.227
  649   1HD1  LEU  84          1HD1      LEU  84  -1.200 -12.047   7.801
  650   2HD1  LEU  84          2HD1      LEU  84   0.127 -11.457   6.802
  651   3HD1  LEU  84          3HD1      LEU  84  -0.953 -10.313   7.597
  652   1HD2  LEU  84          1HD2      LEU  84  -0.626 -12.769   4.888
  653   2HD2  LEU  84          2HD2      LEU  84  -1.982 -13.420   5.809
  654   3HD2  LEU  84          3HD2      LEU  84  -2.271 -12.605   4.272
  655    H    ALA  85           H        ALA  85  -5.769 -12.514   5.604
  656    HA   ALA  85           HA       ALA  85  -4.913 -14.207   3.508
  657   1HB   ALA  85          1HB       ALA  85  -6.011 -15.048   5.526
  658   2HB   ALA  85          2HB       ALA  85  -7.517 -14.280   5.024
  659   3HB   ALA  85          3HB       ALA  85  -6.832 -15.591   4.062
  660    H    ALA  86           H        ALA  86  -7.346 -11.712   3.699
  661    HA   ALA  86           HA       ALA  86  -8.840 -12.369   1.411
  662   1HB   ALA  86          1HB       ALA  86  -8.309  -9.641   2.585
  663   2HB   ALA  86          2HB       ALA  86  -9.587 -10.041   1.439
  664   3HB   ALA  86          3HB       ALA  86  -9.606 -10.737   3.060
  665    H    CYS  87           H        CYS  87  -5.935 -10.391   1.830
  666    HA   CYS  87           HA       CYS  87  -5.742  -9.716  -0.948
  667   1HB   CYS  87          1HB       CYS  87  -4.768  -8.265   0.769
  668   2HB   CYS  87          2HB       CYS  87  -3.684  -9.558   1.268
  669    HG   CYS  87           HG       CYS  87  -2.239  -9.581  -1.129
  670    H    LEU  88           H        LEU  88  -4.394 -12.163   1.166
  671    HA   LEU  88           HA       LEU  88  -2.416 -13.162  -0.568
  672   1HB   LEU  88          1HB       LEU  88  -2.789 -13.559   1.951
  673   2HB   LEU  88          2HB       LEU  88  -3.904 -14.816   1.459
  674    HG   LEU  88           HG       LEU  88  -1.033 -14.804   0.552
  675   1HD1  LEU  88          1HD1      LEU  88  -1.064 -14.741   2.995
  676   2HD1  LEU  88          2HD1      LEU  88  -2.185 -16.103   3.017
  677   3HD1  LEU  88          3HD1      LEU  88  -0.547 -16.320   2.401
  678   1HD2  LEU  88          1HD2      LEU  88  -1.425 -17.201   0.270
  679   2HD2  LEU  88          2HD2      LEU  88  -3.083 -17.003   0.838
  680   3HD2  LEU  88          3HD2      LEU  88  -2.574 -16.257  -0.677
  681    H    THR  89           H        THR  89  -5.819 -14.054  -0.096
  682    HA   THR  89           HA       THR  89  -5.716 -16.267  -1.896
  683    HB   THR  89           HB       THR  89  -8.262 -16.079  -1.779
  684    HG1  THR  89           HG1      THR  89  -7.736 -14.340   0.401
  685   1HG2  THR  89          1HG2      THR  89  -6.681 -16.381   0.777
  686   2HG2  THR  89          2HG2      THR  89  -8.325 -16.963   0.513
  687   3HG2  THR  89          3HG2      THR  89  -6.990 -17.646  -0.412
  688    H    ARG  90           H        ARG  90  -5.671 -12.983  -2.458
  689    HA   ARG  90           HA       ARG  90  -7.017 -13.142  -5.036
  690   1HB   ARG  90          1HB       ARG  90  -5.561 -10.884  -3.653
  691   2HB   ARG  90          2HB       ARG  90  -6.260 -10.752  -5.259
  692   1HG   ARG  90          1HG       ARG  90  -7.770 -11.326  -2.719
  693   2HG   ARG  90          2HG       ARG  90  -7.716  -9.784  -3.575
  694   1HD   ARG  90          1HD       ARG  90  -8.653 -10.997  -5.574
  695   2HD   ARG  90          2HD       ARG  90  -8.919 -12.380  -4.511
  696    HE   ARG  90           HE       ARG  90 -10.066  -9.909  -3.560
  697   1HH1  ARG  90          1HH1      ARG  90 -10.578 -12.829  -5.412
  698   2HH1  ARG  90          2HH1      ARG  90 -12.310 -12.675  -5.427
  699   1HH2  ARG  90          1HH2      ARG  90 -12.328  -9.693  -3.534
  700   2HH2  ARG  90          2HH2      ARG  90 -13.308 -10.883  -4.341
  701    H    GLY  91           H        GLY  91  -4.072 -13.968  -3.781
  702   1HA   GLY  91          1HA       GLY  91  -2.246 -14.852  -4.905
  703   2HA   GLY  91          2HA       GLY  91  -2.925 -14.265  -6.416
  704    H    ILE  92           H        ILE  92  -2.761 -11.938  -3.944
  705    HA   ILE  92           HA       ILE  92  -0.524 -10.646  -5.348
  706    HB   ILE  92           HB       ILE  92  -2.558  -9.346  -3.529
  707   1HG1  ILE  92          1HG1      ILE  92  -2.489  -9.392  -6.555
  708   2HG1  ILE  92          2HG1      ILE  92  -3.605 -10.323  -5.561
  709   1HG2  ILE  92          1HG2      ILE  92  -1.759  -7.261  -4.548
  710   2HG2  ILE  92          2HG2      ILE  92  -0.462  -8.121  -3.716
  711   3HG2  ILE  92          3HG2      ILE  92  -0.571  -8.178  -5.476
  712   1HD1  ILE  92          1HD1      ILE  92  -3.432  -7.324  -5.669
  713   2HD1  ILE  92          2HD1      ILE  92  -4.653  -8.323  -6.460
  714   3HD1  ILE  92          3HD1      ILE  92  -4.567  -8.264  -4.699
  715    H    GLY  93           H        GLY  93   1.294 -10.053  -4.268
  716   1HA   GLY  93          1HA       GLY  93   1.731 -11.145  -1.643
  717   2HA   GLY  93          2HA       GLY  93   2.896 -10.253  -2.612
  718    H    LEU  94           H        LEU  94   1.352 -10.179   0.217
  719    HA   LEU  94           HA       LEU  94   0.999  -7.262   0.250
  720   1HB   LEU  94          1HB       LEU  94  -0.933  -8.564   0.995
  721   2HB   LEU  94          2HB       LEU  94   0.055  -9.375   2.193
  722    HG   LEU  94           HG       LEU  94   0.387  -7.220   3.358
  723   1HD1  LEU  94          1HD1      LEU  94  -1.582  -6.160   1.336
  724   2HD1  LEU  94          2HD1      LEU  94  -0.980  -5.295   2.750
  725   3HD1  LEU  94          3HD1      LEU  94   0.125  -5.729   1.446
  726   1HD2  LEU  94          1HD2      LEU  94  -2.491  -7.987   2.882
  727   2HD2  LEU  94          2HD2      LEU  94  -1.396  -8.718   4.058
  728   3HD2  LEU  94          3HD2      LEU  94  -1.892  -7.034   4.240
  729    H    GLU  95           H        GLU  95   2.948  -6.396   0.642
  730    HA   GLU  95           HA       GLU  95   4.667  -7.555   2.713
  731   1HB   GLU  95          1HB       GLU  95   5.199  -5.286   0.781
  732   2HB   GLU  95          2HB       GLU  95   6.380  -6.028   1.850
  733   1HG   GLU  95          1HG       GLU  95   4.928  -7.511  -0.324
  734   2HG   GLU  95          2HG       GLU  95   6.503  -6.749  -0.533
  735    H    ALA  96           H        ALA  96   4.555  -6.761   4.734
  736    HA   ALA  96           HA       ALA  96   3.337  -4.111   5.109
  737   1HB   ALA  96          1HB       ALA  96   2.825  -4.817   7.383
  738   2HB   ALA  96          2HB       ALA  96   2.185  -5.970   6.212
  739   3HB   ALA  96          3HB       ALA  96   3.656  -6.348   7.108
  740    H    MET  97           H        MET  97   4.601  -2.472   5.643
  741    HA   MET  97           HA       MET  97   6.999  -2.917   7.262
  742   1HB   MET  97          1HB       MET  97   7.001  -1.515   4.579
  743   2HB   MET  97          2HB       MET  97   8.331  -1.463   5.725
  744   1HG   MET  97          1HG       MET  97   8.626  -3.870   5.507
  745   2HG   MET  97          2HG       MET  97   7.275  -3.937   4.376
  746   1HE   MET  97          1HE       MET  97  10.377  -4.589   2.069
  747   2HE   MET  97          2HE       MET  97   8.808  -5.191   2.603
  748   3HE   MET  97          3HE       MET  97  10.162  -5.132   3.733
  749    H    THR  98           H        THR  98   8.065  -0.546   7.494
  750    HA   THR  98           HA       THR  98   5.999   1.212   8.503
  751    HB   THR  98           HB       THR  98   7.948   2.684   9.105
  752    HG1  THR  98           HG1      THR  98  10.009   1.220   8.963
  753   1HG2  THR  98          1HG2      THR  98   8.112  -0.178  10.056
  754   2HG2  THR  98          2HG2      THR  98   8.818   1.217  10.872
  755   3HG2  THR  98          3HG2      THR  98   7.066   1.077  10.719
  756    H    ASN  99           H        ASN  99   6.302   3.645   7.896
  757    HA   ASN  99           HA       ASN  99   5.744   3.983   5.176
  758   1HB   ASN  99          1HB       ASN  99   5.101   5.626   6.895
  759   2HB   ASN  99          2HB       ASN  99   6.794   6.047   7.128
  760   1HD2  ASN  99          2HD2      ASN  99   4.024   6.352   5.094
  761   2HD2  ASN  99          1HD2      ASN  99   4.670   7.547   4.031
  762    H    ALA 100           H        ALA 100   8.749   4.538   6.962
  763    HA   ALA 100           HA       ALA 100  10.245   5.563   4.810
  764   1HB   ALA 100          1HB       ALA 100  12.195   5.175   6.220
  765   2HB   ALA 100          2HB       ALA 100  10.874   5.881   7.151
  766   3HB   ALA 100          3HB       ALA 100  11.229   4.160   7.291
  767    H    ALA 101           H        ALA 101   9.938   2.271   6.104
  768    HA   ALA 101           HA       ALA 101  11.889   1.142   4.367
  769   1HB   ALA 101          1HB       ALA 101   9.668  -0.212   5.890
  770   2HB   ALA 101          2HB       ALA 101  11.051  -1.015   5.146
  771   3HB   ALA 101          3HB       ALA 101  11.296   0.099   6.491
  772    H    ALA 102           H        ALA 102   8.382   1.487   4.224
  773    HA   ALA 102           HA       ALA 102   7.946  -0.127   1.959
  774   1HB   ALA 102          1HB       ALA 102   6.136   0.583   3.441
  775   2HB   ALA 102          2HB       ALA 102   6.353   2.251   2.913
  776   3HB   ALA 102          3HB       ALA 102   5.804   1.029   1.767
  777    H    ALA 103           H        ALA 103   8.556   3.359   2.294
  778    HA   ALA 103           HA       ALA 103   8.329   4.017  -0.426
  779   1HB   ALA 103          1HB       ALA 103   8.347   5.677   1.380
  780   2HB   ALA 103          2HB       ALA 103  10.056   5.343   1.661
  781   3HB   ALA 103          3HB       ALA 103   9.536   6.050   0.132
  782    H    ARG 104           H        ARG 104  11.073   2.899   1.480
  783    HA   ARG 104           HA       ARG 104  13.091   3.274  -0.433
  784   1HB   ARG 104          1HB       ARG 104  13.451   2.794   1.983
  785   2HB   ARG 104          2HB       ARG 104  12.931   1.140   1.706
  786   1HG   ARG 104          1HG       ARG 104  15.374   1.372   1.837
  787   2HG   ARG 104          2HG       ARG 104  14.836   0.732   0.283
  788   1HD   ARG 104          1HD       ARG 104  15.522   2.564  -0.858
  789   2HD   ARG 104          2HD       ARG 104  15.112   3.665   0.456
  790    HE   ARG 104           HE       ARG 104  17.201   3.165   1.487
  791   1HH1  ARG 104          1HH1      ARG 104  16.843   1.708  -1.689
  792   2HH1  ARG 104          2HH1      ARG 104  18.556   1.600  -1.963
  793   1HH2  ARG 104          1HH2      ARG 104  19.452   3.034   1.110
  794   2HH2  ARG 104          2HH2      ARG 104  20.034   2.372  -0.392
  795    H    THR 105           H        THR 105  10.931   0.546   0.183
  796    HA   THR 105           HA       THR 105  12.091  -1.087  -1.876
  797    HB   THR 105           HB       THR 105   9.402  -1.458  -0.544
  798    HG1  THR 105           HG1      THR 105  10.610  -1.583   1.215
  799   1HG2  THR 105          1HG2      THR 105  11.351  -3.426  -1.757
  800   2HG2  THR 105          2HG2      THR 105   9.821  -3.836  -0.980
  801   3HG2  THR 105          3HG2      THR 105   9.828  -2.902  -2.476
  802    H    TYR 106           H        TYR 106   9.396   1.122  -1.581
  803    HA   TYR 106           HA       TYR 106   7.885   0.412  -3.812
  804   1HB   TYR 106          1HB       TYR 106   7.096   1.922  -2.047
  805   2HB   TYR 106          2HB       TYR 106   8.251   3.143  -2.565
  806    HD1  TYR 106           HD1      TYR 106   7.647   4.721  -4.182
  807    HD2  TYR 106           HD2      TYR 106   5.309   1.195  -3.738
  808    HE1  TYR 106           HE1      TYR 106   5.967   5.648  -5.721
  809    HE2  TYR 106           HE2      TYR 106   3.626   2.111  -5.278
  810    HH   TYR 106           HH       TYR 106   2.873   4.325  -6.066
  811    H    ASN 107           H        ASN 107  10.526   2.773  -3.536
  812    HA   ASN 107           HA       ASN 107  10.354   3.872  -6.084
  813   1HB   ASN 107          1HB       ASN 107  11.768   4.810  -4.309
  814   2HB   ASN 107          2HB       ASN 107  12.848   3.424  -4.430
  815   1HD2  ASN 107          2HD2      ASN 107  14.294   3.302  -6.116
  816   2HD2  ASN 107          1HD2      ASN 107  14.589   4.605  -7.214
  817    H    VAL 108           H        VAL 108  11.956   0.919  -5.023
  818    HA   VAL 108           HA       VAL 108  13.298   0.416  -7.485
  819    HB   VAL 108           HB       VAL 108  12.537  -1.538  -5.304
  820   1HG1  VAL 108          1HG1      VAL 108  13.059  -2.673  -7.394
  821   2HG1  VAL 108          2HG1      VAL 108  14.571  -1.773  -7.522
  822   3HG1  VAL 108          3HG1      VAL 108  14.341  -2.931  -6.212
  823   1HG2  VAL 108          1HG2      VAL 108  13.919   0.270  -4.449
  824   2HG2  VAL 108          2HG2      VAL 108  14.841  -1.233  -4.516
  825   3HG2  VAL 108          3HG2      VAL 108  15.089   0.009  -5.743
  826    H    LEU 109           H        LEU 109  10.297  -0.824  -6.046
  827    HA   LEU 109           HA       LEU 109   9.685  -2.609  -8.143
  828   1HB   LEU 109          1HB       LEU 109   7.816  -1.286  -6.177
  829   2HB   LEU 109          2HB       LEU 109   7.443  -2.694  -7.155
  830    HG   LEU 109           HG       LEU 109   9.528  -2.561  -4.973
  831   1HD1  LEU 109          1HD1      LEU 109   8.039  -4.099  -3.789
  832   2HD1  LEU 109          2HD1      LEU 109   7.260  -2.548  -4.103
  833   3HD1  LEU 109          3HD1      LEU 109   6.856  -3.952  -5.091
  834   1HD2  LEU 109          1HD2      LEU 109   9.750  -4.971  -5.321
  835   2HD2  LEU 109          2HD2      LEU 109   8.634  -4.879  -6.684
  836   3HD2  LEU 109          3HD2      LEU 109  10.198  -4.068  -6.768
  837    H    ALA 110           H        ALA 110   8.809   0.760  -7.555
  838    HA   ALA 110           HA       ALA 110   6.971   1.024  -9.686
  839   1HB   ALA 110          1HB       ALA 110   7.122   2.635  -7.844
  840   2HB   ALA 110          2HB       ALA 110   8.708   3.145  -8.423
  841   3HB   ALA 110          3HB       ALA 110   7.277   3.428  -9.413
  842    H    SER 111           H        SER 111  10.464   1.265  -9.500
  843    HA   SER 111           HA       SER 111  10.778   2.353 -12.133
  844   1HB   SER 111          1HB       SER 111  12.807   1.055 -10.299
  845   2HB   SER 111          2HB       SER 111  13.183   1.968 -11.761
  846    HG   SER 111           HG       SER 111  12.183   2.875  -9.287
  847    H    GLU 112           H        GLU 112   9.957  -0.684 -11.035
  848    HA   GLU 112           HA       GLU 112  11.202  -2.104 -13.256
  849   1HB   GLU 112          1HB       GLU 112   9.807  -2.899 -10.756
  850   2HB   GLU 112          2HB       GLU 112   9.695  -3.999 -12.124
  851   1HG   GLU 112          1HG       GLU 112  12.265  -2.967 -10.947
  852   2HG   GLU 112          2HG       GLU 112  11.541  -4.538 -10.595
  853    H    GLY 113           H        GLY 113   8.541  -0.233 -12.833
  854   1HA   GLY 113          1HA       GLY 113   6.747   0.161 -14.227
  855   2HA   GLY 113          2HA       GLY 113   7.338  -1.126 -15.269
  856    H    ARG 114           H        ARG 114   6.831  -1.840 -11.942
  857    HA   ARG 114           HA       ARG 114   4.582  -3.554 -12.687
  858   1HB   ARG 114          1HB       ARG 114   6.312  -3.510 -10.207
  859   2HB   ARG 114          2HB       ARG 114   4.959  -4.606 -10.453
  860   1HG   ARG 114          1HG       ARG 114   6.085  -5.568 -12.388
  861   2HG   ARG 114          2HG       ARG 114   7.439  -4.462 -12.150
  862   1HD   ARG 114          1HD       ARG 114   7.830  -5.448  -9.932
  863   2HD   ARG 114          2HD       ARG 114   6.502  -6.575 -10.211
  864    HE   ARG 114           HE       ARG 114   7.922  -7.237 -12.254
  865   1HH1  ARG 114          1HH1      ARG 114   9.128  -6.420  -9.068
  866   2HH1  ARG 114          2HH1      ARG 114  10.645  -7.221  -9.302
  867   1HH2  ARG 114          1HH2      ARG 114   9.909  -8.312 -12.552
  868   2HH2  ARG 114          2HH2      ARG 114  11.099  -8.291 -11.286
  869    H    ARG 115           H        ARG 115   2.593  -3.417 -11.729
  870    HA   ARG 115           HA       ARG 115   1.890  -0.895 -10.580
  871   1HB   ARG 115          1HB       ARG 115   0.252  -3.427 -10.807
  872   2HB   ARG 115          2HB       ARG 115  -0.372  -1.840 -10.376
  873   1HG   ARG 115          1HG       ARG 115   0.427  -1.018 -12.600
  874   2HG   ARG 115          2HG       ARG 115   0.791  -2.695 -13.014
  875   1HD   ARG 115          1HD       ARG 115  -1.366  -2.167 -13.897
  876   2HD   ARG 115          2HD       ARG 115  -1.586  -3.257 -12.529
  877    HE   ARG 115           HE       ARG 115  -1.855  -0.351 -12.125
  878   1HH1  ARG 115          1HH1      ARG 115  -3.269  -3.555 -12.162
  879   2HH1  ARG 115          2HH1      ARG 115  -4.765  -3.053 -11.444
  880   1HH2  ARG 115          1HH2      ARG 115  -3.822   0.324 -11.183
  881   2HH2  ARG 115          2HH2      ARG 115  -5.080  -0.832 -10.891
  882    H    VAL 116           H        VAL 116   3.143  -0.734  -8.760
  883    HA   VAL 116           HA       VAL 116   2.615  -2.592  -6.580
  884    HB   VAL 116           HB       VAL 116   4.929  -2.121  -6.817
  885   1HG1  VAL 116          1HG1      VAL 116   4.790  -0.099  -8.160
  886   2HG1  VAL 116          2HG1      VAL 116   4.247   0.816  -6.754
  887   3HG1  VAL 116          3HG1      VAL 116   5.875   0.139  -6.789
  888   1HG2  VAL 116          1HG2      VAL 116   4.157  -2.196  -4.513
  889   2HG2  VAL 116          2HG2      VAL 116   5.508  -1.074  -4.680
  890   3HG2  VAL 116          3HG2      VAL 116   3.861  -0.457  -4.540
  891    H    ALA 117           H        ALA 117   1.045  -2.199  -5.219
  892    HA   ALA 117           HA       ALA 117  -0.171   0.440  -5.113
  893   1HB   ALA 117          1HB       ALA 117  -1.611  -1.533  -5.308
  894   2HB   ALA 117          2HB       ALA 117  -0.989  -2.137  -3.772
  895   3HB   ALA 117          3HB       ALA 117  -1.931  -0.647  -3.816
  896    H    LEU 118           H        LEU 118   0.978   1.811  -3.877
  897    HA   LEU 118           HA       LEU 118   2.157   0.892  -1.392
  898   1HB   LEU 118          1HB       LEU 118   3.344   2.472  -2.900
  899   2HB   LEU 118          2HB       LEU 118   2.093   3.661  -2.596
  900    HG   LEU 118           HG       LEU 118   2.727   3.690  -0.207
  901   1HD1  LEU 118          1HD1      LEU 118   3.633   1.436  -0.029
  902   2HD1  LEU 118          2HD1      LEU 118   4.965   1.877  -1.098
  903   3HD1  LEU 118          3HD1      LEU 118   4.822   2.634   0.488
  904   1HD2  LEU 118          1HD2      LEU 118   4.833   4.892  -0.508
  905   2HD2  LEU 118          2HD2      LEU 118   4.991   4.213  -2.129
  906   3HD2  LEU 118          3HD2      LEU 118   3.667   5.320  -1.761
  907    H    ALA 119           H        ALA 119   0.574   0.476   0.041
  908    HA   ALA 119           HA       ALA 119  -1.619   2.302   0.464
  909   1HB   ALA 119          1HB       ALA 119  -0.753  -0.121   2.045
  910   2HB   ALA 119          2HB       ALA 119  -2.259   0.770   2.270
  911   3HB   ALA 119          3HB       ALA 119  -1.963  -0.097   0.763
  912    H    MET 120           H        MET 120  -0.910   4.222   1.173
  913    HA   MET 120           HA       MET 120   1.158   4.330   3.221
  914   1HB   MET 120          1HB       MET 120  -0.152   6.465   1.539
  915   2HB   MET 120          2HB       MET 120   1.036   6.804   2.786
  916   1HG   MET 120          1HG       MET 120   1.688   4.906   0.577
  917   2HG   MET 120          2HG       MET 120   1.753   6.643   0.301
  918   1HE   MET 120          1HE       MET 120   3.313   3.575   2.136
  919   2HE   MET 120          2HE       MET 120   2.697   4.491   3.511
  920   3HE   MET 120          3HE       MET 120   4.437   4.332   3.266
  921    H    ILE 121           H        ILE 121   0.107   3.721   5.083
  922    HA   ILE 121           HA       ILE 121  -2.076   5.420   6.020
  923    HB   ILE 121           HB       ILE 121  -0.663   3.139   7.430
  924   1HG1  ILE 121          1HG1      ILE 121  -3.361   3.226   6.052
  925   2HG1  ILE 121          2HG1      ILE 121  -1.929   2.403   5.445
  926   1HG2  ILE 121          1HG2      ILE 121  -3.171   4.651   8.163
  927   2HG2  ILE 121          2HG2      ILE 121  -2.545   3.235   9.008
  928   3HG2  ILE 121          3HG2      ILE 121  -1.620   4.736   8.997
  929   1HD1  ILE 121          1HD1      ILE 121  -3.490   0.846   6.461
  930   2HD1  ILE 121          2HD1      ILE 121  -1.974   0.901   7.362
  931   3HD1  ILE 121          3HD1      ILE 121  -3.399   1.734   7.983
  932    H    VAL 122           H        VAL 122  -1.324   7.395   6.521
  933    HA   VAL 122           HA       VAL 122   1.188   7.555   8.060
  934    HB   VAL 122           HB       VAL 122   0.257   9.632   6.077
  935   1HG1  VAL 122          1HG1      VAL 122   2.917   9.139   7.398
  936   2HG1  VAL 122          2HG1      VAL 122   2.587  10.380   6.188
  937   3HG1  VAL 122          3HG1      VAL 122   1.789  10.447   7.760
  938   1HG2  VAL 122          1HG2      VAL 122   0.661   7.555   4.864
  939   2HG2  VAL 122          2HG2      VAL 122   1.913   8.745   4.509
  940   3HG2  VAL 122          3HG2      VAL 122   2.249   7.413   5.616
  941    H    GLY 123           H        GLY 123   1.337   9.217   9.619
  942   1HA   GLY 123          1HA       GLY 123   0.393  11.341  10.440
  943   2HA   GLY 123          2HA       GLY 123  -1.192  10.623  10.191
  944    H    GLY 124           H        GLY 124  -2.115  10.237  12.065
  945   1HA   GLY 124          1HA       GLY 124  -2.041   8.583  13.942
  946   2HA   GLY 124          2HA       GLY 124  -0.431   9.210  14.266
  947    H    LEU 125           H        LEU 125  -3.684   9.465  15.003
  948    HA   LEU 125           HA       LEU 125  -3.532  12.232  15.890
  949   1HB   LEU 125          1HB       LEU 125  -5.806  10.251  16.058
  950   2HB   LEU 125          2HB       LEU 125  -5.902  11.954  16.463
  951    HG   LEU 125           HG       LEU 125  -5.363  10.831  13.713
  952   1HD1  LEU 125          1HD1      LEU 125  -7.586  11.716  13.181
  953   2HD1  LEU 125          2HD1      LEU 125  -7.654  10.466  14.422
  954   3HD1  LEU 125          3HD1      LEU 125  -7.804  12.164  14.872
  955   1HD2  LEU 125          1HD2      LEU 125  -5.622  13.158  12.967
  956   2HD2  LEU 125          2HD2      LEU 125  -5.721  13.677  14.649
  957   3HD2  LEU 125          3HD2      LEU 125  -4.233  12.957  14.033
  958    H    GLU 126           H        GLU 126  -2.874  12.741  17.834
  959    HA   GLU 126           HA       GLU 126  -2.388  12.701  20.046
  960   1HB   GLU 126          1HB       GLU 126  -4.293  10.356  20.129
  961   2HB   GLU 126          2HB       GLU 126  -3.606  11.143  21.545
  962   1HG   GLU 126          1HG       GLU 126  -4.760  13.160  21.093
  963   2HG   GLU 126          2HG       GLU 126  -5.246  12.599  19.493
  964    H    HIS 127           H        HIS 127  -0.710  11.936  21.232
  965    HA   HIS 127           HA       HIS 127   0.297   9.262  20.621
  966   1HB   HIS 127          1HB       HIS 127   2.585  10.116  20.231
  967   2HB   HIS 127          2HB       HIS 127   1.443  10.657  19.009
  968    HD1  HIS 127           HD1      HIS 127   3.633  11.894  21.771
  969    HD2  HIS 127           HD2      HIS 127   0.962  13.425  18.969
  970    HE1  HIS 127           HE1      HIS 127   3.978  14.388  21.791
  971    HE2  HIS 127           HE2      HIS 127   2.515  15.260  19.930
  972    H    HIS 128           H        HIS 128  -0.021  11.901  22.825
  973    HA   HIS 128           HA       HIS 128   1.598  10.379  24.758
  974   1HB   HIS 128          1HB       HIS 128   2.685  12.514  24.007
  975   2HB   HIS 128          2HB       HIS 128   1.341  13.387  24.734
  976    HD1  HIS 128           HD1      HIS 128   3.003  14.545  26.386
  977    HD2  HIS 128           HD2      HIS 128   2.805  10.400  26.750
  978    HE1  HIS 128           HE1      HIS 128   4.131  13.995  28.567
  979    HE2  HIS 128           HE2      HIS 128   4.067  11.479  28.736
  980    H    HIS 129           H        HIS 129  -1.180  12.611  24.422
  981    HA   HIS 129           HA       HIS 129  -1.806  12.206  27.226
  982   1HB   HIS 129          1HB       HIS 129  -3.451  13.922  27.018
  983   2HB   HIS 129          2HB       HIS 129  -2.017  14.458  26.160
  984    HD1  HIS 129           HD1      HIS 129  -2.260  14.950  23.665
  985    HD2  HIS 129           HD2      HIS 129  -5.701  13.369  25.385
  986    HE1  HIS 129           HE1      HIS 129  -4.083  15.260  21.955
  987    HE2  HIS 129           HE2      HIS 129  -6.162  14.310  23.024
  988    H    HIS 130           H        HIS 130  -2.015   9.904  25.472
  989    HA   HIS 130           HA       HIS 130  -4.817   9.256  26.041
  990   1HB   HIS 130          1HB       HIS 130  -4.215   9.830  23.522
  991   2HB   HIS 130          2HB       HIS 130  -3.618   8.174  23.525
  992    HD1  HIS 130           HD1      HIS 130  -6.598  10.069  22.904
  993    HD2  HIS 130           HD2      HIS 130  -5.767   6.309  24.492
  994    HE1  HIS 130           HE1      HIS 130  -8.750   8.773  22.762
  995    HE2  HIS 130           HE2      HIS 130  -8.275   6.592  23.929
  996    H    HIS 131           H        HIS 131  -2.384   8.670  27.452
  997    HA   HIS 131           HA       HIS 131  -2.166   5.762  27.034
  998   1HB   HIS 131          1HB       HIS 131  -0.009   6.829  26.831
  999   2HB   HIS 131          2HB       HIS 131  -0.247   7.710  28.334
 1000    HD1  HIS 131           HD1      HIS 131   0.252   4.140  27.110
 1001    HD2  HIS 131           HD2      HIS 131   0.693   6.434  30.559
 1002    HE1  HIS 131           HE1      HIS 131   1.421   2.658  28.772
 1003    HE2  HIS 131           HE2      HIS 131   1.578   4.023  30.887
 1004    H    HIS 132           H        HIS 132  -3.808   4.974  28.239
 1005    HA   HIS 132           HA       HIS 132  -4.414   5.882  30.865
 1006   1HB   HIS 132          1HB       HIS 132  -5.760   3.752  31.020
 1007   2HB   HIS 132          2HB       HIS 132  -6.187   4.811  29.684
 1008    HD1  HIS 132           HD1      HIS 132  -5.716   3.968  27.296
 1009    HD2  HIS 132           HD2      HIS 132  -4.706   1.252  30.284
 1010    HE1  HIS 132           HE1      HIS 132  -5.346   1.773  26.123
 1011    HE2  HIS 132           HE2      HIS 132  -4.582   0.185  27.925
  Start of MODEL   14
    1   1H    MET   1          1HT       MET   1  -3.755  25.665 -32.502
    2   2H    MET   1          2HT       MET   1  -4.722  25.697 -31.111
    3   3H    MET   1          3HT       MET   1  -5.008  24.540 -32.314
    4    HA   MET   1           HA       MET   1  -3.901  23.562 -30.425
    5   1HB   MET   1          1HB       MET   1  -2.052  22.489 -31.610
    6   2HB   MET   1          2HB       MET   1  -3.458  22.630 -32.653
    7   1HG   MET   1          1HG       MET   1  -1.122  24.525 -32.718
    8   2HG   MET   1          2HG       MET   1  -1.273  23.106 -33.751
    9   1HE   MET   1          1HE       MET   1  -1.940  26.056 -36.237
   10   2HE   MET   1          2HE       MET   1  -0.961  24.630 -35.895
   11   3HE   MET   1          3HE       MET   1  -0.818  26.062 -34.877
   12    HA   PRO   2           HA       PRO   2  -0.861  26.117 -28.420
   13   1HB   PRO   2          1HB       PRO   2  -0.171  24.456 -26.439
   14   2HB   PRO   2          2HB       PRO   2  -1.779  25.188 -26.499
   15   1HG   PRO   2          1HG       PRO   2  -0.924  22.426 -27.253
   16   2HG   PRO   2          2HG       PRO   2  -2.389  22.956 -26.408
   17   1HD   PRO   2          1HD       PRO   2  -2.250  22.348 -29.106
   18   2HD   PRO   2          2HD       PRO   2  -3.496  23.366 -28.360
   19    H    LEU   3           H        LEU   3   1.463  25.619 -27.405
   20    HA   LEU   3           HA       LEU   3   3.035  24.526 -29.580
   21   1HB   LEU   3          1HB       LEU   3   3.705  26.025 -27.067
   22   2HB   LEU   3          2HB       LEU   3   4.962  25.223 -27.986
   23    HG   LEU   3           HG       LEU   3   4.309  26.596 -29.971
   24   1HD1  LEU   3          1HD1      LEU   3   2.021  27.128 -29.343
   25   2HD1  LEU   3          2HD1      LEU   3   2.602  28.066 -27.969
   26   3HD1  LEU   3          3HD1      LEU   3   2.955  28.598 -29.614
   27   1HD2  LEU   3          1HD2      LEU   3   5.382  28.633 -29.177
   28   2HD2  LEU   3          2HD2      LEU   3   5.115  28.132 -27.507
   29   3HD2  LEU   3          3HD2      LEU   3   6.195  27.201 -28.545
   30    H    ASN   4           H        ASN   4   1.760  22.473 -28.840
   31    HA   ASN   4           HA       ASN   4   1.868  20.316 -28.208
   32   1HB   ASN   4          1HB       ASN   4   4.791  20.988 -27.920
   33   2HB   ASN   4          2HB       ASN   4   4.156  19.369 -27.651
   34   1HD2  ASN   4          2HD2      ASN   4   5.224  18.435 -29.334
   35   2HD2  ASN   4          1HD2      ASN   4   4.864  18.767 -30.991
   36    H    GLN   5           H        GLN   5   4.378  21.408 -25.963
   37    HA   GLN   5           HA       GLN   5   4.629  21.117 -23.735
   38   1HB   GLN   5          1HB       GLN   5   1.635  21.511 -23.574
   39   2HB   GLN   5          2HB       GLN   5   2.802  21.745 -22.279
   40   1HG   GLN   5          1HG       GLN   5   3.844  23.548 -23.651
   41   2HG   GLN   5          2HG       GLN   5   2.504  23.378 -24.783
   42   1HE2  GLN   5          2HE2      GLN   5   3.275  25.676 -23.243
   43   2HE2  GLN   5          1HE2      GLN   5   1.914  26.089 -22.248
   44    H    GLU   6           H        GLU   6   5.108  18.906 -24.459
   45    HA   GLU   6           HA       GLU   6   3.217  16.953 -23.331
   46   1HB   GLU   6          1HB       GLU   6   4.922  16.539 -25.796
   47   2HB   GLU   6          2HB       GLU   6   3.740  15.419 -25.133
   48   1HG   GLU   6          1HG       GLU   6   1.945  16.955 -25.662
   49   2HG   GLU   6          2HG       GLU   6   3.108  18.139 -26.257
   50    H    HIS   7           H        HIS   7   4.795  14.701 -23.726
   51    HA   HIS   7           HA       HIS   7   6.517  13.485 -22.897
   52   1HB   HIS   7          1HB       HIS   7   7.880  16.167 -22.593
   53   2HB   HIS   7          2HB       HIS   7   8.644  14.639 -22.164
   54    HD1  HIS   7           HD1      HIS   7   9.773  13.379 -24.011
   55    HD2  HIS   7           HD2      HIS   7   7.269  16.381 -25.434
   56    HE1  HIS   7           HE1      HIS   7  10.178  13.482 -26.489
   57    HE2  HIS   7           HE2      HIS   7   8.496  15.147 -27.351
   58    HA   PRO   8           HA       PRO   8   5.017  13.377 -18.787
   59   1HB   PRO   8          1HB       PRO   8   6.946  11.235 -18.277
   60   2HB   PRO   8          2HB       PRO   8   5.184  11.164 -18.326
   61   1HG   PRO   8          1HG       PRO   8   6.728  10.044 -20.237
   62   2HG   PRO   8          2HG       PRO   8   5.131  10.730 -20.584
   63   1HD   PRO   8          1HD       PRO   8   7.843  11.900 -21.063
   64   2HD   PRO   8          2HD       PRO   8   6.397  11.947 -22.093
   65    H    ASP   9           H        ASP   9   5.543  14.776 -17.249
   66    HA   ASP   9           HA       ASP   9   8.338  14.907 -16.360
   67   1HB   ASP   9          1HB       ASP   9   7.745  17.076 -15.322
   68   2HB   ASP   9          2HB       ASP   9   7.490  17.078 -17.061
   69    H    TYR  10           H        TYR  10   8.822  13.940 -14.515
   70    HA   TYR  10           HA       TYR  10   6.604  12.932 -12.926
   71   1HB   TYR  10          1HB       TYR  10   8.302  11.477 -11.827
   72   2HB   TYR  10          2HB       TYR  10   8.168  11.233 -13.560
   73    HD1  TYR  10           HD1      TYR  10  10.372  11.889 -10.836
   74    HD2  TYR  10           HD2      TYR  10   9.961  12.338 -15.049
   75    HE1  TYR  10           HE1      TYR  10  12.807  12.136 -11.042
   76    HE2  TYR  10           HE2      TYR  10  12.398  12.592 -15.263
   77    HH   TYR  10           HH       TYR  10  14.550  11.823 -12.751
   78    H    THR  11           H        THR  11   6.020  14.878 -11.981
   79    HA   THR  11           HA       THR  11   7.884  16.108 -10.116
   80    HB   THR  11           HB       THR  11   6.415  17.539 -11.506
   81    HG1  THR  11           HG1      THR  11   6.161  17.606  -8.678
   82   1HG2  THR  11          1HG2      THR  11   4.021  17.691 -11.002
   83   2HG2  THR  11          2HG2      THR  11   4.450  16.088 -11.603
   84   3HG2  THR  11          3HG2      THR  11   4.171  16.338  -9.880
   85    H    TYR  12           H        TYR  12   6.165  13.408 -10.013
   86    HA   TYR  12           HA       TYR  12   5.051  13.787  -7.332
   87   1HB   TYR  12          1HB       TYR  12   4.791  11.404  -9.180
   88   2HB   TYR  12          2HB       TYR  12   3.916  11.659  -7.676
   89    HD1  TYR  12           HD1      TYR  12   2.375  13.738  -7.565
   90    HD2  TYR  12           HD2      TYR  12   3.875  12.109 -11.197
   91    HE1  TYR  12           HE1      TYR  12   0.568  14.856  -8.805
   92    HE2  TYR  12           HE2      TYR  12   2.077  13.225 -12.449
   93    HH   TYR  12           HH       TYR  12  -0.258  14.075 -11.945
   94    H    ALA  13           H        ALA  13   6.576  13.548  -5.822
   95    HA   ALA  13           HA       ALA  13   8.043  11.021  -5.758
   96   1HB   ALA  13          1HB       ALA  13   9.367  13.702  -5.338
   97   2HB   ALA  13          2HB       ALA  13  10.131  12.123  -5.156
   98   3HB   ALA  13          3HB       ALA  13   9.584  12.661  -6.746
   99    H    LEU  14           H        LEU  14   8.692  10.391  -3.638
  100    HA   LEU  14           HA       LEU  14   6.856  11.097  -1.611
  101   1HB   LEU  14          1HB       LEU  14   9.379   9.465  -1.606
  102   2HB   LEU  14          2HB       LEU  14   8.504   9.788  -0.122
  103    HG   LEU  14           HG       LEU  14   7.860   7.627  -0.883
  104   1HD1  LEU  14          1HD1      LEU  14   5.450   7.895  -1.210
  105   2HD1  LEU  14          2HD1      LEU  14   6.068   8.968   0.048
  106   3HD1  LEU  14          3HD1      LEU  14   5.693   9.609  -1.552
  107   1HD2  LEU  14          1HD2      LEU  14   7.192   8.895  -3.537
  108   2HD2  LEU  14          2HD2      LEU  14   8.543   7.809  -3.211
  109   3HD2  LEU  14          3HD2      LEU  14   6.885   7.217  -3.089
  110    H    ARG  15           H        ARG  15  10.299  11.809  -2.045
  111    HA   ARG  15           HA       ARG  15  11.535  13.634  -1.540
  112   1HB   ARG  15          1HB       ARG  15   9.479  14.863  -2.323
  113   2HB   ARG  15          2HB       ARG  15   8.988  14.982  -0.638
  114   1HG   ARG  15          1HG       ARG  15  10.951  16.282  -0.114
  115   2HG   ARG  15          2HG       ARG  15  11.562  16.077  -1.756
  116   1HD   ARG  15          1HD       ARG  15   9.489  17.234  -2.568
  117   2HD   ARG  15          2HD       ARG  15   9.106  17.591  -0.885
  118    HE   ARG  15           HE       ARG  15  11.646  18.525  -1.183
  119   1HH1  ARG  15          1HH1      ARG  15   8.608  19.102  -2.853
  120   2HH1  ARG  15          2HH1      ARG  15   9.056  20.700  -3.374
  121   1HH2  ARG  15          1HH2      ARG  15  12.220  20.625  -1.853
  122   2HH2  ARG  15          2HH2      ARG  15  11.114  21.562  -2.806
  123    H    ALA  16           H        ALA  16   9.010  13.692   0.978
  124    HA   ALA  16           HA       ALA  16  11.105  13.243   2.989
  125   1HB   ALA  16          1HB       ALA  16  10.650  15.648   2.945
  126   2HB   ALA  16          2HB       ALA  16   8.933  15.332   3.193
  127   3HB   ALA  16          3HB       ALA  16  10.096  14.924   4.454
  128    H    ALA  17           H        ALA  17  10.566  11.268   3.662
  129    HA   ALA  17           HA       ALA  17   7.783  10.810   4.512
  130   1HB   ALA  17          1HB       ALA  17   7.991   8.480   3.793
  131   2HB   ALA  17          2HB       ALA  17   8.231   9.587   2.442
  132   3HB   ALA  17          3HB       ALA  17   9.619   8.805   3.197
  133    H    ASP  18           H        ASP  18   7.829  10.783   6.669
  134    HA   ASP  18           HA       ASP  18  10.132   9.557   8.003
  135   1HB   ASP  18          1HB       ASP  18   9.112  10.648  10.091
  136   2HB   ASP  18          2HB       ASP  18   9.858  11.702   8.898
  137    H    GLY  19           H        GLY  19   6.636   9.761   8.654
  138   1HA   GLY  19          1HA       GLY  19   5.989   7.098   8.555
  139   2HA   GLY  19          2HA       GLY  19   6.667   7.329  10.161
  140    H    ARG  20           H        ARG  20   5.613  10.184  10.073
  141    HA   ARG  20           HA       ARG  20   2.890   9.483  10.911
  142   1HB   ARG  20          1HB       ARG  20   4.331  12.106  11.342
  143   2HB   ARG  20          2HB       ARG  20   2.847  11.568  12.117
  144   1HG   ARG  20          1HG       ARG  20   4.265   9.643  13.045
  145   2HG   ARG  20          2HG       ARG  20   5.650  10.629  12.580
  146   1HD   ARG  20          1HD       ARG  20   3.461  11.324  14.524
  147   2HD   ARG  20          2HD       ARG  20   5.168  11.076  14.873
  148    HE   ARG  20           HE       ARG  20   4.203  13.335  13.238
  149   1HH1  ARG  20          1HH1      ARG  20   6.217  12.043  15.790
  150   2HH1  ARG  20          2HH1      ARG  20   6.924  13.579  16.188
  151   1HH2  ARG  20          1HH2      ARG  20   5.088  15.363  13.782
  152   2HH2  ARG  20          2HH2      ARG  20   6.263  15.469  15.063
  153    H    HIS  21           H        HIS  21   4.661  11.107   8.465
  154    HA   HIS  21           HA       HIS  21   2.279  11.444   6.912
  155   1HB   HIS  21          1HB       HIS  21   2.609  13.875   6.468
  156   2HB   HIS  21          2HB       HIS  21   2.107  13.530   8.115
  157    HD1  HIS  21           HD1      HIS  21   3.242  15.023   9.695
  158    HD2  HIS  21           HD2      HIS  21   5.715  14.033   6.500
  159    HE1  HIS  21           HE1      HIS  21   5.413  16.213  10.121
  160    HE2  HIS  21           HE2      HIS  21   6.958  15.403   8.310
  161    H    ALA  22           H        ALA  22   2.729  12.008   4.697
  162    HA   ALA  22           HA       ALA  22   5.578  11.953   3.949
  163   1HB   ALA  22          1HB       ALA  22   3.362  10.436   2.566
  164   2HB   ALA  22          2HB       ALA  22   5.038  10.530   2.028
  165   3HB   ALA  22          3HB       ALA  22   4.644   9.724   3.547
  166    H    LYS  23           H        LYS  23   6.114  13.570   2.562
  167    HA   LYS  23           HA       LYS  23   3.882  15.233   1.630
  168   1HB   LYS  23          1HB       LYS  23   5.595  16.295   3.089
  169   2HB   LYS  23          2HB       LYS  23   6.802  15.978   1.847
  170   1HG   LYS  23          1HG       LYS  23   5.602  17.389   0.283
  171   2HG   LYS  23          2HG       LYS  23   4.340  17.671   1.482
  172   1HD   LYS  23          1HD       LYS  23   6.088  18.671   2.963
  173   2HD   LYS  23          2HD       LYS  23   7.222  18.542   1.614
  174   1HE   LYS  23          1HE       LYS  23   5.720  19.922   0.247
  175   2HE   LYS  23          2HE       LYS  23   4.629  20.078   1.621
  176   1HZ   LYS  23          1HZ       LYS  23   7.421  21.069   1.474
  177   2HZ   LYS  23          2HZ       LYS  23   6.013  22.012   1.430
  178   3HZ   LYS  23          3HZ       LYS  23   6.426  21.169   2.845
  179    H    VAL  24           H        VAL  24   3.272  14.557  -0.329
  180    HA   VAL  24           HA       VAL  24   5.266  13.685  -2.262
  181    HB   VAL  24           HB       VAL  24   2.255  13.822  -2.548
  182   1HG1  VAL  24          1HG1      VAL  24   3.402  13.833  -4.695
  183   2HG1  VAL  24          2HG1      VAL  24   4.330  12.410  -4.222
  184   3HG1  VAL  24          3HG1      VAL  24   2.584  12.293  -4.436
  185   1HG2  VAL  24          1HG2      VAL  24   4.031  11.496  -1.823
  186   2HG2  VAL  24          2HG2      VAL  24   2.869  12.295  -0.766
  187   3HG2  VAL  24          3HG2      VAL  24   2.306  11.390  -2.171
  188    H    ASN  25           H        ASN  25   6.228  15.119  -3.461
  189    HA   ASN  25           HA       ASN  25   6.716  16.931  -4.726
  190   1HB   ASN  25          1HB       ASN  25   4.725  16.325  -6.058
  191   2HB   ASN  25          2HB       ASN  25   3.718  17.285  -4.979
  192   1HD2  ASN  25          2HD2      ASN  25   3.026  18.712  -6.514
  193   2HD2  ASN  25          1HD2      ASN  25   4.066  19.875  -7.279
  194    H    GLU  26           H        GLU  26   3.720  18.249  -3.391
  195    HA   GLU  26           HA       GLU  26   5.253  19.942  -1.567
  196   1HB   GLU  26          1HB       GLU  26   4.966  21.127  -3.773
  197   2HB   GLU  26          2HB       GLU  26   3.230  21.070  -3.512
  198   1HG   GLU  26          1HG       GLU  26   4.203  23.241  -2.929
  199   2HG   GLU  26          2HG       GLU  26   3.435  22.456  -1.550
  200    H    GLN  27           H        GLN  27   2.952  17.756  -1.843
  201    HA   GLN  27           HA       GLN  27   1.038  19.102  -0.059
  202   1HB   GLN  27          1HB       GLN  27   0.661  16.654  -1.794
  203   2HB   GLN  27          2HB       GLN  27  -0.560  17.338  -0.731
  204   1HG   GLN  27          1HG       GLN  27  -0.519  19.413  -2.041
  205   2HG   GLN  27          2HG       GLN  27   0.668  18.687  -3.124
  206   1HE2  GLN  27          2HE2      GLN  27   0.022  17.092  -4.559
  207   2HE2  GLN  27          1HE2      GLN  27  -1.642  16.776  -4.901
  208    H    ILE  28           H        ILE  28   1.098  18.542   2.016
  209    HA   ILE  28           HA       ILE  28   2.667  16.225   2.817
  210    HB   ILE  28           HB       ILE  28   1.260  18.253   4.568
  211   1HG1  ILE  28          1HG1      ILE  28   4.152  18.087   3.684
  212   2HG1  ILE  28          2HG1      ILE  28   2.988  19.313   3.193
  213   1HG2  ILE  28          1HG2      ILE  28   3.345  16.169   5.211
  214   2HG2  ILE  28          2HG2      ILE  28   2.753  17.394   6.332
  215   3HG2  ILE  28          3HG2      ILE  28   1.657  16.154   5.719
  216   1HD1  ILE  28          1HD1      ILE  28   4.014  18.875   5.989
  217   2HD1  ILE  28          2HD1      ILE  28   4.512  20.157   4.885
  218   3HD1  ILE  28          3HD1      ILE  28   2.856  20.110   5.493
  219    H    LEU  29           H        LEU  29   1.569  14.379   2.516
  220    HA   LEU  29           HA       LEU  29  -1.251  14.252   3.238
  221   1HB   LEU  29          1HB       LEU  29   0.553  12.216   1.930
  222   2HB   LEU  29          2HB       LEU  29  -1.164  12.002   2.214
  223    HG   LEU  29           HG       LEU  29   0.066  14.095   0.416
  224   1HD1  LEU  29          1HD1      LEU  29  -1.455  11.576  -0.241
  225   2HD1  LEU  29          2HD1      LEU  29  -0.921  12.793  -1.400
  226   3HD1  LEU  29          3HD1      LEU  29   0.268  11.850  -0.503
  227   1HD2  LEU  29          1HD2      LEU  29  -2.007  14.864   1.447
  228   2HD2  LEU  29          2HD2      LEU  29  -2.235  14.547  -0.273
  229   3HD2  LEU  29          3HD2      LEU  29  -2.824  13.392   0.922
  230    H    GLN  30           H        GLN  30  -1.524  14.061   5.351
  231    HA   GLN  30           HA       GLN  30  -0.021  11.981   6.787
  232   1HB   GLN  30          1HB       GLN  30  -0.887  13.162   8.851
  233   2HB   GLN  30          2HB       GLN  30   0.261  14.073   7.882
  234   1HG   GLN  30          1HG       GLN  30  -1.614  15.305   6.866
  235   2HG   GLN  30          2HG       GLN  30  -2.728  14.429   7.915
  236   1HE2  GLN  30          2HE2      GLN  30  -3.426  16.334   8.885
  237   2HE2  GLN  30          1HE2      GLN  30  -2.450  17.206  10.016
  238    H    GLN  31           H        GLN  31  -1.810  10.960   5.166
  239    HA   GLN  31           HA       GLN  31  -4.013  10.089   6.885
  240   1HB   GLN  31          1HB       GLN  31  -4.323  11.007   4.016
  241   2HB   GLN  31          2HB       GLN  31  -5.581  10.235   4.968
  242   1HG   GLN  31          1HG       GLN  31  -5.713  12.101   6.441
  243   2HG   GLN  31          2HG       GLN  31  -4.284  12.842   5.719
  244   1HE2  GLN  31          2HE2      GLN  31  -6.719  11.251   3.806
  245   2HE2  GLN  31          1HE2      GLN  31  -7.350  12.679   3.065
  246    H    SER  32           H        SER  32  -5.255   8.313   5.413
  247    HA   SER  32           HA       SER  32  -3.233   6.419   4.517
  248   1HB   SER  32          1HB       SER  32  -6.228   6.040   4.778
  249   2HB   SER  32          2HB       SER  32  -5.014   4.776   4.580
  250    HG   SER  32           HG       SER  32  -5.921   5.575   6.826
  251    H    PHE  33           H        PHE  33  -2.640   6.567   2.436
  252    HA   PHE  33           HA       PHE  33  -4.726   7.124   0.448
  253   1HB   PHE  33          1HB       PHE  33  -3.241   8.665  -0.755
  254   2HB   PHE  33          2HB       PHE  33  -3.618   9.249   0.859
  255    HD1  PHE  33           HD1      PHE  33  -1.013   8.167  -1.411
  256    HD2  PHE  33           HD2      PHE  33  -1.894   9.186   2.628
  257    HE1  PHE  33           HE1      PHE  33   1.388   8.469  -0.964
  258    HE2  PHE  33           HE2      PHE  33   0.506   9.486   3.079
  259    HZ   PHE  33           HZ       PHE  33   2.149   9.130   1.282
  260    H    ILE  34           H        ILE  34  -4.366   6.360  -1.622
  261    HA   ILE  34           HA       ILE  34  -2.386   4.188  -1.784
  262    HB   ILE  34           HB       ILE  34  -4.847   4.598  -3.494
  263   1HG1  ILE  34          1HG1      ILE  34  -4.466   2.677  -1.185
  264   2HG1  ILE  34          2HG1      ILE  34  -5.374   4.182  -1.083
  265   1HG2  ILE  34          1HG2      ILE  34  -4.474   2.265  -4.153
  266   2HG2  ILE  34          2HG2      ILE  34  -3.097   3.285  -4.570
  267   3HG2  ILE  34          3HG2      ILE  34  -3.014   2.222  -3.164
  268   1HD1  ILE  34          1HD1      ILE  34  -6.029   1.845  -2.862
  269   2HD1  ILE  34          2HD1      ILE  34  -6.847   2.275  -1.360
  270   3HD1  ILE  34          3HD1      ILE  34  -6.940   3.351  -2.754
  271    H    LEU  35           H        LEU  35  -0.620   4.708  -2.896
  272    HA   LEU  35           HA       LEU  35  -0.832   6.728  -5.021
  273   1HB   LEU  35          1HB       LEU  35   0.716   7.302  -3.239
  274   2HB   LEU  35          2HB       LEU  35   1.557   5.778  -3.441
  275    HG   LEU  35           HG       LEU  35   2.289   6.487  -5.688
  276   1HD1  LEU  35          1HD1      LEU  35   0.980   9.108  -4.981
  277   2HD1  LEU  35          2HD1      LEU  35   1.997   8.805  -6.389
  278   3HD1  LEU  35          3HD1      LEU  35   0.444   7.984  -6.230
  279   1HD2  LEU  35          1HD2      LEU  35   3.745   6.880  -3.794
  280   2HD2  LEU  35          2HD2      LEU  35   3.876   8.211  -4.944
  281   3HD2  LEU  35          3HD2      LEU  35   2.941   8.415  -3.464
  282    H    MET  36           H        MET  36  -0.925   5.966  -7.001
  283    HA   MET  36           HA       MET  36   0.779   3.673  -7.705
  284   1HB   MET  36          1HB       MET  36  -1.968   4.336  -8.792
  285   2HB   MET  36          2HB       MET  36  -0.920   3.074  -9.422
  286   1HG   MET  36          1HG       MET  36  -0.986   1.995  -7.180
  287   2HG   MET  36          2HG       MET  36  -2.182   3.195  -6.696
  288   1HE   MET  36          1HE       MET  36  -1.736   1.372 -10.175
  289   2HE   MET  36          2HE       MET  36  -2.836   0.008  -9.969
  290   3HE   MET  36          3HE       MET  36  -1.382   0.128  -8.975
  291    HA   PRO  37           HA       PRO  37   2.874   5.931 -10.795
  292   1HB   PRO  37          1HB       PRO  37   1.664   4.211 -12.912
  293   2HB   PRO  37          2HB       PRO  37   3.359   4.611 -12.616
  294   1HG   PRO  37          1HG       PRO  37   2.405   2.237 -11.919
  295   2HG   PRO  37          2HG       PRO  37   3.550   3.092 -10.870
  296   1HD   PRO  37          1HD       PRO  37   0.603   2.740 -10.574
  297   2HD   PRO  37          2HD       PRO  37   1.866   2.790  -9.328
  298    H    ASP  38           H        ASP  38  -0.531   5.348 -11.602
  299    HA   ASP  38           HA       ASP  38  -0.509   7.924 -13.040
  300   1HB   ASP  38          1HB       ASP  38  -0.887   6.176 -14.640
  301   2HB   ASP  38          2HB       ASP  38  -2.117   5.435 -13.626
  302    H    GLU  39           H        GLU  39  -2.167   5.893 -10.734
  303    HA   GLU  39           HA       GLU  39  -4.226   7.973 -10.427
  304   1HB   GLU  39          1HB       GLU  39  -4.884   5.625 -11.178
  305   2HB   GLU  39          2HB       GLU  39  -4.472   5.103  -9.553
  306   1HG   GLU  39          1HG       GLU  39  -6.202   6.383  -8.594
  307   2HG   GLU  39          2HG       GLU  39  -6.472   7.275 -10.094
  308    H    LEU  40           H        LEU  40  -4.481   8.951  -8.525
  309    HA   LEU  40           HA       LEU  40  -3.110   7.841  -6.174
  310   1HB   LEU  40          1HB       LEU  40  -1.806   9.718  -6.930
  311   2HB   LEU  40          2HB       LEU  40  -3.239  10.716  -7.081
  312    HG   LEU  40           HG       LEU  40  -3.520  10.669  -4.628
  313   1HD1  LEU  40          1HD1      LEU  40  -0.883   9.210  -4.634
  314   2HD1  LEU  40          2HD1      LEU  40  -1.728   9.823  -3.214
  315   3HD1  LEU  40          3HD1      LEU  40  -2.443   8.528  -4.174
  316   1HD2  LEU  40          1HD2      LEU  40  -2.301  12.495  -5.699
  317   2HD2  LEU  40          2HD2      LEU  40  -1.648  12.136  -4.100
  318   3HD2  LEU  40          3HD2      LEU  40  -0.798  11.586  -5.544
  319    H    VAL  41           H        VAL  41  -4.562   7.289  -4.710
  320    HA   VAL  41           HA       VAL  41  -7.006   8.926  -4.467
  321    HB   VAL  41           HB       VAL  41  -6.671   6.034  -3.639
  322   1HG1  VAL  41          1HG1      VAL  41  -9.109   6.069  -3.382
  323   2HG1  VAL  41          2HG1      VAL  41  -8.323   7.232  -2.314
  324   3HG1  VAL  41          3HG1      VAL  41  -9.123   7.787  -3.785
  325   1HG2  VAL  41          1HG2      VAL  41  -8.067   7.186  -6.054
  326   2HG2  VAL  41          2HG2      VAL  41  -6.588   6.226  -6.062
  327   3HG2  VAL  41          3HG2      VAL  41  -8.110   5.495  -5.553
  328    H    GLU  42           H        GLU  42  -6.322  10.389  -2.953
  329    HA   GLU  42           HA       GLU  42  -4.908   9.470  -0.594
  330   1HB   GLU  42          1HB       GLU  42  -4.502  11.737  -0.098
  331   2HB   GLU  42          2HB       GLU  42  -4.387  11.622  -1.845
  332   1HG   GLU  42          1HG       GLU  42  -6.651  12.765  -0.230
  333   2HG   GLU  42          2HG       GLU  42  -5.538  13.630  -1.283
  334    H    HIS  43           H        HIS  43  -8.074   9.634  -1.500
  335    HA   HIS  43           HA       HIS  43  -8.979  10.045   1.257
  336   1HB   HIS  43          1HB       HIS  43 -11.290  10.253   0.235
  337   2HB   HIS  43          2HB       HIS  43 -10.168  11.555  -0.124
  338    HD1  HIS  43           HD1      HIS  43  -9.323  11.760  -2.573
  339    HD2  HIS  43           HD2      HIS  43 -12.189   8.800  -1.970
  340    HE1  HIS  43           HE1      HIS  43 -10.135  11.117  -4.866
  341    HE2  HIS  43           HE2      HIS  43 -12.052   9.540  -4.448
  342    H    TRP  44           H        TRP  44  -8.144   7.932   1.737
  343    HA   TRP  44           HA       TRP  44  -9.985   5.786   0.921
  344   1HB   TRP  44          1HB       TRP  44  -7.543   5.448   0.438
  345   2HB   TRP  44          2HB       TRP  44  -7.235   5.525   2.168
  346    HD1  TRP  44           HD1      TRP  44 -10.275   3.589   0.910
  347    HE1  TRP  44           HE1      TRP  44  -9.891   1.078   1.328
  348    HE3  TRP  44           HE3      TRP  44  -5.376   3.757   2.359
  349    HZ2  TRP  44           HZ2      TRP  44  -7.779  -0.607   2.148
  350    HZ3  TRP  44           HZ3      TRP  44  -4.245   1.650   2.938
  351    HH2  TRP  44           HH2      TRP  44  -5.422  -0.486   2.834
  352    HA   PRO  45           HA       PRO  45 -11.642   6.529   4.994
  353   1HB   PRO  45          1HB       PRO  45 -13.322   4.184   4.446
  354   2HB   PRO  45          2HB       PRO  45 -13.790   5.864   4.719
  355   1HG   PRO  45          1HG       PRO  45 -13.974   4.723   2.296
  356   2HG   PRO  45          2HG       PRO  45 -13.549   6.432   2.496
  357   1HD   PRO  45          1HD       PRO  45 -11.762   4.088   1.945
  358   2HD   PRO  45          2HD       PRO  45 -11.738   5.715   1.229
  359    H    VAL  46           H        VAL  46  -9.346   5.497   5.499
  360    HA   VAL  46           HA       VAL  46  -9.977   3.356   7.412
  361    HB   VAL  46           HB       VAL  46  -7.411   3.528   5.806
  362   1HG1  VAL  46          1HG1      VAL  46  -6.771   1.469   6.958
  363   2HG1  VAL  46          2HG1      VAL  46  -7.014   2.792   8.101
  364   3HG1  VAL  46          3HG1      VAL  46  -8.247   1.544   7.921
  365   1HG2  VAL  46          1HG2      VAL  46  -9.596   1.447   5.769
  366   2HG2  VAL  46          2HG2      VAL  46  -9.259   2.621   4.496
  367   3HG2  VAL  46          3HG2      VAL  46  -8.077   1.368   4.874
  368    HA   PRO  47           HA       PRO  47  -8.394   6.953   9.725
  369   1HB   PRO  47          1HB       PRO  47  -9.613   5.506  11.982
  370   2HB   PRO  47          2HB       PRO  47  -9.913   7.148  11.408
  371   1HG   PRO  47          1HG       PRO  47 -11.719   5.190  11.071
  372   2HG   PRO  47          2HG       PRO  47 -11.484   6.464   9.858
  373   1HD   PRO  47          1HD       PRO  47 -10.480   3.639   9.859
  374   2HD   PRO  47          2HD       PRO  47 -11.162   4.590   8.523
  375    H    SER  48           H        SER  48  -8.208   3.547  10.664
  376    HA   SER  48           HA       SER  48  -5.402   3.809  11.227
  377   1HB   SER  48          1HB       SER  48  -7.324   3.078  13.449
  378   2HB   SER  48          2HB       SER  48  -5.577   2.859  13.531
  379    HG   SER  48           HG       SER  48  -6.270   5.384  12.769
  380    H    LEU  49           H        LEU  49  -4.509   1.632  11.951
  381    HA   LEU  49           HA       LEU  49  -5.203  -0.265   9.990
  382   1HB   LEU  49          1HB       LEU  49  -3.482  -0.575  12.449
  383   2HB   LEU  49          2HB       LEU  49  -3.520  -1.683  11.089
  384    HG   LEU  49           HG       LEU  49  -2.683   1.211  10.898
  385   1HD1  LEU  49          1HD1      LEU  49  -0.410   0.357  10.706
  386   2HD1  LEU  49          2HD1      LEU  49  -1.119  -0.060  12.266
  387   3HD1  LEU  49          3HD1      LEU  49  -0.993  -1.281  11.001
  388   1HD2  LEU  49          1HD2      LEU  49  -3.582   0.295   8.826
  389   2HD2  LEU  49          2HD2      LEU  49  -1.842   0.558   8.701
  390   3HD2  LEU  49          3HD2      LEU  49  -2.474  -1.072   8.940
  391    H    GLY  50           H        GLY  50  -6.466   0.278  13.114
  392   1HA   GLY  50          1HA       GLY  50  -7.330  -2.366  13.720
  393   2HA   GLY  50          2HA       GLY  50  -7.963  -0.883  14.421
  394    H    GLN  51           H        GLN  51  -8.340  -0.141  11.390
  395    HA   GLN  51           HA       GLN  51 -10.880  -1.593  11.059
  396   1HB   GLN  51          1HB       GLN  51 -10.195   1.268  10.362
  397   2HB   GLN  51          2HB       GLN  51 -11.660   0.458   9.823
  398   1HG   GLN  51          1HG       GLN  51 -12.349   0.136  12.134
  399   2HG   GLN  51          2HG       GLN  51 -10.868   0.913  12.691
  400   1HE2  GLN  51          2HE2      GLN  51 -12.018   2.496  13.785
  401   2HE2  GLN  51          1HE2      GLN  51 -12.835   3.784  12.949
  402    H    LEU  52           H        LEU  52  -8.026  -2.000  10.064
  403    HA   LEU  52           HA       LEU  52  -8.283  -1.682   7.205
  404   1HB   LEU  52          1HB       LEU  52  -6.092  -1.513   8.394
  405   2HB   LEU  52          2HB       LEU  52  -6.201  -3.224   8.756
  406    HG   LEU  52           HG       LEU  52  -6.127  -3.750   6.362
  407   1HD1  LEU  52          1HD1      LEU  52  -5.810  -0.774   5.997
  408   2HD1  LEU  52          2HD1      LEU  52  -5.614  -1.991   4.736
  409   3HD1  LEU  52          3HD1      LEU  52  -7.191  -1.747   5.488
  410   1HD2  LEU  52          1HD2      LEU  52  -3.903  -1.918   7.256
  411   2HD2  LEU  52          2HD2      LEU  52  -4.047  -3.636   7.634
  412   3HD2  LEU  52          3HD2      LEU  52  -3.803  -3.117   5.966
  413    H    GLN  53           H        GLN  53 -10.360  -2.844   7.382
  414    HA   GLN  53           HA       GLN  53 -10.063  -5.768   7.272
  415   1HB   GLN  53          1HB       GLN  53 -12.491  -3.999   7.676
  416   2HB   GLN  53          2HB       GLN  53 -12.567  -5.747   7.506
  417   1HG   GLN  53          1HG       GLN  53 -10.909  -4.448   9.635
  418   2HG   GLN  53          2HG       GLN  53 -12.630  -4.762   9.859
  419   1HE2  GLN  53          2HE2      GLN  53 -12.118  -6.170  11.571
  420   2HE2  GLN  53          1HE2      GLN  53 -11.539  -7.769  11.267
  421    HA   PRO  54           HA       PRO  54 -10.924  -5.748   2.924
  422   1HB   PRO  54          1HB       PRO  54 -12.764  -7.747   2.612
  423   2HB   PRO  54          2HB       PRO  54 -11.037  -8.028   2.855
  424   1HG   PRO  54          1HG       PRO  54 -13.282  -8.202   4.803
  425   2HG   PRO  54          2HG       PRO  54 -11.835  -9.212   4.661
  426   1HD   PRO  54          1HD       PRO  54 -12.125  -7.248   6.531
  427   2HD   PRO  54          2HD       PRO  54 -10.555  -7.762   5.887
  428    H    ALA  55           H        ALA  55 -13.327  -5.056   5.194
  429    HA   ALA  55           HA       ALA  55 -15.364  -4.283   3.298
  430   1HB   ALA  55          1HB       ALA  55 -15.981  -5.044   5.538
  431   2HB   ALA  55          2HB       ALA  55 -15.116  -3.680   6.246
  432   3HB   ALA  55          3HB       ALA  55 -16.541  -3.398   5.246
  433    H    HIS  56           H        HIS  56 -12.440  -3.021   4.233
  434    HA   HIS  56           HA       HIS  56 -13.235  -0.321   3.348
  435   1HB   HIS  56          1HB       HIS  56 -11.151  -1.064   5.416
  436   2HB   HIS  56          2HB       HIS  56 -11.295   0.542   4.712
  437    HD1  HIS  56           HD1      HIS  56 -12.712   2.125   6.002
  438    HD2  HIS  56           HD2      HIS  56 -13.656  -1.845   6.818
  439    HE1  HIS  56           HE1      HIS  56 -14.453   2.196   7.817
  440    HE2  HIS  56           HE2      HIS  56 -15.114  -0.212   8.190
  441    H    MET  57           H        MET  57 -10.839  -2.876   3.343
  442    HA   MET  57           HA       MET  57  -9.148  -1.505   1.426
  443   1HB   MET  57          1HB       MET  57  -8.264  -2.924   3.317
  444   2HB   MET  57          2HB       MET  57  -8.907  -4.329   2.482
  445   1HG   MET  57          1HG       MET  57  -7.444  -3.892   0.588
  446   2HG   MET  57          2HG       MET  57  -6.818  -2.453   1.392
  447   1HE   MET  57          1HE       MET  57  -4.315  -3.317   1.093
  448   2HE   MET  57          2HE       MET  57  -4.939  -4.735   0.249
  449   3HE   MET  57          3HE       MET  57  -3.785  -4.931   1.568
  450    H    ASP  58           H        ASP  58 -12.002  -2.879   1.102
  451    HA   ASP  58           HA       ASP  58 -11.835  -4.930  -0.772
  452   1HB   ASP  58          1HB       ASP  58 -13.915  -4.346   0.360
  453   2HB   ASP  58          2HB       ASP  58 -13.962  -2.798  -0.478
  454    H    ALA  59           H        ALA  59 -11.885  -1.436  -1.237
  455    HA   ALA  59           HA       ALA  59 -12.068  -1.356  -4.018
  456   1HB   ALA  59          1HB       ALA  59 -10.596   0.556  -2.206
  457   2HB   ALA  59          2HB       ALA  59 -11.124   0.884  -3.857
  458   3HB   ALA  59          3HB       ALA  59 -12.317   0.614  -2.587
  459    H    VAL  60           H        VAL  60  -9.261  -1.753  -1.919
  460    HA   VAL  60           HA       VAL  60  -7.321  -1.563  -3.999
  461    HB   VAL  60           HB       VAL  60  -7.010  -2.926  -1.318
  462   1HG1  VAL  60          1HG1      VAL  60  -4.634  -2.380  -1.598
  463   2HG1  VAL  60          2HG1      VAL  60  -5.223  -3.429  -2.889
  464   3HG1  VAL  60          3HG1      VAL  60  -4.982  -1.709  -3.191
  465   1HG2  VAL  60          1HG2      VAL  60  -6.156  -0.783  -0.494
  466   2HG2  VAL  60          2HG2      VAL  60  -6.560  -0.031  -2.038
  467   3HG2  VAL  60          3HG2      VAL  60  -7.841  -0.658  -1.002
  468    H    LEU  61           H        LEU  61  -9.023  -4.210  -2.411
  469    HA   LEU  61           HA       LEU  61  -7.583  -6.324  -3.614
  470   1HB   LEU  61          1HB       LEU  61 -10.427  -6.304  -2.596
  471   2HB   LEU  61          2HB       LEU  61  -9.470  -7.735  -2.926
  472    HG   LEU  61           HG       LEU  61  -8.846  -5.680  -0.805
  473   1HD1  LEU  61          1HD1      LEU  61  -9.486  -7.439   0.773
  474   2HD1  LEU  61          2HD1      LEU  61 -10.837  -6.965  -0.258
  475   3HD1  LEU  61          3HD1      LEU  61  -9.969  -8.469  -0.575
  476   1HD2  LEU  61          1HD2      LEU  61  -7.172  -7.294  -0.053
  477   2HD2  LEU  61          2HD2      LEU  61  -7.558  -8.336  -1.422
  478   3HD2  LEU  61          3HD2      LEU  61  -6.843  -6.748  -1.698
  479    H    ALA  62           H        ALA  62 -10.441  -4.511  -4.580
  480    HA   ALA  62           HA       ALA  62 -10.938  -6.176  -6.886
  481   1HB   ALA  62          1HB       ALA  62 -12.726  -4.600  -7.384
  482   2HB   ALA  62          2HB       ALA  62 -12.786  -5.101  -5.695
  483   3HB   ALA  62          3HB       ALA  62 -12.139  -3.518  -6.122
  484    H    LEU  63           H        LEU  63  -9.060  -3.386  -6.162
  485    HA   LEU  63           HA       LEU  63  -8.937  -2.191  -8.712
  486   1HB   LEU  63          1HB       LEU  63  -8.146  -1.343  -6.380
  487   2HB   LEU  63          2HB       LEU  63  -6.653  -2.174  -6.759
  488    HG   LEU  63           HG       LEU  63  -7.788  -0.082  -8.602
  489   1HD1  LEU  63          1HD1      LEU  63  -7.572   0.924  -6.388
  490   2HD1  LEU  63          2HD1      LEU  63  -5.907   0.350  -6.285
  491   3HD1  LEU  63          3HD1      LEU  63  -6.352   1.551  -7.497
  492   1HD2  LEU  63          1HD2      LEU  63  -4.992  -1.117  -8.136
  493   2HD2  LEU  63          2HD2      LEU  63  -6.030  -1.511  -9.506
  494   3HD2  LEU  63          3HD2      LEU  63  -5.451   0.140  -9.286
  495    H    ASN  64           H        ASN  64  -7.342  -4.915  -7.280
  496    HA   ASN  64           HA       ASN  64  -6.167  -6.632  -8.167
  497   1HB   ASN  64          1HB       ASN  64  -7.123  -5.319 -10.663
  498   2HB   ASN  64          2HB       ASN  64  -5.823  -6.499 -10.797
  499   1HD2  ASN  64          2HD2      ASN  64  -9.146  -5.994  -9.846
  500   2HD2  ASN  64          1HD2      ASN  64  -9.613  -7.663  -9.906
  501    HA   PRO  65           HA       PRO  65  -2.226  -4.431  -8.567
  502   1HB   PRO  65          1HB       PRO  65  -1.465  -4.541  -5.951
  503   2HB   PRO  65          2HB       PRO  65  -2.376  -3.197  -6.641
  504   1HG   PRO  65          1HG       PRO  65  -3.247  -5.182  -4.714
  505   2HG   PRO  65          2HG       PRO  65  -4.089  -3.725  -5.262
  506   1HD   PRO  65          1HD       PRO  65  -4.437  -6.512  -6.118
  507   2HD   PRO  65          2HD       PRO  65  -5.517  -5.120  -6.344
  508    H    ALA  66           H        ALA  66  -0.200  -5.480  -8.630
  509    HA   ALA  66           HA       ALA  66  -0.285  -8.355  -8.194
  510   1HB   ALA  66          1HB       ALA  66   1.896  -8.379  -9.324
  511   2HB   ALA  66          2HB       ALA  66   0.674  -7.535 -10.277
  512   3HB   ALA  66          3HB       ALA  66   1.880  -6.616  -9.376
  513    H    VAL  67           H        VAL  67   1.579  -5.548  -7.129
  514    HA   VAL  67           HA       VAL  67   2.186  -7.001  -4.658
  515    HB   VAL  67           HB       VAL  67   4.229  -7.088  -5.952
  516   1HG1  VAL  67          1HG1      VAL  67   4.037  -4.087  -6.159
  517   2HG1  VAL  67          2HG1      VAL  67   5.397  -5.073  -6.698
  518   3HG1  VAL  67          3HG1      VAL  67   3.823  -5.238  -7.477
  519   1HG2  VAL  67          1HG2      VAL  67   4.468  -6.759  -3.558
  520   2HG2  VAL  67          2HG2      VAL  67   5.766  -5.943  -4.429
  521   3HG2  VAL  67          3HG2      VAL  67   4.421  -5.009  -3.777
  522    H    ILE  68           H        ILE  68   1.919  -5.847  -2.832
  523    HA   ILE  68           HA       ILE  68   1.167  -3.009  -3.133
  524    HB   ILE  68           HB       ILE  68   0.059  -4.956  -1.099
  525   1HG1  ILE  68          1HG1      ILE  68  -1.305  -3.768  -3.525
  526   2HG1  ILE  68          2HG1      ILE  68  -0.740  -5.433  -3.400
  527   1HG2  ILE  68          1HG2      ILE  68  -0.690  -2.104  -1.737
  528   2HG2  ILE  68          2HG2      ILE  68  -1.513  -3.147  -0.578
  529   3HG2  ILE  68          3HG2      ILE  68   0.158  -2.662  -0.295
  530   1HD1  ILE  68          1HD1      ILE  68  -2.866  -4.150  -1.696
  531   2HD1  ILE  68          2HD1      ILE  68  -3.130  -5.289  -3.017
  532   3HD1  ILE  68          3HD1      ILE  68  -2.296  -5.813  -1.554
  533    H    LEU  69           H        LEU  69   2.513  -1.696  -2.106
  534    HA   LEU  69           HA       LEU  69   4.118  -2.744   0.104
  535   1HB   LEU  69          1HB       LEU  69   4.292  -0.143  -1.418
  536   2HB   LEU  69          2HB       LEU  69   5.341  -0.582  -0.084
  537    HG   LEU  69           HG       LEU  69   5.158  -2.049  -2.717
  538   1HD1  LEU  69          1HD1      LEU  69   7.401  -1.150  -3.102
  539   2HD1  LEU  69          2HD1      LEU  69   6.202   0.135  -2.946
  540   3HD1  LEU  69          3HD1      LEU  69   7.286  -0.229  -1.602
  541   1HD2  LEU  69          1HD2      LEU  69   5.713  -3.531  -0.859
  542   2HD2  LEU  69          2HD2      LEU  69   7.108  -3.281  -1.908
  543   3HD2  LEU  69          3HD2      LEU  69   7.006  -2.439  -0.363
  544    H    LEU  70           H        LEU  70   3.118  -2.660   1.980
  545    HA   LEU  70           HA       LEU  70   1.195  -0.517   2.495
  546   1HB   LEU  70          1HB       LEU  70   0.485  -2.844   2.855
  547   2HB   LEU  70          2HB       LEU  70   1.776  -3.059   4.020
  548    HG   LEU  70           HG       LEU  70   0.719  -1.362   5.477
  549   1HD1  LEU  70          1HD1      LEU  70  -0.433  -0.079   3.745
  550   2HD1  LEU  70          2HD1      LEU  70  -1.510  -1.443   3.449
  551   3HD1  LEU  70          3HD1      LEU  70  -1.550  -0.611   5.003
  552   1HD2  LEU  70          1HD2      LEU  70   0.255  -3.724   5.820
  553   2HD2  LEU  70          2HD2      LEU  70  -1.172  -2.752   6.177
  554   3HD2  LEU  70          3HD2      LEU  70  -1.071  -3.646   4.661
  555    H    GLY  71           H        GLY  71   2.118   1.250   3.278
  556   1HA   GLY  71          1HA       GLY  71   4.349   1.013   5.164
  557   2HA   GLY  71          2HA       GLY  71   3.805   2.491   4.378
  558    H    THR  72           H        THR  72   3.431   0.380   7.085
  559    HA   THR  72           HA       THR  72   1.056   1.735   8.042
  560    HB   THR  72           HB       THR  72   1.262   0.167   9.987
  561    HG1  THR  72           HG1      THR  72   3.434  -0.290  10.035
  562   1HG2  THR  72          1HG2      THR  72   1.312  -1.100   7.246
  563   2HG2  THR  72          2HG2      THR  72   0.678  -1.847   8.713
  564   3HG2  THR  72          3HG2      THR  72  -0.102  -0.413   8.045
  565    H    GLY  73           H        GLY  73   2.025   3.836   8.205
  566   1HA   GLY  73          1HA       GLY  73   3.019   5.573   9.327
  567   2HA   GLY  73          2HA       GLY  73   2.602   4.658  10.766
  568    H    GLU  74           H        GLU  74   4.262   4.451  12.075
  569    HA   GLU  74           HA       GLU  74   6.922   3.982  10.908
  570   1HB   GLU  74          1HB       GLU  74   7.687   4.922  13.224
  571   2HB   GLU  74          2HB       GLU  74   7.213   6.026  11.943
  572   1HG   GLU  74          1HG       GLU  74   6.306   6.730  14.073
  573   2HG   GLU  74          2HG       GLU  74   5.015   6.284  12.961
  574    H    ARG  75           H        ARG  75   4.560   2.296  12.040
  575    HA   ARG  75           HA       ARG  75   6.243   0.531  13.692
  576   1HB   ARG  75          1HB       ARG  75   4.683   1.584  15.195
  577   2HB   ARG  75          2HB       ARG  75   3.342   1.276  14.103
  578   1HG   ARG  75          1HG       ARG  75   3.565  -1.122  14.492
  579   2HG   ARG  75          2HG       ARG  75   4.922  -0.818  15.579
  580   1HD   ARG  75          1HD       ARG  75   3.496   0.391  17.098
  581   2HD   ARG  75          2HD       ARG  75   2.139   0.271  15.979
  582    HE   ARG  75           HE       ARG  75   1.932  -2.018  16.501
  583   1HH1  ARG  75          1HH1      ARG  75   4.445  -0.425  18.346
  584   2HH1  ARG  75          2HH1      ARG  75   4.525  -1.669  19.553
  585   1HH2  ARG  75          1HH2      ARG  75   2.045  -3.668  18.078
  586   2HH2  ARG  75          2HH2      ARG  75   3.160  -3.528  19.402
  587    H    GLN  76           H        GLN  76   6.523  -1.359  12.690
  588    HA   GLN  76           HA       GLN  76   4.988  -2.114  10.414
  589   1HB   GLN  76          1HB       GLN  76   7.414  -2.714  10.888
  590   2HB   GLN  76          2HB       GLN  76   6.806  -3.911  12.022
  591   1HG   GLN  76          1HG       GLN  76   5.621  -5.037  10.221
  592   2HG   GLN  76          2HG       GLN  76   6.186  -3.820   9.078
  593   1HE2  GLN  76          2HE2      GLN  76   6.614  -6.681   9.032
  594   2HE2  GLN  76          1HE2      GLN  76   8.323  -6.921   9.063
  595    H    GLN  77           H        GLN  77   2.886  -2.494  10.780
  596    HA   GLN  77           HA       GLN  77   2.162  -4.269  13.019
  597   1HB   GLN  77          1HB       GLN  77   1.469  -1.898  13.282
  598   2HB   GLN  77          2HB       GLN  77   0.541  -2.027  11.799
  599   1HG   GLN  77          1HG       GLN  77  -0.846  -2.178  13.812
  600   2HG   GLN  77          2HG       GLN  77  -0.945  -3.623  12.809
  601   1HE2  GLN  77          2HE2      GLN  77  -0.301  -5.547  13.614
  602   2HE2  GLN  77          1HE2      GLN  77   0.237  -5.787  15.246
  603    H    PHE  78           H        PHE  78   1.292  -6.128  12.454
  604    HA   PHE  78           HA       PHE  78   0.711  -6.841   9.790
  605   1HB   PHE  78          1HB       PHE  78  -0.083  -8.201  12.374
  606   2HB   PHE  78          2HB       PHE  78  -0.203  -8.926  10.774
  607    HD1  PHE  78           HD1      PHE  78   2.002  -8.053  13.519
  608    HD2  PHE  78           HD2      PHE  78   1.829  -9.504   9.522
  609    HE1  PHE  78           HE1      PHE  78   4.316  -8.866  13.718
  610    HE2  PHE  78           HE2      PHE  78   4.142 -10.321   9.715
  611    HZ   PHE  78           HZ       PHE  78   5.387 -10.002  11.815
  612    HA   PRO  79           HA       PRO  79  -3.450  -5.299   9.448
  613   1HB   PRO  79          1HB       PRO  79  -3.820  -7.176   7.240
  614   2HB   PRO  79          2HB       PRO  79  -3.746  -5.412   7.202
  615   1HG   PRO  79          1HG       PRO  79  -1.793  -6.978   6.173
  616   2HG   PRO  79          2HG       PRO  79  -1.472  -5.383   6.880
  617   1HD   PRO  79          1HD       PRO  79  -1.091  -8.101   8.079
  618   2HD   PRO  79          2HD       PRO  79  -0.041  -6.671   8.168
  619    H    SER  80           H        SER  80  -5.642  -6.585   8.623
  620    HA   SER  80           HA       SER  80  -6.271  -8.276  10.830
  621   1HB   SER  80          1HB       SER  80  -7.940  -6.750   9.926
  622   2HB   SER  80          2HB       SER  80  -7.866  -7.559   8.361
  623    HG   SER  80           HG       SER  80  -9.646  -8.247   9.645
  624    H    THR  81           H        THR  81  -6.678 -10.448  10.872
  625    HA   THR  81           HA       THR  81  -5.233 -12.078   9.072
  626    HB   THR  81           HB       THR  81  -6.566 -13.916  10.375
  627    HG1  THR  81           HG1      THR  81  -7.090 -12.794  12.528
  628   1HG2  THR  81          1HG2      THR  81  -4.198 -13.397  10.734
  629   2HG2  THR  81          2HG2      THR  81  -4.649 -12.051  11.780
  630   3HG2  THR  81          3HG2      THR  81  -5.018 -13.706  12.264
  631    H    ASP  82           H        ASP  82  -8.501 -10.959   9.159
  632    HA   ASP  82           HA       ASP  82  -9.635 -12.992   7.506
  633   1HB   ASP  82          1HB       ASP  82 -10.987 -11.544   9.003
  634   2HB   ASP  82          2HB       ASP  82 -10.604 -10.162   7.984
  635    H    VAL  83           H        VAL  83  -7.908 -10.028   6.949
  636    HA   VAL  83           HA       VAL  83  -8.568  -9.762   4.177
  637    HB   VAL  83           HB       VAL  83  -6.190  -8.620   5.661
  638   1HG1  VAL  83          1HG1      VAL  83  -6.169  -6.933   3.886
  639   2HG1  VAL  83          2HG1      VAL  83  -5.916  -8.558   3.248
  640   3HG1  VAL  83          3HG1      VAL  83  -7.488  -7.777   3.072
  641   1HG2  VAL  83          1HG2      VAL  83  -8.319  -7.981   6.702
  642   2HG2  VAL  83          2HG2      VAL  83  -7.502  -6.605   5.957
  643   3HG2  VAL  83          3HG2      VAL  83  -8.877  -7.359   5.149
  644    H    LEU  84           H        LEU  84  -6.046 -11.312   6.044
  645    HA   LEU  84           HA       LEU  84  -4.133 -11.740   4.071
  646   1HB   LEU  84          1HB       LEU  84  -4.804 -13.495   6.433
  647   2HB   LEU  84          2HB       LEU  84  -3.320 -13.571   5.502
  648    HG   LEU  84           HG       LEU  84  -4.223 -11.217   7.167
  649   1HD1  LEU  84          1HD1      LEU  84  -2.356 -11.823   8.623
  650   2HD1  LEU  84          2HD1      LEU  84  -3.548 -13.120   8.529
  651   3HD1  LEU  84          3HD1      LEU  84  -2.039 -13.243   7.626
  652   1HD2  LEU  84          1HD2      LEU  84  -1.664 -11.679   5.637
  653   2HD2  LEU  84          2HD2      LEU  84  -2.930 -10.523   5.221
  654   3HD2  LEU  84          3HD2      LEU  84  -1.999 -10.315   6.704
  655    H    ALA  85           H        ALA  85  -7.086 -13.485   4.764
  656    HA   ALA  85           HA       ALA  85  -6.595 -15.839   3.339
  657   1HB   ALA  85          1HB       ALA  85  -8.517 -15.557   4.823
  658   2HB   ALA  85          2HB       ALA  85  -9.223 -14.403   3.690
  659   3HB   ALA  85          3HB       ALA  85  -9.017 -16.089   3.217
  660    H    ALA  86           H        ALA  86  -8.125 -12.813   2.245
  661    HA   ALA  86           HA       ALA  86  -8.502 -13.651  -0.428
  662   1HB   ALA  86          1HB       ALA  86  -9.750 -11.793   0.562
  663   2HB   ALA  86          2HB       ALA  86  -8.266 -10.847   0.663
  664   3HB   ALA  86          3HB       ALA  86  -8.919 -11.294  -0.912
  665    H    CYS  87           H        CYS  87  -5.900 -11.943   1.212
  666    HA   CYS  87           HA       CYS  87  -4.382 -11.215  -1.025
  667   1HB   CYS  87          1HB       CYS  87  -4.023 -10.376   1.287
  668   2HB   CYS  87          2HB       CYS  87  -3.381 -11.951   1.736
  669    HG   CYS  87           HG       CYS  87  -1.460 -11.426  -0.618
  670    H    LEU  88           H        LEU  88  -4.285 -14.152   0.977
  671    HA   LEU  88           HA       LEU  88  -2.141 -15.342  -0.485
  672   1HB   LEU  88          1HB       LEU  88  -4.153 -16.555   1.407
  673   2HB   LEU  88          2HB       LEU  88  -2.757 -17.400   0.768
  674    HG   LEU  88           HG       LEU  88  -2.670 -14.964   2.550
  675   1HD1  LEU  88          1HD1      LEU  88  -1.809 -16.497   4.235
  676   2HD1  LEU  88          2HD1      LEU  88  -3.423 -16.975   3.710
  677   3HD1  LEU  88          3HD1      LEU  88  -2.009 -17.849   3.120
  678   1HD2  LEU  88          1HD2      LEU  88  -0.785 -15.029   1.004
  679   2HD2  LEU  88          2HD2      LEU  88  -0.262 -15.394   2.649
  680   3HD2  LEU  88          3HD2      LEU  88  -0.445 -16.695   1.472
  681    H    THR  89           H        THR  89  -5.661 -15.693  -0.555
  682    HA   THR  89           HA       THR  89  -5.783 -17.918  -2.258
  683    HB   THR  89           HB       THR  89  -7.818 -15.692  -1.988
  684    HG1  THR  89           HG1      THR  89  -7.503 -16.580   0.026
  685   1HG2  THR  89          1HG2      THR  89  -8.230 -17.122  -3.937
  686   2HG2  THR  89          2HG2      THR  89  -8.138 -18.554  -2.911
  687   3HG2  THR  89          3HG2      THR  89  -9.444 -17.390  -2.686
  688    H    ARG  90           H        ARG  90  -5.635 -14.452  -2.975
  689    HA   ARG  90           HA       ARG  90  -5.899 -14.946  -5.811
  690   1HB   ARG  90          1HB       ARG  90  -5.311 -12.405  -4.290
  691   2HB   ARG  90          2HB       ARG  90  -5.545 -12.496  -6.031
  692   1HG   ARG  90          1HG       ARG  90  -7.803 -13.682  -5.255
  693   2HG   ARG  90          2HG       ARG  90  -7.518 -12.666  -3.839
  694   1HD   ARG  90          1HD       ARG  90  -8.902 -11.510  -5.483
  695   2HD   ARG  90          2HD       ARG  90  -7.345 -10.701  -5.283
  696    HE   ARG  90           HE       ARG  90  -7.299 -12.612  -7.409
  697   1HH1  ARG  90          1HH1      ARG  90  -8.312  -9.350  -6.606
  698   2HH1  ARG  90          2HH1      ARG  90  -8.185  -8.783  -8.239
  699   1HH2  ARG  90          1HH2      ARG  90  -7.133 -11.867  -9.540
  700   2HH2  ARG  90          2HH2      ARG  90  -7.506 -10.211  -9.912
  701    H    GLY  91           H        GLY  91  -3.328 -14.217  -3.529
  702   1HA   GLY  91          1HA       GLY  91  -1.081 -14.885  -3.877
  703   2HA   GLY  91          2HA       GLY  91  -1.390 -14.930  -5.608
  704    H    ILE  92           H        ILE  92  -2.038 -12.368  -3.262
  705    HA   ILE  92           HA       ILE  92  -0.583 -10.499  -4.981
  706    HB   ILE  92           HB       ILE  92  -2.364  -9.920  -2.601
  707   1HG1  ILE  92          1HG1      ILE  92  -2.963  -9.722  -5.563
  708   2HG1  ILE  92          2HG1      ILE  92  -3.581 -10.968  -4.485
  709   1HG2  ILE  92          1HG2      ILE  92  -2.366  -7.619  -3.436
  710   2HG2  ILE  92          2HG2      ILE  92  -0.736  -8.154  -3.027
  711   3HG2  ILE  92          3HG2      ILE  92  -1.243  -8.081  -4.715
  712   1HD1  ILE  92          1HD1      ILE  92  -4.775  -9.257  -3.208
  713   2HD1  ILE  92          2HD1      ILE  92  -4.167  -8.021  -4.309
  714   3HD1  ILE  92          3HD1      ILE  92  -5.257  -9.274  -4.904
  715    H    GLY  93           H        GLY  93   1.198  -9.362  -4.288
  716   1HA   GLY  93          1HA       GLY  93   2.540 -10.452  -1.941
  717   2HA   GLY  93          2HA       GLY  93   3.258  -9.415  -3.164
  718    H    LEU  94           H        LEU  94   1.445  -9.535  -0.206
  719    HA   LEU  94           HA       LEU  94   1.329  -6.631  -0.022
  720   1HB   LEU  94          1HB       LEU  94  -0.620  -7.927   0.693
  721   2HB   LEU  94          2HB       LEU  94   0.363  -8.788   1.861
  722    HG   LEU  94           HG       LEU  94   0.741  -6.655   3.071
  723   1HD1  LEU  94          1HD1      LEU  94  -1.275  -5.550   1.121
  724   2HD1  LEU  94          2HD1      LEU  94  -0.641  -4.719   2.541
  725   3HD1  LEU  94          3HD1      LEU  94   0.433  -5.120   1.201
  726   1HD2  LEU  94          1HD2      LEU  94  -1.024  -8.178   3.769
  727   2HD2  LEU  94          2HD2      LEU  94  -1.511  -6.502   4.018
  728   3HD2  LEU  94          3HD2      LEU  94  -2.148  -7.412   2.647
  729    H    GLU  95           H        GLU  95   3.281  -5.789   0.409
  730    HA   GLU  95           HA       GLU  95   4.992  -7.074   2.406
  731   1HB   GLU  95          1HB       GLU  95   5.536  -4.741   0.555
  732   2HB   GLU  95          2HB       GLU  95   6.707  -5.461   1.651
  733   1HG   GLU  95          1HG       GLU  95   5.390  -6.829  -0.683
  734   2HG   GLU  95          2HG       GLU  95   7.047  -6.227  -0.624
  735    H    ALA  96           H        ALA  96   4.488  -6.524   4.424
  736    HA   ALA  96           HA       ALA  96   3.437  -3.903   5.056
  737   1HB   ALA  96          1HB       ALA  96   4.102  -6.207   6.888
  738   2HB   ALA  96          2HB       ALA  96   3.199  -4.756   7.322
  739   3HB   ALA  96          3HB       ALA  96   2.527  -5.900   6.158
  740    H    MET  97           H        MET  97   4.783  -2.257   5.231
  741    HA   MET  97           HA       MET  97   7.295  -2.615   6.719
  742   1HB   MET  97          1HB       MET  97   7.000  -1.087   4.120
  743   2HB   MET  97          2HB       MET  97   8.439  -1.105   5.125
  744   1HG   MET  97          1HG       MET  97   8.686  -3.504   4.722
  745   2HG   MET  97          2HG       MET  97   7.248  -3.473   3.702
  746   1HE   MET  97          1HE       MET  97  10.087  -4.619   2.734
  747   2HE   MET  97          2HE       MET  97  10.137  -3.959   1.099
  748   3HE   MET  97          3HE       MET  97   8.628  -4.606   1.743
  749    H    THR  98           H        THR  98   8.244  -0.180   6.921
  750    HA   THR  98           HA       THR  98   6.112   1.410   8.094
  751    HB   THR  98           HB       THR  98   8.010   2.927   8.777
  752    HG1  THR  98           HG1      THR  98  10.082   1.436   8.606
  753   1HG2  THR  98          1HG2      THR  98   8.876   1.416  10.503
  754   2HG2  THR  98          2HG2      THR  98   7.134   1.226  10.302
  755   3HG2  THR  98          3HG2      THR  98   8.237   0.032   9.615
  756    H    ASN  99           H        ASN  99   6.139   3.812   7.604
  757    HA   ASN  99           HA       ASN  99   5.532   4.262   4.938
  758   1HB   ASN  99          1HB       ASN  99   4.694   5.736   6.634
  759   2HB   ASN  99          2HB       ASN  99   6.320   6.203   7.114
  760   1HD2  ASN  99          2HD2      ASN  99   3.883   6.489   4.620
  761   2HD2  ASN  99          1HD2      ASN  99   4.526   7.922   3.903
  762    H    ALA 100           H        ALA 100   8.552   5.015   6.643
  763    HA   ALA 100           HA       ALA 100   9.850   6.187   4.422
  764   1HB   ALA 100          1HB       ALA 100  10.563   6.544   6.745
  765   2HB   ALA 100          2HB       ALA 100  11.095   4.864   6.827
  766   3HB   ALA 100          3HB       ALA 100  11.887   5.987   5.722
  767    H    ALA 101           H        ALA 101   9.764   2.872   5.659
  768    HA   ALA 101           HA       ALA 101  11.820   1.901   3.947
  769   1HB   ALA 101          1HB       ALA 101  11.236   0.806   6.062
  770   2HB   ALA 101          2HB       ALA 101   9.673   0.347   5.385
  771   3HB   ALA 101          3HB       ALA 101  11.159  -0.310   4.698
  772    H    ALA 102           H        ALA 102   8.282   1.879   3.772
  773    HA   ALA 102           HA       ALA 102   8.081   0.267   1.467
  774   1HB   ALA 102          1HB       ALA 102   6.161   2.381   2.438
  775   2HB   ALA 102          2HB       ALA 102   5.799   1.083   1.302
  776   3HB   ALA 102          3HB       ALA 102   6.195   0.703   2.978
  777    H    ALA 103           H        ALA 103   8.410   3.753   1.915
  778    HA   ALA 103           HA       ALA 103   8.016   4.529  -0.761
  779   1HB   ALA 103          1HB       ALA 103   7.991   6.108   1.109
  780   2HB   ALA 103          2HB       ALA 103   9.720   5.853   1.346
  781   3HB   ALA 103          3HB       ALA 103   9.136   6.604  -0.139
  782    H    ARG 104           H        ARG 104  10.908   3.535   1.000
  783    HA   ARG 104           HA       ARG 104  12.763   4.091  -1.059
  784   1HB   ARG 104          1HB       ARG 104  12.864   2.276   1.344
  785   2HB   ARG 104          2HB       ARG 104  14.225   2.460   0.243
  786   1HG   ARG 104          1HG       ARG 104  14.489   4.740   0.794
  787   2HG   ARG 104          2HG       ARG 104  12.931   4.796   1.617
  788   1HD   ARG 104          1HD       ARG 104  14.836   4.743   3.179
  789   2HD   ARG 104          2HD       ARG 104  13.756   3.365   3.372
  790    HE   ARG 104           HE       ARG 104  15.682   2.447   1.676
  791   1HH1  ARG 104          1HH1      ARG 104  15.777   4.017   4.806
  792   2HH1  ARG 104          2HH1      ARG 104  17.180   3.150   5.346
  793   1HH2  ARG 104          1HH2      ARG 104  17.524   1.310   2.369
  794   2HH2  ARG 104          2HH2      ARG 104  18.179   1.603   3.955
  795    H    THR 105           H        THR 105  10.947   1.183  -0.198
  796    HA   THR 105           HA       THR 105  12.174  -0.467  -2.176
  797    HB   THR 105           HB       THR 105   9.507  -0.885  -0.811
  798    HG1  THR 105           HG1      THR 105  10.663  -1.132   0.941
  799   1HG2  THR 105          1HG2      THR 105  11.467  -2.842  -2.023
  800   2HG2  THR 105          2HG2      THR 105   9.973  -3.265  -1.189
  801   3HG2  THR 105          3HG2      THR 105   9.911  -2.379  -2.712
  802    H    TYR 106           H        TYR 106   9.474   1.729  -2.133
  803    HA   TYR 106           HA       TYR 106   8.051   0.782  -4.363
  804   1HB   TYR 106          1HB       TYR 106   7.254   2.486  -2.680
  805   2HB   TYR 106          2HB       TYR 106   8.268   3.670  -3.497
  806    HD1  TYR 106           HD1      TYR 106   7.334   4.948  -5.206
  807    HD2  TYR 106           HD2      TYR 106   5.554   1.215  -4.210
  808    HE1  TYR 106           HE1      TYR 106   5.497   5.409  -6.776
  809    HE2  TYR 106           HE2      TYR 106   3.716   1.663  -5.776
  810    HH   TYR 106           HH       TYR 106   2.622   3.688  -6.789
  811    H    ASN 107           H        ASN 107  10.827   2.886  -4.071
  812    HA   ASN 107           HA       ASN 107  11.035   3.952  -6.613
  813   1HB   ASN 107          1HB       ASN 107  12.556   4.595  -4.846
  814   2HB   ASN 107          2HB       ASN 107  13.202   2.962  -4.745
  815   1HD2  ASN 107          2HD2      ASN 107  15.284   3.497  -5.166
  816   2HD2  ASN 107          1HD2      ASN 107  15.842   4.076  -6.699
  817    H    VAL 108           H        VAL 108  12.084   0.775  -5.457
  818    HA   VAL 108           HA       VAL 108  13.301  -0.030  -7.897
  819    HB   VAL 108           HB       VAL 108  12.255  -1.720  -5.617
  820   1HG1  VAL 108          1HG1      VAL 108  14.149  -2.439  -7.855
  821   2HG1  VAL 108          2HG1      VAL 108  13.742  -3.467  -6.481
  822   3HG1  VAL 108          3HG1      VAL 108  12.500  -3.031  -7.655
  823   1HG2  VAL 108          1HG2      VAL 108  15.034  -0.694  -6.193
  824   2HG2  VAL 108          2HG2      VAL 108  13.967  -0.137  -4.905
  825   3HG2  VAL 108          3HG2      VAL 108  14.591  -1.786  -4.880
  826    H    LEU 109           H        LEU 109  10.159  -0.750  -6.404
  827    HA   LEU 109           HA       LEU 109   9.332  -2.493  -8.484
  828   1HB   LEU 109          1HB       LEU 109   7.727  -1.080  -6.360
  829   2HB   LEU 109          2HB       LEU 109   7.100  -2.333  -7.416
  830    HG   LEU 109           HG       LEU 109   9.312  -2.680  -5.389
  831   1HD1  LEU 109          1HD1      LEU 109   6.480  -3.707  -5.429
  832   2HD1  LEU 109          2HD1      LEU 109   7.708  -4.097  -4.223
  833   3HD1  LEU 109          3HD1      LEU 109   7.113  -2.444  -4.373
  834   1HD2  LEU 109          1HD2      LEU 109   8.012  -4.682  -7.233
  835   2HD2  LEU 109          2HD2      LEU 109   9.670  -4.090  -7.337
  836   3HD2  LEU 109          3HD2      LEU 109   9.165  -5.060  -5.953
  837    H    ALA 110           H        ALA 110   9.133   0.952  -8.062
  838    HA   ALA 110           HA       ALA 110   7.128   1.477  -9.989
  839   1HB   ALA 110          1HB       ALA 110   7.876   3.153  -8.362
  840   2HB   ALA 110          2HB       ALA 110   9.449   3.220  -9.158
  841   3HB   ALA 110          3HB       ALA 110   8.004   3.753 -10.016
  842    H    SER 111           H        SER 111  10.661   1.217 -10.204
  843    HA   SER 111           HA       SER 111  10.750   1.690 -13.011
  844   1HB   SER 111          1HB       SER 111  12.771   0.391 -11.166
  845   2HB   SER 111          2HB       SER 111  13.086   0.872 -12.835
  846    HG   SER 111           HG       SER 111  13.394   2.368 -10.746
  847    H    GLU 112           H        GLU 112  10.394  -1.151 -10.988
  848    HA   GLU 112           HA       GLU 112  10.689  -3.115 -12.981
  849   1HB   GLU 112          1HB       GLU 112   9.342  -2.975 -10.318
  850   2HB   GLU 112          2HB       GLU 112   8.995  -4.342 -11.363
  851   1HG   GLU 112          1HG       GLU 112  11.773  -3.519 -10.565
  852   2HG   GLU 112          2HG       GLU 112  10.810  -4.712  -9.692
  853    H    GLY 113           H        GLY 113   7.949  -1.151 -11.960
  854   1HA   GLY 113          1HA       GLY 113   5.955  -0.684 -13.004
  855   2HA   GLY 113          2HA       GLY 113   6.635  -1.390 -14.463
  856    H    ARG 114           H        ARG 114   6.490  -3.236 -11.536
  857    HA   ARG 114           HA       ARG 114   4.923  -5.228 -12.947
  858   1HB   ARG 114          1HB       ARG 114   7.064  -5.688 -11.630
  859   2HB   ARG 114          2HB       ARG 114   6.098  -5.470 -10.177
  860   1HG   ARG 114          1HG       ARG 114   4.701  -7.341 -10.768
  861   2HG   ARG 114          2HG       ARG 114   5.524  -7.510 -12.320
  862   1HD   ARG 114          1HD       ARG 114   6.713  -7.923  -9.577
  863   2HD   ARG 114          2HD       ARG 114   6.372  -9.166 -10.781
  864    HE   ARG 114           HE       ARG 114   8.486  -7.124 -10.972
  865   1HH1  ARG 114          1HH1      ARG 114   7.113 -10.197 -11.956
  866   2HH1  ARG 114          2HH1      ARG 114   8.475 -10.616 -12.951
  867   1HH2  ARG 114          1HH2      ARG 114  10.284  -7.691 -12.265
  868   2HH2  ARG 114          2HH2      ARG 114  10.253  -9.201 -13.146
  869    H    ARG 115           H        ARG 115   3.363  -3.088 -12.433
  870    HA   ARG 115           HA       ARG 115   1.423  -2.361 -11.497
  871   1HB   ARG 115          1HB       ARG 115   0.803  -4.539 -12.582
  872   2HB   ARG 115          2HB       ARG 115   0.943  -5.299 -11.004
  873   1HG   ARG 115          1HG       ARG 115  -0.883  -4.028 -10.145
  874   2HG   ARG 115          2HG       ARG 115  -0.930  -3.019 -11.594
  875   1HD   ARG 115          1HD       ARG 115  -1.515  -5.979 -11.457
  876   2HD   ARG 115          2HD       ARG 115  -2.706  -4.689 -11.644
  877    HE   ARG 115           HE       ARG 115  -1.380  -4.172 -13.776
  878   1HH1  ARG 115          1HH1      ARG 115  -1.915  -7.387 -12.464
  879   2HH1  ARG 115          2HH1      ARG 115  -1.705  -8.171 -14.005
  880   1HH2  ARG 115          1HH2      ARG 115  -1.103  -5.224 -15.791
  881   2HH2  ARG 115          2HH2      ARG 115  -1.259  -6.959 -15.872
  882    H    VAL 116           H        VAL 116   2.867  -1.516  -9.748
  883    HA   VAL 116           HA       VAL 116   2.477  -2.864  -7.180
  884    HB   VAL 116           HB       VAL 116   4.791  -2.337  -7.704
  885   1HG1  VAL 116          1HG1      VAL 116   3.906   0.541  -7.868
  886   2HG1  VAL 116          2HG1      VAL 116   5.574  -0.029  -7.922
  887   3HG1  VAL 116          3HG1      VAL 116   4.452  -0.462  -9.212
  888   1HG2  VAL 116          1HG2      VAL 116   5.385  -1.053  -5.701
  889   2HG2  VAL 116          2HG2      VAL 116   3.703  -0.550  -5.531
  890   3HG2  VAL 116          3HG2      VAL 116   4.137  -2.252  -5.367
  891    H    ALA 117           H        ALA 117   1.355  -1.972  -5.550
  892    HA   ALA 117           HA       ALA 117   0.248   0.729  -5.962
  893   1HB   ALA 117          1HB       ALA 117  -1.490  -0.991  -6.125
  894   2HB   ALA 117          2HB       ALA 117  -1.044  -1.594  -4.529
  895   3HB   ALA 117          3HB       ALA 117  -1.725   0.025  -4.701
  896    H    LEU 118           H        LEU 118   0.947   2.166  -4.522
  897    HA   LEU 118           HA       LEU 118   2.296   1.211  -2.119
  898   1HB   LEU 118          1HB       LEU 118   3.332   2.924  -3.638
  899   2HB   LEU 118          2HB       LEU 118   2.066   4.035  -3.154
  900    HG   LEU 118           HG       LEU 118   2.858   3.869  -0.810
  901   1HD1  LEU 118          1HD1      LEU 118   5.041   2.852  -0.373
  902   2HD1  LEU 118          2HD1      LEU 118   3.868   1.658  -0.931
  903   3HD1  LEU 118          3HD1      LEU 118   5.099   2.267  -2.037
  904   1HD2  LEU 118          1HD2      LEU 118   3.610   5.682  -2.272
  905   2HD2  LEU 118          2HD2      LEU 118   4.867   5.212  -1.127
  906   3HD2  LEU 118          3HD2      LEU 118   4.964   4.688  -2.808
  907    H    ALA 119           H        ALA 119   0.942   0.806  -0.496
  908    HA   ALA 119           HA       ALA 119  -1.326   2.606  -0.038
  909   1HB   ALA 119          1HB       ALA 119  -1.835   0.215  -0.149
  910   2HB   ALA 119          2HB       ALA 119  -0.721  -0.088   1.182
  911   3HB   ALA 119          3HB       ALA 119  -2.177   0.867   1.453
  912    H    MET 120           H        MET 120  -0.538   4.335   1.019
  913    HA   MET 120           HA       MET 120   1.240   3.888   3.308
  914   1HB   MET 120          1HB       MET 120   0.589   6.343   1.691
  915   2HB   MET 120          2HB       MET 120   1.452   6.426   3.220
  916   1HG   MET 120          1HG       MET 120   2.348   4.896   0.792
  917   2HG   MET 120          2HG       MET 120   2.954   6.472   1.295
  918   1HE   MET 120          1HE       MET 120   6.040   4.317   2.122
  919   2HE   MET 120          2HE       MET 120   5.470   5.858   1.481
  920   3HE   MET 120          3HE       MET 120   5.003   4.350   0.694
  921    H    ILE 121           H        ILE 121   0.226   3.603   5.148
  922    HA   ILE 121           HA       ILE 121  -2.141   5.257   5.727
  923    HB   ILE 121           HB       ILE 121  -1.323   2.621   6.974
  924   1HG1  ILE 121          1HG1      ILE 121  -3.631   3.317   5.143
  925   2HG1  ILE 121          2HG1      ILE 121  -2.199   2.404   4.682
  926   1HG2  ILE 121          1HG2      ILE 121  -3.469   2.729   8.155
  927   2HG2  ILE 121          2HG2      ILE 121  -2.421   4.080   8.594
  928   3HG2  ILE 121          3HG2      ILE 121  -3.760   4.329   7.473
  929   1HD1  ILE 121          1HD1      ILE 121  -2.831   0.645   6.266
  930   2HD1  ILE 121          2HD1      ILE 121  -4.278   1.561   6.688
  931   3HD1  ILE 121          3HD1      ILE 121  -4.080   0.931   5.053
  932    H    VAL 122           H        VAL 122  -1.168   7.061   6.556
  933    HA   VAL 122           HA       VAL 122   0.580   6.629   8.888
  934    HB   VAL 122           HB       VAL 122   1.575   8.857   8.429
  935   1HG1  VAL 122          1HG1      VAL 122   2.956   8.142   6.532
  936   2HG1  VAL 122          2HG1      VAL 122   2.712   6.842   7.699
  937   3HG1  VAL 122          3HG1      VAL 122   1.801   6.854   6.189
  938   1HG2  VAL 122          1HG2      VAL 122   0.024   8.675   5.849
  939   2HG2  VAL 122          2HG2      VAL 122  -0.233   9.848   7.140
  940   3HG2  VAL 122          3HG2      VAL 122   1.269   9.870   6.216
  941    H    GLY 123           H        GLY 123   0.252   7.858  10.708
  942   1HA   GLY 123          1HA       GLY 123  -0.947   9.835  11.667
  943   2HA   GLY 123          2HA       GLY 123  -2.351   9.240  10.788
  944    H    GLY 124           H        GLY 124  -3.708   8.717  12.427
  945   1HA   GLY 124          1HA       GLY 124  -4.609   7.419  14.094
  946   2HA   GLY 124          2HA       GLY 124  -3.311   6.276  13.792
  947    H    LEU 125           H        LEU 125  -2.249   9.413  14.552
  948    HA   LEU 125           HA       LEU 125  -0.887   8.562  16.866
  949   1HB   LEU 125          1HB       LEU 125  -0.179  10.845  17.137
  950   2HB   LEU 125          2HB       LEU 125  -0.112  10.420  15.440
  951    HG   LEU 125           HG       LEU 125  -2.426  11.958  16.617
  952   1HD1  LEU 125          1HD1      LEU 125  -1.338  13.991  15.815
  953   2HD1  LEU 125          2HD1      LEU 125  -0.372  13.199  17.060
  954   3HD1  LEU 125          3HD1      LEU 125   0.088  13.056  15.363
  955   1HD2  LEU 125          1HD2      LEU 125  -2.750  12.674  14.302
  956   2HD2  LEU 125          2HD2      LEU 125  -1.369  11.699  13.800
  957   3HD2  LEU 125          3HD2      LEU 125  -2.816  10.916  14.438
  958    H    GLU 126           H        GLU 126  -4.035   9.847  16.370
  959    HA   GLU 126           HA       GLU 126  -4.408  10.327  19.231
  960   1HB   GLU 126          1HB       GLU 126  -5.956  11.125  16.784
  961   2HB   GLU 126          2HB       GLU 126  -6.679  11.207  18.385
  962   1HG   GLU 126          1HG       GLU 126  -4.103  12.572  17.660
  963   2HG   GLU 126          2HG       GLU 126  -5.686  13.341  17.538
  964    H    HIS 127           H        HIS 127  -4.634   7.774  17.191
  965    HA   HIS 127           HA       HIS 127  -7.150   6.686  18.067
  966   1HB   HIS 127          1HB       HIS 127  -5.992   5.999  15.934
  967   2HB   HIS 127          2HB       HIS 127  -4.785   5.182  16.920
  968    HD1  HIS 127           HD1      HIS 127  -8.282   4.877  15.669
  969    HD2  HIS 127           HD2      HIS 127  -5.671   2.805  18.162
  970    HE1  HIS 127           HE1      HIS 127  -9.336   2.623  16.036
  971    HE2  HIS 127           HE2      HIS 127  -7.795   1.422  17.633
  972    H    HIS 128           H        HIS 128  -3.754   6.308  18.913
  973    HA   HIS 128           HA       HIS 128  -4.435   4.940  21.384
  974   1HB   HIS 128          1HB       HIS 128  -2.348   4.275  20.339
  975   2HB   HIS 128          2HB       HIS 128  -1.801   5.944  20.261
  976    HD1  HIS 128           HD1      HIS 128  -2.114   3.040  22.597
  977    HD2  HIS 128           HD2      HIS 128  -0.764   6.976  22.662
  978    HE1  HIS 128           HE1      HIS 128  -0.837   3.288  24.754
  979    HE2  HIS 128           HE2      HIS 128  -0.156   5.720  24.839
  980    H    HIS 129           H        HIS 129  -5.583   6.294  22.664
  981    HA   HIS 129           HA       HIS 129  -5.212   9.097  22.752
  982   1HB   HIS 129          1HB       HIS 129  -6.505   7.289  24.815
  983   2HB   HIS 129          2HB       HIS 129  -6.664   9.041  24.749
  984    HD1  HIS 129           HD1      HIS 129  -9.224   7.465  24.630
  985    HD2  HIS 129           HD2      HIS 129  -7.030   8.428  21.230
  986    HE1  HIS 129           HE1      HIS 129 -10.844   7.331  22.710
  987    HE2  HIS 129           HE2      HIS 129  -9.436   7.683  20.649
  988    H    HIS 130           H        HIS 130  -3.668  10.236  23.665
  989    HA   HIS 130           HA       HIS 130  -1.444   8.931  24.814
  990   1HB   HIS 130          1HB       HIS 130  -2.066  11.891  24.893
  991   2HB   HIS 130          2HB       HIS 130  -0.482  11.144  25.084
  992    HD1  HIS 130           HD1      HIS 130  -1.542  13.210  22.792
  993    HD2  HIS 130           HD2      HIS 130  -0.766   9.144  22.411
  994    HE1  HIS 130           HE1      HIS 130  -1.130  12.822  20.343
  995    HE2  HIS 130           HE2      HIS 130  -0.995  10.319  20.121
  996    H    HIS 131           H        HIS 131  -3.734  11.230  26.294
  997    HA   HIS 131           HA       HIS 131  -3.738   9.489  28.630
  998   1HB   HIS 131          1HB       HIS 131  -3.455  11.235  30.246
  999   2HB   HIS 131          2HB       HIS 131  -2.112  11.337  29.122
 1000    HD1  HIS 131           HD1      HIS 131  -1.941  13.456  27.661
 1001    HD2  HIS 131           HD2      HIS 131  -5.194  13.429  30.258
 1002    HE1  HIS 131           HE1      HIS 131  -2.823  15.816  27.677
 1003    HE2  HIS 131           HE2      HIS 131  -4.706  15.804  29.357
 1004    H    HIS 132           H        HIS 132  -5.161  12.124  26.811
 1005    HA   HIS 132           HA       HIS 132  -7.799  11.070  27.279
 1006   1HB   HIS 132          1HB       HIS 132  -6.916  13.641  28.521
 1007   2HB   HIS 132          2HB       HIS 132  -8.537  13.562  27.843
 1008    HD1  HIS 132           HD1      HIS 132 -10.258  12.044  29.038
 1009    HD2  HIS 132           HD2      HIS 132  -6.538  12.215  30.895
 1010    HE1  HIS 132           HE1      HIS 132 -10.582  11.019  31.315
 1011    HE2  HIS 132           HE2      HIS 132  -8.336  11.184  32.446
  Start of MODEL   15
    1   1H    MET   1          1HT       MET   1 -15.534  21.629  -0.796
    2   2H    MET   1          2HT       MET   1 -16.032  20.007  -0.850
    3   3H    MET   1          3HT       MET   1 -16.415  21.059  -2.128
    4    HA   MET   1           HA       MET   1 -13.693  20.198  -1.343
    5   1HB   MET   1          1HB       MET   1 -15.089  18.448  -2.453
    6   2HB   MET   1          2HB       MET   1 -15.311  19.537  -3.815
    7   1HG   MET   1          1HG       MET   1 -12.930  19.498  -4.269
    8   2HG   MET   1          2HG       MET   1 -12.662  18.469  -2.865
    9   1HE   MET   1          1HE       MET   1 -11.354  16.688  -4.264
   10   2HE   MET   1          2HE       MET   1 -11.521  17.709  -5.692
   11   3HE   MET   1          3HE       MET   1 -11.935  15.998  -5.780
   12    HA   PRO   2           HA       PRO   2 -12.536  24.023  -3.270
   13   1HB   PRO   2          1HB       PRO   2  -9.870  22.836  -3.596
   14   2HB   PRO   2          2HB       PRO   2 -10.368  24.224  -2.625
   15   1HG   PRO   2          1HG       PRO   2  -9.642  21.882  -1.507
   16   2HG   PRO   2          2HG       PRO   2 -10.885  22.926  -0.793
   17   1HD   PRO   2          1HD       PRO   2 -11.206  20.436  -2.428
   18   2HD   PRO   2          2HD       PRO   2 -12.101  20.959  -0.986
   19    H    LEU   3           H        LEU   3 -13.907  23.115  -5.110
   20    HA   LEU   3           HA       LEU   3 -14.234  23.022  -7.346
   21   1HB   LEU   3          1HB       LEU   3 -11.304  23.733  -7.528
   22   2HB   LEU   3          2HB       LEU   3 -12.443  23.769  -8.858
   23    HG   LEU   3           HG       LEU   3 -12.595  25.517  -6.399
   24   1HD1  LEU   3          1HD1      LEU   3 -11.767  26.173  -9.221
   25   2HD1  LEU   3          2HD1      LEU   3 -11.931  27.321  -7.893
   26   3HD1  LEU   3          3HD1      LEU   3 -10.692  26.069  -7.827
   27   1HD2  LEU   3          1HD2      LEU   3 -14.329  26.715  -7.620
   28   2HD2  LEU   3          2HD2      LEU   3 -14.207  25.562  -8.950
   29   3HD2  LEU   3          3HD2      LEU   3 -14.789  25.030  -7.372
   30    H    ASN   4           H        ASN   4 -13.221  21.982  -9.437
   31    HA   ASN   4           HA       ASN   4 -11.479  19.742  -9.007
   32   1HB   ASN   4          1HB       ASN   4 -12.940  17.974  -9.576
   33   2HB   ASN   4          2HB       ASN   4 -13.845  18.921  -8.404
   34   1HD2  ASN   4          2HD2      ASN   4 -15.624  20.138  -9.101
   35   2HD2  ASN   4          1HD2      ASN   4 -16.378  19.848 -10.636
   36    H    GLN   5           H        GLN   5 -10.820  18.796 -11.086
   37    HA   GLN   5           HA       GLN   5 -11.531  20.353 -13.439
   38   1HB   GLN   5          1HB       GLN   5  -9.646  21.510 -12.052
   39   2HB   GLN   5          2HB       GLN   5  -8.627  20.227 -12.690
   40   1HG   GLN   5          1HG       GLN   5  -8.292  21.955 -14.183
   41   2HG   GLN   5          2HG       GLN   5  -9.504  20.962 -14.990
   42   1HE2  GLN   5          2HE2      GLN   5 -11.645  21.723 -15.127
   43   2HE2  GLN   5          1HE2      GLN   5 -12.023  23.391 -14.868
   44    H    GLU   6           H        GLU   6 -11.413  19.122 -15.228
   45    HA   GLU   6           HA       GLU   6 -10.494  16.427 -15.098
   46   1HB   GLU   6          1HB       GLU   6 -11.256  18.154 -17.459
   47   2HB   GLU   6          2HB       GLU   6 -10.925  16.430 -17.554
   48   1HG   GLU   6          1HG       GLU   6 -12.807  15.957 -16.112
   49   2HG   GLU   6          2HG       GLU   6 -13.111  17.683 -15.910
   50    H    HIS   7           H        HIS   7  -8.639  15.552 -15.721
   51    HA   HIS   7           HA       HIS   7  -6.468  15.308 -16.250
   52   1HB   HIS   7          1HB       HIS   7  -7.455  17.051 -18.241
   53   2HB   HIS   7          2HB       HIS   7  -5.877  17.667 -17.758
   54    HD1  HIS   7           HD1      HIS   7  -4.248  16.850 -19.426
   55    HD2  HIS   7           HD2      HIS   7  -7.018  13.930 -18.396
   56    HE1  HIS   7           HE1      HIS   7  -3.516  14.768 -20.631
   57    HE2  HIS   7           HE2      HIS   7  -5.111  12.975 -19.852
   58    HA   PRO   8           HA       PRO   8  -4.879  18.413 -13.272
   59   1HB   PRO   8          1HB       PRO   8  -5.409  17.236 -10.927
   60   2HB   PRO   8          2HB       PRO   8  -6.645  18.167 -11.780
   61   1HG   PRO   8          1HG       PRO   8  -6.416  15.251 -11.410
   62   2HG   PRO   8          2HG       PRO   8  -7.849  16.232 -11.755
   63   1HD   PRO   8          1HD       PRO   8  -6.217  14.720 -13.599
   64   2HD   PRO   8          2HD       PRO   8  -7.705  15.631 -13.932
   65    H    ASP   9           H        ASP   9  -3.801  16.057 -14.731
   66    HA   ASP   9           HA       ASP   9  -2.364  14.314 -13.071
   67   1HB   ASP   9          1HB       ASP   9  -1.569  15.159 -15.862
   68   2HB   ASP   9          2HB       ASP   9  -1.176  13.648 -15.052
   69    H    TYR  10           H        TYR  10  -1.052  15.137 -11.536
   70    HA   TYR  10           HA       TYR  10   1.119  16.915 -12.427
   71   1HB   TYR  10          1HB       TYR  10   0.096  16.382  -9.626
   72   2HB   TYR  10          2HB       TYR  10   1.467  17.414 -10.018
   73    HD1  TYR  10           HD1      TYR  10  -1.851  17.482  -9.124
   74    HD2  TYR  10           HD2      TYR  10   0.799  19.229 -11.958
   75    HE1  TYR  10           HE1      TYR  10  -3.380  19.390  -9.368
   76    HE2  TYR  10           HE2      TYR  10  -0.724  21.143 -12.209
   77    HH   TYR  10           HH       TYR  10  -3.073  21.678 -11.886
   78    H    THR  11           H        THR  11   3.260  16.365 -11.907
   79    HA   THR  11           HA       THR  11   3.781  13.554 -11.825
   80    HB   THR  11           HB       THR  11   6.203  14.327 -11.725
   81    HG1  THR  11           HG1      THR  11   6.156  16.356 -10.924
   82   1HG2  THR  11          1HG2      THR  11   4.491  15.404 -13.968
   83   2HG2  THR  11          2HG2      THR  11   6.222  15.081 -14.050
   84   3HG2  THR  11          3HG2      THR  11   5.084  13.750 -13.831
   85    H    TYR  12           H        TYR  12   3.381  12.547  -9.915
   86    HA   TYR  12           HA       TYR  12   3.818  13.775  -7.391
   87   1HB   TYR  12          1HB       TYR  12   3.224  11.679  -6.407
   88   2HB   TYR  12          2HB       TYR  12   2.202  11.882  -7.821
   89    HD1  TYR  12           HD1      TYR  12   4.632   9.819  -6.176
   90    HD2  TYR  12           HD2      TYR  12   2.773  10.583  -9.925
   91    HE1  TYR  12           HE1      TYR  12   5.360   7.616  -6.976
   92    HE2  TYR  12           HE2      TYR  12   3.498   8.376 -10.738
   93    HH   TYR  12           HH       TYR  12   5.403   6.742 -10.164
   94    H    ALA  13           H        ALA  13   5.616  13.932  -6.222
   95    HA   ALA  13           HA       ALA  13   8.051  12.762  -7.331
   96   1HB   ALA  13          1HB       ALA  13   9.241  14.364  -5.966
   97   2HB   ALA  13          2HB       ALA  13   7.977  15.176  -6.888
   98   3HB   ALA  13          3HB       ALA  13   7.737  14.841  -5.173
   99    H    LEU  14           H        LEU  14   6.664  13.239  -4.084
  100    HA   LEU  14           HA       LEU  14   6.984  12.178  -2.106
  101   1HB   LEU  14          1HB       LEU  14   5.766  10.400  -3.342
  102   2HB   LEU  14          2HB       LEU  14   7.304   9.728  -3.846
  103    HG   LEU  14           HG       LEU  14   7.862   9.323  -1.454
  104   1HD1  LEU  14          1HD1      LEU  14   5.001  10.153  -0.996
  105   2HD1  LEU  14          2HD1      LEU  14   6.072   9.431   0.205
  106   3HD1  LEU  14          3HD1      LEU  14   6.436  11.026  -0.456
  107   1HD2  LEU  14          1HD2      LEU  14   6.372   7.407  -1.187
  108   2HD2  LEU  14          2HD2      LEU  14   5.304   8.057  -2.431
  109   3HD2  LEU  14          3HD2      LEU  14   6.940   7.548  -2.849
  110    H    ARG  15           H        ARG  15   8.976  13.384  -1.909
  111    HA   ARG  15           HA       ARG  15  11.409  11.785  -2.372
  112   1HB   ARG  15          1HB       ARG  15  11.123  14.788  -2.187
  113   2HB   ARG  15          2HB       ARG  15  12.624  13.918  -2.462
  114   1HG   ARG  15          1HG       ARG  15  11.717  13.070  -4.585
  115   2HG   ARG  15          2HG       ARG  15  10.251  14.016  -4.312
  116   1HD   ARG  15          1HD       ARG  15  11.602  16.066  -4.253
  117   2HD   ARG  15          2HD       ARG  15  13.050  15.111  -4.557
  118    HE   ARG  15           HE       ARG  15  10.829  15.436  -6.474
  119   1HH1  ARG  15          1HH1      ARG  15  14.226  14.894  -5.754
  120   2HH1  ARG  15          2HH1      ARG  15  14.720  15.005  -7.421
  121   1HH2  ARG  15          1HH2      ARG  15  11.489  15.576  -8.668
  122   2HH2  ARG  15          2HH2      ARG  15  13.172  15.371  -9.062
  123    H    ALA  16           H        ALA  16   9.421  12.411   0.063
  124    HA   ALA  16           HA       ALA  16  11.557  12.463   2.036
  125   1HB   ALA  16          1HB       ALA  16  11.007  14.821   1.687
  126   2HB   ALA  16          2HB       ALA  16   9.320  14.482   2.076
  127   3HB   ALA  16          3HB       ALA  16  10.566  14.282   3.308
  128    H    ALA  17           H        ALA  17  11.177  11.101   3.612
  129    HA   ALA  17           HA       ALA  17   8.396  10.353   4.249
  130   1HB   ALA  17          1HB       ALA  17   9.445   8.556   2.965
  131   2HB   ALA  17          2HB       ALA  17  10.775   8.496   4.122
  132   3HB   ALA  17          3HB       ALA  17   9.144   8.051   4.629
  133    H    ASP  18           H        ASP  18   7.917  10.833   6.294
  134    HA   ASP  18           HA       ASP  18  10.134  10.982   8.236
  135   1HB   ASP  18          1HB       ASP  18   7.636  12.665   8.024
  136   2HB   ASP  18          2HB       ASP  18   8.689  12.674   9.435
  137    H    GLY  19           H        GLY  19   7.752   9.005   7.421
  138   1HA   GLY  19          1HA       GLY  19   6.913   7.213   8.638
  139   2HA   GLY  19          2HA       GLY  19   7.528   7.955  10.107
  140    H    ARG  20           H        ARG  20   6.326  10.254  10.416
  141    HA   ARG  20           HA       ARG  20   3.558   9.491  10.800
  142   1HB   ARG  20          1HB       ARG  20   5.100  11.929  11.693
  143   2HB   ARG  20          2HB       ARG  20   3.387  11.698  12.004
  144   1HG   ARG  20          1HG       ARG  20   4.217  10.907  13.955
  145   2HG   ARG  20          2HG       ARG  20   4.249   9.411  13.018
  146   1HD   ARG  20          1HD       ARG  20   6.345   9.569  14.103
  147   2HD   ARG  20          2HD       ARG  20   6.629   9.982  12.412
  148    HE   ARG  20           HE       ARG  20   6.107  12.297  14.006
  149   1HH1  ARG  20          1HH1      ARG  20   8.605  10.006  13.101
  150   2HH1  ARG  20          2HH1      ARG  20   9.913  11.090  13.485
  151   1HH2  ARG  20          1HH2      ARG  20   7.826  13.708  14.520
  152   2HH2  ARG  20          2HH2      ARG  20   9.470  13.191  14.295
  153    H    HIS  21           H        HIS  21   5.303  11.093   8.418
  154    HA   HIS  21           HA       HIS  21   2.926  11.692   6.979
  155   1HB   HIS  21          1HB       HIS  21   3.241  14.107   6.697
  156   2HB   HIS  21          2HB       HIS  21   2.932  13.703   8.378
  157    HD1  HIS  21           HD1      HIS  21   4.484  14.719  10.027
  158    HD2  HIS  21           HD2      HIS  21   6.112  14.624   6.194
  159    HE1  HIS  21           HE1      HIS  21   6.645  16.012  10.166
  160    HE2  HIS  21           HE2      HIS  21   7.561  16.024   7.814
  161    H    ALA  22           H        ALA  22   3.374  12.485   4.801
  162    HA   ALA  22           HA       ALA  22   6.171  12.112   3.968
  163   1HB   ALA  22          1HB       ALA  22   5.439  10.814   2.034
  164   2HB   ALA  22          2HB       ALA  22   4.960  10.024   3.535
  165   3HB   ALA  22          3HB       ALA  22   3.767  10.914   2.588
  166    H    LYS  23           H        LYS  23   6.784  13.305   2.126
  167    HA   LYS  23           HA       LYS  23   5.040  15.597   1.629
  168   1HB   LYS  23          1HB       LYS  23   7.953  15.128   1.018
  169   2HB   LYS  23          2HB       LYS  23   7.068  16.541   0.469
  170   1HG   LYS  23          1HG       LYS  23   6.556  17.033   2.876
  171   2HG   LYS  23          2HG       LYS  23   7.696  15.749   3.296
  172   1HD   LYS  23          1HD       LYS  23   9.449  16.907   2.033
  173   2HD   LYS  23          2HD       LYS  23   8.310  18.194   1.643
  174   1HE   LYS  23          1HE       LYS  23   8.068  18.657   4.059
  175   2HE   LYS  23          2HE       LYS  23   9.296  17.432   4.389
  176   1HZ   LYS  23          1HZ       LYS  23   9.649  19.952   2.861
  177   2HZ   LYS  23          2HZ       LYS  23  10.340  19.564   4.362
  178   3HZ   LYS  23          3HZ       LYS  23  10.826  18.734   2.963
  179    H    VAL  24           H        VAL  24   3.657  15.352   0.033
  180    HA   VAL  24           HA       VAL  24   4.513  14.016  -2.426
  181    HB   VAL  24           HB       VAL  24   1.783  15.115  -1.711
  182   1HG1  VAL  24          1HG1      VAL  24   0.995  13.783  -3.612
  183   2HG1  VAL  24          2HG1      VAL  24   2.163  15.002  -4.117
  184   3HG1  VAL  24          3HG1      VAL  24   2.657  13.316  -3.971
  185   1HG2  VAL  24          1HG2      VAL  24   1.151  12.747  -1.398
  186   2HG2  VAL  24          2HG2      VAL  24   2.844  12.293  -1.605
  187   3HG2  VAL  24          3HG2      VAL  24   2.358  13.290  -0.232
  188    H    ASN  25           H        ASN  25   5.900  15.472  -3.285
  189    HA   ASN  25           HA       ASN  25   6.592  17.188  -4.584
  190   1HB   ASN  25          1HB       ASN  25   3.641  17.831  -4.728
  191   2HB   ASN  25          2HB       ASN  25   4.876  18.715  -5.615
  192   1HD2  ASN  25          2HD2      ASN  25   4.009  18.167  -7.582
  193   2HD2  ASN  25          1HD2      ASN  25   4.146  16.563  -8.238
  194    H    GLU  26           H        GLU  26   3.910  19.027  -3.320
  195    HA   GLU  26           HA       GLU  26   5.787  20.603  -1.694
  196   1HB   GLU  26          1HB       GLU  26   3.607  21.643  -3.519
  197   2HB   GLU  26          2HB       GLU  26   4.600  22.633  -2.457
  198   1HG   GLU  26          1HG       GLU  26   6.534  22.257  -3.723
  199   2HG   GLU  26          2HG       GLU  26   5.818  20.884  -4.564
  200    H    GLN  27           H        GLN  27   3.346  18.571  -1.518
  201    HA   GLN  27           HA       GLN  27   1.959  20.050   0.618
  202   1HB   GLN  27          1HB       GLN  27   0.825  17.916  -1.198
  203   2HB   GLN  27          2HB       GLN  27  -0.038  18.705   0.115
  204   1HG   GLN  27          1HG       GLN  27   0.107  20.833  -1.029
  205   2HG   GLN  27          2HG       GLN  27   1.054  20.097  -2.321
  206   1HE2  GLN  27          2HE2      GLN  27  -0.552  17.648  -2.278
  207   2HE2  GLN  27          1HE2      GLN  27  -2.044  18.049  -3.049
  208    H    ILE  28           H        ILE  28   2.029  19.168   2.573
  209    HA   ILE  28           HA       ILE  28   3.346  16.590   2.889
  210    HB   ILE  28           HB       ILE  28   2.525  18.621   4.974
  211   1HG1  ILE  28          1HG1      ILE  28   5.245  18.007   3.792
  212   2HG1  ILE  28          2HG1      ILE  28   4.277  19.432   3.431
  213   1HG2  ILE  28          1HG2      ILE  28   3.973  17.345   6.489
  214   2HG2  ILE  28          2HG2      ILE  28   2.629  16.371   5.893
  215   3HG2  ILE  28          3HG2      ILE  28   4.244  16.155   5.217
  216   1HD1  ILE  28          1HD1      ILE  28   4.447  20.127   5.771
  217   2HD1  ILE  28          2HD1      ILE  28   5.443  18.710   6.110
  218   3HD1  ILE  28          3HD1      ILE  28   6.030  19.959   5.011
  219    H    LEU  29           H        LEU  29   2.111  14.836   2.911
  220    HA   LEU  29           HA       LEU  29  -0.638  15.067   3.925
  221   1HB   LEU  29          1HB       LEU  29   0.626  13.049   2.076
  222   2HB   LEU  29          2HB       LEU  29  -0.990  12.881   2.732
  223    HG   LEU  29           HG       LEU  29  -0.048  15.096   0.904
  224   1HD1  LEU  29          1HD1      LEU  29  -1.914  12.775   0.431
  225   2HD1  LEU  29          2HD1      LEU  29  -1.571  14.074  -0.713
  226   3HD1  LEU  29          3HD1      LEU  29  -0.291  12.958  -0.237
  227   1HD2  LEU  29          1HD2      LEU  29  -2.805  14.537   1.996
  228   2HD2  LEU  29          2HD2      LEU  29  -1.744  15.842   2.526
  229   3HD2  LEU  29          3HD2      LEU  29  -2.359  15.823   0.874
  230    H    GLN  30           H        GLN  30  -1.309  13.920   5.621
  231    HA   GLN  30           HA       GLN  30   0.357  11.741   6.626
  232   1HB   GLN  30          1HB       GLN  30   0.025  12.566   8.959
  233   2HB   GLN  30          2HB       GLN  30   1.050  13.596   7.973
  234   1HG   GLN  30          1HG       GLN  30  -0.864  15.104   7.616
  235   2HG   GLN  30          2HG       GLN  30  -1.830  14.092   8.690
  236   1HE2  GLN  30          2HE2      GLN  30  -1.060  16.893   8.956
  237   2HE2  GLN  30          1HE2      GLN  30  -0.220  17.016  10.462
  238    H    GLN  31           H        GLN  31  -1.702  11.163   5.179
  239    HA   GLN  31           HA       GLN  31  -3.765  10.282   7.075
  240   1HB   GLN  31          1HB       GLN  31  -4.237  11.375   4.288
  241   2HB   GLN  31          2HB       GLN  31  -5.464  10.600   5.277
  242   1HG   GLN  31          1HG       GLN  31  -3.991  13.105   6.056
  243   2HG   GLN  31          2HG       GLN  31  -5.566  13.078   5.264
  244   1HE2  GLN  31          2HE2      GLN  31  -6.453  10.720   6.730
  245   2HE2  GLN  31          1HE2      GLN  31  -6.800  11.252   8.334
  246    H    SER  32           H        SER  32  -5.251   8.692   5.501
  247    HA   SER  32           HA       SER  32  -3.370   6.664   4.574
  248   1HB   SER  32          1HB       SER  32  -6.366   6.452   4.959
  249   2HB   SER  32          2HB       SER  32  -5.237   5.121   4.697
  250    HG   SER  32           HG       SER  32  -5.612   5.227   6.873
  251    H    PHE  33           H        PHE  33  -2.967   6.462   2.461
  252    HA   PHE  33           HA       PHE  33  -5.086   6.890   0.532
  253   1HB   PHE  33          1HB       PHE  33  -3.760   8.472  -0.839
  254   2HB   PHE  33          2HB       PHE  33  -4.217   9.147   0.719
  255    HD1  PHE  33           HD1      PHE  33  -2.539   9.562   2.436
  256    HD2  PHE  33           HD2      PHE  33  -1.459   8.023  -1.384
  257    HE1  PHE  33           HE1      PHE  33  -0.188  10.143   2.868
  258    HE2  PHE  33           HE2      PHE  33   0.892   8.595  -0.954
  259    HZ   PHE  33           HZ       PHE  33   1.531   9.656   1.173
  260    H    ILE  34           H        ILE  34  -4.713   5.951  -1.465
  261    HA   ILE  34           HA       ILE  34  -2.499   4.021  -1.520
  262    HB   ILE  34           HB       ILE  34  -4.941   4.142  -3.302
  263   1HG1  ILE  34          1HG1      ILE  34  -4.403   2.324  -0.942
  264   2HG1  ILE  34          2HG1      ILE  34  -5.490   3.708  -0.910
  265   1HG2  ILE  34          1HG2      ILE  34  -4.316   1.855  -3.924
  266   2HG2  ILE  34          2HG2      ILE  34  -3.040   3.005  -4.322
  267   3HG2  ILE  34          3HG2      ILE  34  -2.883   1.970  -2.902
  268   1HD1  ILE  34          1HD1      ILE  34  -6.718   1.633  -1.176
  269   2HD1  ILE  34          2HD1      ILE  34  -6.885   2.648  -2.611
  270   3HD1  ILE  34          3HD1      ILE  34  -5.796   1.261  -2.633
  271    H    LEU  35           H        LEU  35  -0.772   4.540  -2.686
  272    HA   LEU  35           HA       LEU  35  -1.071   6.575  -4.785
  273   1HB   LEU  35          1HB       LEU  35   0.457   7.156  -2.958
  274   2HB   LEU  35          2HB       LEU  35   1.385   5.701  -3.263
  275    HG   LEU  35           HG       LEU  35   2.035   6.563  -5.468
  276   1HD1  LEU  35          1HD1      LEU  35   0.535   9.049  -4.649
  277   2HD1  LEU  35          2HD1      LEU  35   1.544   8.871  -6.085
  278   3HD1  LEU  35          3HD1      LEU  35   0.062   7.929  -5.925
  279   1HD2  LEU  35          1HD2      LEU  35   3.464   7.006  -3.548
  280   2HD2  LEU  35          2HD2      LEU  35   3.506   8.352  -4.686
  281   3HD2  LEU  35          3HD2      LEU  35   2.561   8.483  -3.204
  282    H    MET  36           H        MET  36  -0.873   6.000  -6.812
  283    HA   MET  36           HA       MET  36   0.824   3.718  -7.534
  284   1HB   MET  36          1HB       MET  36  -1.972   4.267  -8.564
  285   2HB   MET  36          2HB       MET  36  -0.866   3.114  -9.292
  286   1HG   MET  36          1HG       MET  36  -0.876   1.798  -7.244
  287   2HG   MET  36          2HG       MET  36  -1.962   2.968  -6.492
  288   1HE   MET  36          1HE       MET  36  -4.291  -0.147  -7.077
  289   2HE   MET  36          2HE       MET  36  -3.643   0.985  -5.886
  290   3HE   MET  36          3HE       MET  36  -2.576  -0.195  -6.665
  291    HA   PRO  37           HA       PRO  37   2.207   6.539 -10.737
  292   1HB   PRO  37          1HB       PRO  37   2.784   4.753 -12.726
  293   2HB   PRO  37          2HB       PRO  37   3.846   5.056 -11.347
  294   1HG   PRO  37          1HG       PRO  37   1.908   2.824 -11.796
  295   2HG   PRO  37          2HG       PRO  37   3.532   2.773 -11.088
  296   1HD   PRO  37          1HD       PRO  37   1.282   2.720  -9.583
  297   2HD   PRO  37          2HD       PRO  37   2.790   3.468  -9.021
  298    H    ASP  38           H        ASP  38  -0.381   4.328 -11.044
  299    HA   ASP  38           HA       ASP  38  -1.357   5.255 -13.587
  300   1HB   ASP  38          1HB       ASP  38  -2.641   3.530 -11.451
  301   2HB   ASP  38          2HB       ASP  38  -3.355   3.863 -13.025
  302    H    GLU  39           H        GLU  39  -2.217   5.719 -10.176
  303    HA   GLU  39           HA       GLU  39  -3.270   8.315 -10.628
  304   1HB   GLU  39          1HB       GLU  39  -5.609   7.912 -10.092
  305   2HB   GLU  39          2HB       GLU  39  -5.162   7.005 -11.531
  306   1HG   GLU  39          1HG       GLU  39  -4.994   4.970 -10.233
  307   2HG   GLU  39          2HG       GLU  39  -5.346   5.861  -8.753
  308    H    LEU  40           H        LEU  40  -4.503   9.050  -8.569
  309    HA   LEU  40           HA       LEU  40  -3.226   7.835  -6.212
  310   1HB   LEU  40          1HB       LEU  40  -2.327  10.041  -6.593
  311   2HB   LEU  40          2HB       LEU  40  -3.935  10.716  -6.771
  312    HG   LEU  40           HG       LEU  40  -4.376  10.235  -4.379
  313   1HD1  LEU  40          1HD1      LEU  40  -1.470   9.444  -4.313
  314   2HD1  LEU  40          2HD1      LEU  40  -2.519   9.655  -2.909
  315   3HD1  LEU  40          3HD1      LEU  40  -2.849   8.370  -4.072
  316   1HD2  LEU  40          1HD2      LEU  40  -2.939  12.001  -3.486
  317   2HD2  LEU  40          2HD2      LEU  40  -1.925  11.900  -4.924
  318   3HD2  LEU  40          3HD2      LEU  40  -3.599  12.434  -5.062
  319    H    VAL  41           H        VAL  41  -4.557   7.023  -4.727
  320    HA   VAL  41           HA       VAL  41  -7.379   7.884  -4.769
  321    HB   VAL  41           HB       VAL  41  -6.299   5.267  -3.696
  322   1HG1  VAL  41          1HG1      VAL  41  -8.346   6.012  -2.600
  323   2HG1  VAL  41          2HG1      VAL  41  -9.127   6.209  -4.169
  324   3HG1  VAL  41          3HG1      VAL  41  -8.657   4.602  -3.615
  325   1HG2  VAL  41          1HG2      VAL  41  -7.297   4.213  -5.659
  326   2HG2  VAL  41          2HG2      VAL  41  -7.756   5.796  -6.284
  327   3HG2  VAL  41          3HG2      VAL  41  -6.052   5.370  -6.127
  328    H    GLU  42           H        GLU  42  -7.164   9.595  -3.352
  329    HA   GLU  42           HA       GLU  42  -5.887   9.140  -0.774
  330   1HB   GLU  42          1HB       GLU  42  -6.025  11.478  -0.419
  331   2HB   GLU  42          2HB       GLU  42  -5.578  11.272  -2.104
  332   1HG   GLU  42          1HG       GLU  42  -8.373  11.821  -1.139
  333   2HG   GLU  42          2HG       GLU  42  -7.242  13.056  -1.684
  334    H    HIS  43           H        HIS  43  -8.999   9.170  -2.193
  335    HA   HIS  43           HA       HIS  43 -10.439   9.513   0.281
  336   1HB   HIS  43          1HB       HIS  43 -11.250   8.815  -2.533
  337   2HB   HIS  43          2HB       HIS  43 -12.395   8.714  -1.201
  338    HD1  HIS  43           HD1      HIS  43 -10.409  11.203  -3.210
  339    HD2  HIS  43           HD2      HIS  43 -13.378  11.142  -0.294
  340    HE1  HIS  43           HE1      HIS  43 -11.319  13.550  -3.110
  341    HE2  HIS  43           HE2      HIS  43 -13.230  13.442  -1.467
  342    H    TRP  44           H        TRP  44  -8.850   7.686   1.048
  343    HA   TRP  44           HA       TRP  44 -10.301   5.130   0.808
  344   1HB   TRP  44          1HB       TRP  44  -7.992   5.175  -0.226
  345   2HB   TRP  44          2HB       TRP  44  -7.349   5.442   1.389
  346    HD1  TRP  44           HD1      TRP  44  -9.981   2.868   0.134
  347    HE1  TRP  44           HE1      TRP  44  -9.213   0.524   0.881
  348    HE3  TRP  44           HE3      TRP  44  -5.561   4.145   2.365
  349    HZ2  TRP  44           HZ2      TRP  44  -7.011  -0.625   2.230
  350    HZ3  TRP  44           HZ3      TRP  44  -4.183   2.363   3.359
  351    HH2  TRP  44           HH2      TRP  44  -4.896   0.030   3.291
  352    HA   PRO  45           HA       PRO  45 -10.745   6.508   5.098
  353   1HB   PRO  45          1HB       PRO  45 -13.089   5.282   5.584
  354   2HB   PRO  45          2HB       PRO  45 -12.985   6.768   4.631
  355   1HG   PRO  45          1HG       PRO  45 -13.262   3.938   3.706
  356   2HG   PRO  45          2HG       PRO  45 -14.067   5.398   3.103
  357   1HD   PRO  45          1HD       PRO  45 -11.894   4.244   1.898
  358   2HD   PRO  45          2HD       PRO  45 -12.300   5.966   1.766
  359    H    VAL  46           H        VAL  46  -8.813   4.961   5.297
  360    HA   VAL  46           HA       VAL  46  -9.692   2.813   7.103
  361    HB   VAL  46           HB       VAL  46  -7.358   2.636   5.184
  362   1HG1  VAL  46          1HG1      VAL  46  -7.012   0.388   6.093
  363   2HG1  VAL  46          2HG1      VAL  46  -6.811   1.620   7.339
  364   3HG1  VAL  46          3HG1      VAL  46  -8.292   0.666   7.273
  365   1HG2  VAL  46          1HG2      VAL  46  -9.517   2.244   4.121
  366   2HG2  VAL  46          2HG2      VAL  46  -8.594   0.746   4.229
  367   3HG2  VAL  46          3HG2      VAL  46  -9.919   1.049   5.354
  368    HA   PRO  47           HA       PRO  47  -6.866   5.539   9.454
  369   1HB   PRO  47          1HB       PRO  47  -8.692   5.239  11.666
  370   2HB   PRO  47          2HB       PRO  47  -8.312   6.697  10.749
  371   1HG   PRO  47          1HG       PRO  47 -10.748   5.429  10.691
  372   2HG   PRO  47          2HG       PRO  47 -10.130   6.465   9.393
  373   1HD   PRO  47          1HD       PRO  47 -10.176   3.477   9.582
  374   2HD   PRO  47          2HD       PRO  47 -10.460   4.525   8.175
  375    H    SER  48           H        SER  48  -5.440   3.719   9.392
  376    HA   SER  48           HA       SER  48  -4.099   2.189  10.396
  377   1HB   SER  48          1HB       SER  48  -5.729   2.762  12.887
  378   2HB   SER  48          2HB       SER  48  -4.172   1.933  12.833
  379    HG   SER  48           HG       SER  48  -4.248   4.407  11.610
  380    H    LEU  49           H        LEU  49  -4.646   0.193  12.285
  381    HA   LEU  49           HA       LEU  49  -6.216  -1.579  10.638
  382   1HB   LEU  49          1HB       LEU  49  -4.767  -2.101  13.234
  383   2HB   LEU  49          2HB       LEU  49  -5.455  -3.325  12.181
  384    HG   LEU  49           HG       LEU  49  -3.165  -1.481  11.482
  385   1HD1  LEU  49          1HD1      LEU  49  -3.206  -4.445  12.023
  386   2HD1  LEU  49          2HD1      LEU  49  -1.804  -3.492  11.536
  387   3HD1  LEU  49          3HD1      LEU  49  -2.562  -3.210  13.104
  388   1HD2  LEU  49          1HD2      LEU  49  -2.967  -2.828   9.452
  389   2HD2  LEU  49          2HD2      LEU  49  -4.410  -3.734   9.908
  390   3HD2  LEU  49          3HD2      LEU  49  -4.531  -2.017   9.531
  391    H    GLY  50           H        GLY  50  -7.922  -2.944  11.531
  392   1HA   GLY  50          1HA       GLY  50  -9.677  -3.274  13.146
  393   2HA   GLY  50          2HA       GLY  50  -9.427  -1.619  13.691
  394    H    GLN  51           H        GLN  51  -9.548  -0.069  11.620
  395    HA   GLN  51           HA       GLN  51 -12.200  -0.410  10.530
  396   1HB   GLN  51          1HB       GLN  51 -10.167   1.809  10.253
  397   2HB   GLN  51          2HB       GLN  51 -11.737   1.830   9.466
  398   1HG   GLN  51          1HG       GLN  51 -12.211   3.045  11.321
  399   2HG   GLN  51          2HG       GLN  51 -12.608   1.434  11.910
  400   1HE2  GLN  51          2HE2      GLN  51 -11.894   3.768  13.425
  401   2HE2  GLN  51          1HE2      GLN  51 -10.486   3.352  14.336
  402    H    LEU  52           H        LEU  52  -9.119  -1.346   9.667
  403    HA   LEU  52           HA       LEU  52  -9.427  -1.253   6.824
  404   1HB   LEU  52          1HB       LEU  52  -7.198  -1.385   7.808
  405   2HB   LEU  52          2HB       LEU  52  -7.592  -2.920   8.554
  406    HG   LEU  52           HG       LEU  52  -7.775  -3.962   6.334
  407   1HD1  LEU  52          1HD1      LEU  52  -6.872  -1.286   5.280
  408   2HD1  LEU  52          2HD1      LEU  52  -7.088  -2.763   4.338
  409   3HD1  LEU  52          3HD1      LEU  52  -8.482  -1.979   5.082
  410   1HD2  LEU  52          1HD2      LEU  52  -5.389  -3.858   5.743
  411   2HD2  LEU  52          2HD2      LEU  52  -5.199  -2.469   6.811
  412   3HD2  LEU  52          3HD2      LEU  52  -5.642  -4.040   7.479
  413    H    GLN  53           H        GLN  53 -11.529  -2.069   6.614
  414    HA   GLN  53           HA       GLN  53 -12.129  -4.775   7.422
  415   1HB   GLN  53          1HB       GLN  53 -13.732  -2.893   5.683
  416   2HB   GLN  53          2HB       GLN  53 -14.319  -4.351   6.469
  417   1HG   GLN  53          1HG       GLN  53 -13.936  -3.315   8.653
  418   2HG   GLN  53          2HG       GLN  53 -13.377  -1.850   7.848
  419   1HE2  GLN  53          2HE2      GLN  53 -15.999  -3.818   6.658
  420   2HE2  GLN  53          1HE2      GLN  53 -17.261  -2.678   6.984
  421    HA   PRO  54           HA       PRO  54 -11.106  -6.915   3.624
  422   1HB   PRO  54          1HB       PRO  54 -13.874  -8.010   3.782
  423   2HB   PRO  54          2HB       PRO  54 -12.335  -8.865   3.615
  424   1HG   PRO  54          1HG       PRO  54 -13.632  -8.848   5.940
  425   2HG   PRO  54          2HG       PRO  54 -11.863  -8.732   5.883
  426   1HD   PRO  54          1HD       PRO  54 -13.890  -6.596   6.387
  427   2HD   PRO  54          2HD       PRO  54 -12.282  -6.818   7.108
  428    H    ALA  55           H        ALA  55 -14.237  -5.332   3.998
  429    HA   ALA  55           HA       ALA  55 -14.671  -5.055   1.172
  430   1HB   ALA  55          1HB       ALA  55 -16.554  -5.270   2.703
  431   2HB   ALA  55          2HB       ALA  55 -16.098  -3.757   3.488
  432   3HB   ALA  55          3HB       ALA  55 -16.634  -3.751   1.809
  433    H    HIS  56           H        HIS  56 -12.766  -3.408   3.425
  434    HA   HIS  56           HA       HIS  56 -12.843  -0.903   1.912
  435   1HB   HIS  56          1HB       HIS  56 -11.821  -1.666   4.605
  436   2HB   HIS  56          2HB       HIS  56 -10.985  -0.365   3.761
  437    HD1  HIS  56           HD1      HIS  56 -12.544   0.242   6.355
  438    HD2  HIS  56           HD2      HIS  56 -14.132   0.583   2.519
  439    HE1  HIS  56           HE1      HIS  56 -14.446   1.873   6.546
  440    HE2  HIS  56           HE2      HIS  56 -15.322   2.152   4.194
  441    H    MET  57           H        MET  57 -10.979  -3.758   2.293
  442    HA   MET  57           HA       MET  57  -8.762  -2.670   0.725
  443   1HB   MET  57          1HB       MET  57  -8.413  -4.249   2.686
  444   2HB   MET  57          2HB       MET  57  -9.161  -5.505   1.712
  445   1HG   MET  57          1HG       MET  57  -6.782  -5.730   1.600
  446   2HG   MET  57          2HG       MET  57  -7.388  -5.218   0.026
  447   1HE   MET  57          1HE       MET  57  -4.308  -5.077   1.088
  448   2HE   MET  57          2HE       MET  57  -3.821  -3.528   0.399
  449   3HE   MET  57          3HE       MET  57  -4.792  -4.647  -0.556
  450    H    ASP  58           H        ASP  58 -11.757  -3.815   0.258
  451    HA   ASP  58           HA       ASP  58 -11.673  -5.810  -1.664
  452   1HB   ASP  58          1HB       ASP  58 -13.694  -5.123  -0.449
  453   2HB   ASP  58          2HB       ASP  58 -13.706  -3.596  -1.321
  454    H    ALA  59           H        ALA  59 -11.592  -2.290  -2.074
  455    HA   ALA  59           HA       ALA  59 -11.735  -2.161  -4.850
  456   1HB   ALA  59          1HB       ALA  59 -11.838  -0.195  -3.398
  457   2HB   ALA  59          2HB       ALA  59 -10.127  -0.388  -3.014
  458   3HB   ALA  59          3HB       ALA  59 -10.622   0.001  -4.661
  459    H    VAL  60           H        VAL  60  -8.909  -2.638  -2.767
  460    HA   VAL  60           HA       VAL  60  -7.027  -2.584  -4.913
  461    HB   VAL  60           HB       VAL  60  -6.634  -3.792  -2.172
  462   1HG1  VAL  60          1HG1      VAL  60  -4.681  -2.658  -4.170
  463   2HG1  VAL  60          2HG1      VAL  60  -4.273  -3.243  -2.557
  464   3HG1  VAL  60          3HG1      VAL  60  -4.896  -4.362  -3.770
  465   1HG2  VAL  60          1HG2      VAL  60  -6.212  -0.936  -3.048
  466   2HG2  VAL  60          2HG2      VAL  60  -7.472  -1.509  -1.955
  467   3HG2  VAL  60          3HG2      VAL  60  -5.778  -1.610  -1.477
  468    H    LEU  61           H        LEU  61  -8.778  -5.084  -3.176
  469    HA   LEU  61           HA       LEU  61  -7.390  -7.301  -4.281
  470   1HB   LEU  61          1HB       LEU  61 -10.178  -7.153  -3.136
  471   2HB   LEU  61          2HB       LEU  61  -9.285  -8.628  -3.448
  472    HG   LEU  61           HG       LEU  61  -8.464  -6.500  -1.469
  473   1HD1  LEU  61          1HD1      LEU  61 -10.499  -7.652  -0.780
  474   2HD1  LEU  61          2HD1      LEU  61  -9.703  -9.209  -1.017
  475   3HD1  LEU  61          3HD1      LEU  61  -9.132  -8.108   0.235
  476   1HD2  LEU  61          1HD2      LEU  61  -6.572  -7.742  -2.408
  477   2HD2  LEU  61          2HD2      LEU  61  -6.834  -8.146  -0.711
  478   3HD2  LEU  61          3HD2      LEU  61  -7.355  -9.261  -1.973
  479    H    ALA  62           H        ALA  62  -9.752  -5.187  -5.529
  480    HA   ALA  62           HA       ALA  62 -10.680  -7.047  -7.558
  481   1HB   ALA  62          1HB       ALA  62 -12.257  -5.460  -6.545
  482   2HB   ALA  62          2HB       ALA  62 -11.310  -4.119  -7.196
  483   3HB   ALA  62          3HB       ALA  62 -12.125  -5.237  -8.289
  484    H    LEU  63           H        LEU  63  -8.631  -4.182  -7.295
  485    HA   LEU  63           HA       LEU  63  -8.209  -3.821 -10.070
  486   1HB   LEU  63          1HB       LEU  63  -6.494  -2.993  -7.728
  487   2HB   LEU  63          2HB       LEU  63  -6.282  -2.430  -9.375
  488    HG   LEU  63           HG       LEU  63  -8.711  -1.921  -7.651
  489   1HD1  LEU  63          1HD1      LEU  63  -7.931   0.394  -7.630
  490   2HD1  LEU  63          2HD1      LEU  63  -6.754  -0.690  -6.886
  491   3HD1  LEU  63          3HD1      LEU  63  -6.486  -0.084  -8.520
  492   1HD2  LEU  63          1HD2      LEU  63  -8.002  -0.913 -10.405
  493   2HD2  LEU  63          2HD2      LEU  63  -9.279  -2.066 -10.017
  494   3HD2  LEU  63          3HD2      LEU  63  -9.391  -0.401  -9.445
  495    H    ASN  64           H        ASN  64  -6.546  -5.674  -7.610
  496    HA   ASN  64           HA       ASN  64  -5.084  -7.393  -7.696
  497   1HB   ASN  64          1HB       ASN  64  -6.003  -7.456 -10.560
  498   2HB   ASN  64          2HB       ASN  64  -4.812  -8.592  -9.935
  499   1HD2  ASN  64          2HD2      ASN  64  -6.062  -8.697  -7.300
  500   2HD2  ASN  64          1HD2      ASN  64  -7.492  -9.648  -7.490
  501    HA   PRO  65           HA       PRO  65  -1.526  -5.000  -9.236
  502   1HB   PRO  65          1HB       PRO  65  -0.472  -4.905  -6.608
  503   2HB   PRO  65          2HB       PRO  65  -1.177  -3.581  -7.535
  504   1HG   PRO  65          1HG       PRO  65  -2.262  -4.704  -5.227
  505   2HG   PRO  65          2HG       PRO  65  -3.132  -3.690  -6.390
  506   1HD   PRO  65          1HD       PRO  65  -3.108  -6.662  -6.105
  507   2HD   PRO  65          2HD       PRO  65  -4.438  -5.581  -6.575
  508    H    ALA  66           H        ALA  66   0.734  -5.708  -9.207
  509    HA   ALA  66           HA       ALA  66   1.061  -8.544  -8.953
  510   1HB   ALA  66          1HB       ALA  66   2.217  -7.270 -10.705
  511   2HB   ALA  66          2HB       ALA  66   3.126  -6.399  -9.469
  512   3HB   ALA  66          3HB       ALA  66   3.359  -8.135  -9.676
  513    H    VAL  67           H        VAL  67   2.030  -5.684  -7.175
  514    HA   VAL  67           HA       VAL  67   2.446  -7.345  -4.821
  515    HB   VAL  67           HB       VAL  67   4.691  -7.182  -5.708
  516   1HG1  VAL  67          1HG1      VAL  67   5.812  -5.026  -6.036
  517   2HG1  VAL  67          2HG1      VAL  67   4.439  -5.229  -7.123
  518   3HG1  VAL  67          3HG1      VAL  67   4.293  -4.195  -5.702
  519   1HG2  VAL  67          1HG2      VAL  67   4.488  -7.077  -3.293
  520   2HG2  VAL  67          2HG2      VAL  67   5.835  -6.077  -3.836
  521   3HG2  VAL  67          3HG2      VAL  67   4.313  -5.322  -3.364
  522    H    ILE  68           H        ILE  68   1.674  -6.439  -3.021
  523    HA   ILE  68           HA       ILE  68   0.814  -3.628  -3.143
  524    HB   ILE  68           HB       ILE  68  -0.032  -5.805  -1.216
  525   1HG1  ILE  68          1HG1      ILE  68  -1.540  -4.526  -3.508
  526   2HG1  ILE  68          2HG1      ILE  68  -0.868  -6.155  -3.514
  527   1HG2  ILE  68          1HG2      ILE  68  -1.719  -4.211  -0.458
  528   2HG2  ILE  68          2HG2      ILE  68  -0.093  -3.568  -0.224
  529   3HG2  ILE  68          3HG2      ILE  68  -1.082  -2.997  -1.568
  530   1HD1  ILE  68          1HD1      ILE  68  -3.018  -5.161  -1.657
  531   2HD1  ILE  68          2HD1      ILE  68  -3.272  -6.149  -3.097
  532   3HD1  ILE  68          3HD1      ILE  68  -2.374  -6.801  -1.725
  533    H    LEU  69           H        LEU  69   1.836  -2.165  -1.931
  534    HA   LEU  69           HA       LEU  69   3.749  -3.150   0.080
  535   1HB   LEU  69          1HB       LEU  69   4.368  -1.695  -2.076
  536   2HB   LEU  69          2HB       LEU  69   3.906  -0.382  -1.012
  537    HG   LEU  69           HG       LEU  69   6.071  -2.412  -0.451
  538   1HD1  LEU  69          1HD1      LEU  69   7.587  -0.503  -0.752
  539   2HD1  LEU  69          2HD1      LEU  69   6.706  -0.902  -2.225
  540   3HD1  LEU  69          3HD1      LEU  69   6.217   0.486  -1.254
  541   1HD2  LEU  69          1HD2      LEU  69   6.648  -0.961   1.438
  542   2HD2  LEU  69          2HD2      LEU  69   5.235   0.037   1.097
  543   3HD2  LEU  69          3HD2      LEU  69   5.026  -1.638   1.605
  544    H    LEU  70           H        LEU  70   3.007  -2.911   2.070
  545    HA   LEU  70           HA       LEU  70   1.020  -0.826   2.621
  546   1HB   LEU  70          1HB       LEU  70   0.404  -3.138   3.179
  547   2HB   LEU  70          2HB       LEU  70   1.811  -3.267   4.216
  548    HG   LEU  70           HG       LEU  70   0.860  -1.486   5.666
  549   1HD1  LEU  70          1HD1      LEU  70  -1.581  -1.810   3.929
  550   2HD1  LEU  70          2HD1      LEU  70  -1.470  -0.851   5.405
  551   3HD1  LEU  70          3HD1      LEU  70  -0.537  -0.389   3.982
  552   1HD2  LEU  70          1HD2      LEU  70  -0.887  -3.903   5.219
  553   2HD2  LEU  70          2HD2      LEU  70   0.555  -3.828   6.232
  554   3HD2  LEU  70          3HD2      LEU  70  -0.878  -2.897   6.668
  555    H    GLY  71           H        GLY  71   1.659   0.960   3.611
  556   1HA   GLY  71          1HA       GLY  71   4.060   0.823   5.336
  557   2HA   GLY  71          2HA       GLY  71   3.582   2.253   4.429
  558    H    THR  72           H        THR  72   3.228   0.488   7.334
  559    HA   THR  72           HA       THR  72   0.786   1.821   8.153
  560    HB   THR  72           HB       THR  72   1.180   0.543  10.304
  561    HG1  THR  72           HG1      THR  72   3.235  -0.060  10.435
  562   1HG2  THR  72          1HG2      THR  72   0.566  -1.619   9.328
  563   2HG2  THR  72          2HG2      THR  72  -0.298  -0.295   8.545
  564   3HG2  THR  72          3HG2      THR  72   1.079  -1.049   7.739
  565    H    GLY  73           H        GLY  73   2.429   3.840   7.716
  566   1HA   GLY  73          1HA       GLY  73   3.653   5.591   8.569
  567   2HA   GLY  73          2HA       GLY  73   2.754   5.277  10.044
  568    H    GLU  74           H        GLU  74   3.712   4.203  11.710
  569    HA   GLU  74           HA       GLU  74   6.433   3.201  11.345
  570   1HB   GLU  74          1HB       GLU  74   6.562   5.502  12.308
  571   2HB   GLU  74          2HB       GLU  74   5.571   4.963  13.655
  572   1HG   GLU  74          1HG       GLU  74   8.038   5.080  14.090
  573   2HG   GLU  74          2HG       GLU  74   7.267   3.540  14.464
  574    H    ARG  75           H        ARG  75   7.015   1.632  12.998
  575    HA   ARG  75           HA       ARG  75   6.611  -0.247  14.215
  576   1HB   ARG  75          1HB       ARG  75   5.165   1.020  15.729
  577   2HB   ARG  75          2HB       ARG  75   3.824   0.870  14.604
  578   1HG   ARG  75          1HG       ARG  75   4.017  -1.630  14.898
  579   2HG   ARG  75          2HG       ARG  75   5.119  -1.292  16.236
  580   1HD   ARG  75          1HD       ARG  75   2.258  -0.368  15.987
  581   2HD   ARG  75          2HD       ARG  75   2.855  -1.634  17.056
  582    HE   ARG  75           HE       ARG  75   4.209   0.219  18.119
  583   1HH1  ARG  75          1HH1      ARG  75   1.156   0.817  16.513
  584   2HH1  ARG  75          2HH1      ARG  75   0.771   2.215  17.474
  585   1HH2  ARG  75          1HH2      ARG  75   3.698   2.052  19.398
  586   2HH2  ARG  75          2HH2      ARG  75   2.214   2.911  19.113
  587    H    GLN  76           H        GLN  76   6.638  -2.019  13.083
  588    HA   GLN  76           HA       GLN  76   5.240  -2.343  10.638
  589   1HB   GLN  76          1HB       GLN  76   7.399  -3.401  11.041
  590   2HB   GLN  76          2HB       GLN  76   6.714  -4.345  12.355
  591   1HG   GLN  76          1HG       GLN  76   5.188  -5.402  10.671
  592   2HG   GLN  76          2HG       GLN  76   6.130  -4.593   9.419
  593   1HE2  GLN  76          2HE2      GLN  76   7.509  -5.814  12.385
  594   2HE2  GLN  76          1HE2      GLN  76   8.415  -7.101  11.659
  595    H    GLN  77           H        GLN  77   3.154  -2.802  10.420
  596    HA   GLN  77           HA       GLN  77   1.895  -4.578  12.397
  597   1HB   GLN  77          1HB       GLN  77   0.799  -2.031  11.215
  598   2HB   GLN  77          2HB       GLN  77  -0.215  -3.226  12.011
  599   1HG   GLN  77          1HG       GLN  77   2.122  -1.849  13.314
  600   2HG   GLN  77          2HG       GLN  77   0.445  -1.320  13.454
  601   1HE2  GLN  77          2HE2      GLN  77   2.753  -3.794  14.290
  602   2HE2  GLN  77          1HE2      GLN  77   1.805  -4.524  15.542
  603    H    PHE  78           H        PHE  78   0.762  -6.222  11.601
  604    HA   PHE  78           HA       PHE  78   0.326  -6.326   8.696
  605   1HB   PHE  78          1HB       PHE  78   0.439  -8.529  10.773
  606   2HB   PHE  78          2HB       PHE  78   0.007  -8.790   9.088
  607    HD1  PHE  78           HD1      PHE  78   2.715  -8.071  11.426
  608    HD2  PHE  78           HD2      PHE  78   1.676  -8.652   7.342
  609    HE1  PHE  78           HE1      PHE  78   5.092  -8.360  10.866
  610    HE2  PHE  78           HE2      PHE  78   4.052  -8.939   6.774
  611    HZ   PHE  78           HZ       PHE  78   5.763  -8.794   8.537
  612    HA   PRO  79           HA       PRO  79  -4.071  -5.957   9.249
  613   1HB   PRO  79          1HB       PRO  79  -4.295  -7.945   7.066
  614   2HB   PRO  79          2HB       PRO  79  -4.941  -6.303   7.161
  615   1HG   PRO  79          1HG       PRO  79  -2.861  -6.881   5.586
  616   2HG   PRO  79          2HG       PRO  79  -2.951  -5.342   6.467
  617   1HD   PRO  79          1HD       PRO  79  -1.357  -7.798   7.090
  618   2HD   PRO  79          2HD       PRO  79  -0.894  -6.089   7.230
  619    H    SER  80           H        SER  80  -5.927  -7.235   9.841
  620    HA   SER  80           HA       SER  80  -5.247  -9.428  11.516
  621   1HB   SER  80          1HB       SER  80  -7.806  -9.522  11.771
  622   2HB   SER  80          2HB       SER  80  -6.995  -8.042  12.288
  623    HG   SER  80           HG       SER  80  -8.924  -7.804  10.911
  624    H    THR  81           H        THR  81  -6.491 -11.517  11.429
  625    HA   THR  81           HA       THR  81  -5.882 -12.928   9.092
  626    HB   THR  81           HB       THR  81  -7.965 -13.760  11.120
  627    HG1  THR  81           HG1      THR  81  -6.064 -13.126  12.219
  628   1HG2  THR  81          1HG2      THR  81  -6.041 -15.346   9.410
  629   2HG2  THR  81          2HG2      THR  81  -7.147 -16.024  10.604
  630   3HG2  THR  81          3HG2      THR  81  -7.783 -15.220   9.170
  631    H    ASP  82           H        ASP  82  -8.712 -11.164  10.037
  632    HA   ASP  82           HA       ASP  82 -10.649 -12.175   8.303
  633   1HB   ASP  82          1HB       ASP  82 -10.299  -9.270   9.093
  634   2HB   ASP  82          2HB       ASP  82 -11.793 -10.057   8.599
  635    H    VAL  83           H        VAL  83  -8.182  -9.694   7.813
  636    HA   VAL  83           HA       VAL  83  -9.002  -9.216   5.076
  637    HB   VAL  83           HB       VAL  83  -6.583  -8.144   6.540
  638   1HG1  VAL  83          1HG1      VAL  83  -7.989  -7.187   4.049
  639   2HG1  VAL  83          2HG1      VAL  83  -6.651  -6.364   4.852
  640   3HG1  VAL  83          3HG1      VAL  83  -6.401  -7.951   4.126
  641   1HG2  VAL  83          1HG2      VAL  83  -7.915  -6.136   6.953
  642   2HG2  VAL  83          2HG2      VAL  83  -9.321  -6.918   6.231
  643   3HG2  VAL  83          3HG2      VAL  83  -8.629  -7.554   7.723
  644    H    LEU  84           H        LEU  84  -6.377 -10.793   6.819
  645    HA   LEU  84           HA       LEU  84  -4.612 -11.256   4.719
  646   1HB   LEU  84          1HB       LEU  84  -5.176 -12.955   7.147
  647   2HB   LEU  84          2HB       LEU  84  -3.814 -13.198   6.071
  648    HG   LEU  84           HG       LEU  84  -4.309 -10.741   7.752
  649   1HD1  LEU  84          1HD1      LEU  84  -3.657 -12.667   9.083
  650   2HD1  LEU  84          2HD1      LEU  84  -2.288 -12.963   8.010
  651   3HD1  LEU  84          3HD1      LEU  84  -2.337 -11.500   8.995
  652   1HD2  LEU  84          1HD2      LEU  84  -1.983 -11.460   5.970
  653   2HD2  LEU  84          2HD2      LEU  84  -3.185 -10.211   5.643
  654   3HD2  LEU  84          3HD2      LEU  84  -2.088 -10.044   7.015
  655    H    ALA  85           H        ALA  85  -7.462 -13.072   5.703
  656    HA   ALA  85           HA       ALA  85  -7.088 -15.366   4.162
  657   1HB   ALA  85          1HB       ALA  85  -9.500 -15.699   4.358
  658   2HB   ALA  85          2HB       ALA  85  -8.800 -15.182   5.892
  659   3HB   ALA  85          3HB       ALA  85  -9.690 -14.030   4.896
  660    H    ALA  86           H        ALA  86  -8.371 -12.214   3.278
  661    HA   ALA  86           HA       ALA  86  -9.341 -13.102   0.719
  662   1HB   ALA  86          1HB       ALA  86  -9.015 -10.309   1.804
  663   2HB   ALA  86          2HB       ALA  86  -9.902 -10.759   0.347
  664   3HB   ALA  86          3HB       ALA  86 -10.465 -11.303   1.927
  665    H    CYS  87           H        CYS  87  -6.346 -12.045   1.966
  666    HA   CYS  87           HA       CYS  87  -5.351 -11.156  -0.624
  667   1HB   CYS  87          1HB       CYS  87  -4.739 -10.007   1.540
  668   2HB   CYS  87          2HB       CYS  87  -3.827 -11.449   1.973
  669    HG   CYS  87           HG       CYS  87  -1.919 -11.196   0.019
  670    H    LEU  88           H        LEU  88  -5.035 -13.837   1.628
  671    HA   LEU  88           HA       LEU  88  -2.890 -15.087   0.188
  672   1HB   LEU  88          1HB       LEU  88  -4.683 -16.185   2.350
  673   2HB   LEU  88          2HB       LEU  88  -3.234 -16.961   1.743
  674    HG   LEU  88           HG       LEU  88  -3.320 -14.312   3.192
  675   1HD1  LEU  88          1HD1      LEU  88  -2.342 -17.018   4.096
  676   2HD1  LEU  88          2HD1      LEU  88  -2.245 -15.514   5.014
  677   3HD1  LEU  88          3HD1      LEU  88  -3.817 -16.218   4.644
  678   1HD2  LEU  88          1HD2      LEU  88  -0.882 -14.500   3.216
  679   2HD2  LEU  88          2HD2      LEU  88  -0.982 -15.963   2.237
  680   3HD2  LEU  88          3HD2      LEU  88  -1.504 -14.416   1.568
  681    H    THR  89           H        THR  89  -6.373 -15.276   0.122
  682    HA   THR  89           HA       THR  89  -6.669 -17.779  -1.110
  683    HB   THR  89           HB       THR  89  -8.796 -16.556  -2.106
  684    HG1  THR  89           HG1      THR  89  -8.552 -14.931   0.143
  685   1HG2  THR  89          1HG2      THR  89  -8.423 -17.102   0.840
  686   2HG2  THR  89          2HG2      THR  89  -9.968 -17.010  -0.007
  687   3HG2  THR  89          3HG2      THR  89  -8.828 -18.300  -0.390
  688    H    ARG  90           H        ARG  90  -6.247 -14.549  -2.529
  689    HA   ARG  90           HA       ARG  90  -6.187 -15.720  -5.193
  690   1HB   ARG  90          1HB       ARG  90  -5.843 -12.827  -4.372
  691   2HB   ARG  90          2HB       ARG  90  -6.046 -13.425  -6.015
  692   1HG   ARG  90          1HG       ARG  90  -8.273 -14.388  -5.166
  693   2HG   ARG  90          2HG       ARG  90  -8.054 -13.296  -3.798
  694   1HD   ARG  90          1HD       ARG  90  -9.412 -12.189  -5.430
  695   2HD   ARG  90          2HD       ARG  90  -7.825 -11.417  -5.419
  696    HE   ARG  90           HE       ARG  90  -7.699 -13.369  -7.370
  697   1HH1  ARG  90          1HH1      ARG  90  -9.650 -10.510  -6.781
  698   2HH1  ARG  90          2HH1      ARG  90  -9.917 -10.192  -8.466
  699   1HH2  ARG  90          1HH2      ARG  90  -8.070 -12.978  -9.568
  700   2HH2  ARG  90          2HH2      ARG  90  -9.015 -11.607 -10.068
  701    H    GLY  91           H        GLY  91  -4.039 -14.940  -2.704
  702   1HA   GLY  91          1HA       GLY  91  -1.777 -15.369  -2.567
  703   2HA   GLY  91          2HA       GLY  91  -1.805 -15.844  -4.259
  704    H    ILE  92           H        ILE  92  -2.565 -12.797  -2.592
  705    HA   ILE  92           HA       ILE  92  -0.983 -11.379  -4.590
  706    HB   ILE  92           HB       ILE  92  -2.616 -10.200  -2.336
  707   1HG1  ILE  92          1HG1      ILE  92  -4.055 -11.560  -3.795
  708   2HG1  ILE  92          2HG1      ILE  92  -4.393  -9.845  -3.993
  709   1HG2  ILE  92          1HG2      ILE  92  -2.582  -8.177  -3.723
  710   2HG2  ILE  92          2HG2      ILE  92  -0.958  -8.689  -3.267
  711   3HG2  ILE  92          3HG2      ILE  92  -1.557  -9.007  -4.895
  712   1HD1  ILE  92          1HD1      ILE  92  -3.077  -9.834  -6.055
  713   2HD1  ILE  92          2HD1      ILE  92  -2.766 -11.558  -5.858
  714   3HD1  ILE  92          3HD1      ILE  92  -4.412 -10.984  -6.127
  715    H    GLY  93           H        GLY  93   0.953 -10.460  -4.185
  716   1HA   GLY  93          1HA       GLY  93   2.338 -11.137  -1.775
  717   2HA   GLY  93          2HA       GLY  93   2.970 -10.176  -3.106
  718    H    LEU  94           H        LEU  94   2.188 -10.082   0.075
  719    HA   LEU  94           HA       LEU  94   1.566  -7.205   0.019
  720   1HB   LEU  94          1HB       LEU  94  -0.205  -8.525   1.034
  721   2HB   LEU  94          2HB       LEU  94   0.943  -9.283   2.120
  722    HG   LEU  94           HG       LEU  94   1.351  -7.070   3.175
  723   1HD1  LEU  94          1HD1      LEU  94  -0.948  -6.180   1.441
  724   2HD1  LEU  94          2HD1      LEU  94  -0.196  -5.241   2.731
  725   3HD1  LEU  94          3HD1      LEU  94   0.730  -5.654   1.287
  726   1HD2  LEU  94          1HD2      LEU  94  -0.787  -6.980   4.371
  727   2HD2  LEU  94          2HD2      LEU  94  -1.514  -8.009   3.136
  728   3HD2  LEU  94          3HD2      LEU  94  -0.222  -8.637   4.160
  729    H    GLU  95           H        GLU  95   3.409  -6.128   0.259
  730    HA   GLU  95           HA       GLU  95   5.441  -7.079   2.141
  731   1HB   GLU  95          1HB       GLU  95   5.451  -4.743   0.213
  732   2HB   GLU  95          2HB       GLU  95   6.800  -5.205   1.236
  733   1HG   GLU  95          1HG       GLU  95   5.596  -6.963  -0.887
  734   2HG   GLU  95          2HG       GLU  95   7.014  -5.939  -1.117
  735    H    ALA  96           H        ALA  96   4.909  -6.558   4.204
  736    HA   ALA  96           HA       ALA  96   3.629  -3.977   4.726
  737   1HB   ALA  96          1HB       ALA  96   2.570  -5.972   5.674
  738   2HB   ALA  96          2HB       ALA  96   4.043  -6.319   6.578
  739   3HB   ALA  96          3HB       ALA  96   3.115  -4.862   6.932
  740    H    MET  97           H        MET  97   4.916  -2.334   5.157
  741    HA   MET  97           HA       MET  97   7.134  -2.699   7.023
  742   1HB   MET  97          1HB       MET  97   7.402  -1.451   4.281
  743   2HB   MET  97          2HB       MET  97   8.584  -1.237   5.562
  744   1HG   MET  97          1HG       MET  97   8.962  -3.662   5.601
  745   2HG   MET  97          2HG       MET  97   7.804  -3.848   4.283
  746   1HE   MET  97          1HE       MET  97   8.179  -2.879   1.840
  747   2HE   MET  97          2HE       MET  97   9.600  -1.951   1.361
  748   3HE   MET  97          3HE       MET  97   8.449  -1.270   2.511
  749    H    THR  98           H        THR  98   8.161  -0.200   7.058
  750    HA   THR  98           HA       THR  98   5.908   1.377   8.033
  751    HB   THR  98           HB       THR  98   7.770   2.818   8.994
  752    HG1  THR  98           HG1      THR  98   9.840   1.960   8.968
  753   1HG2  THR  98          1HG2      THR  98   6.557   1.188  10.352
  754   2HG2  THR  98          2HG2      THR  98   7.649  -0.088   9.813
  755   3HG2  THR  98          3HG2      THR  98   8.259   1.233  10.808
  756    H    ASN  99           H        ASN  99   6.178   3.822   7.709
  757    HA   ASN  99           HA       ASN  99   5.897   4.430   5.003
  758   1HB   ASN  99          1HB       ASN  99   4.875   5.877   6.581
  759   2HB   ASN  99          2HB       ASN  99   6.394   6.157   7.422
  760   1HD2  ASN  99          2HD2      ASN  99   4.539   6.887   4.543
  761   2HD2  ASN  99          1HD2      ASN  99   5.427   8.304   4.109
  762    H    ALA 100           H        ALA 100   8.700   4.810   7.129
  763    HA   ALA 100           HA       ALA 100  10.333   6.245   5.361
  764   1HB   ALA 100          1HB       ALA 100  11.180   4.308   7.514
  765   2HB   ALA 100          2HB       ALA 100  12.188   5.554   6.776
  766   3HB   ALA 100          3HB       ALA 100  10.794   6.013   7.756
  767    H    ALA 101           H        ALA 101   9.845   2.770   5.750
  768    HA   ALA 101           HA       ALA 101  11.926   2.122   3.852
  769   1HB   ALA 101          1HB       ALA 101   9.884   0.361   5.202
  770   2HB   ALA 101          2HB       ALA 101  11.249  -0.203   4.234
  771   3HB   ALA 101          3HB       ALA 101  11.535   0.653   5.749
  772    H    ALA 102           H        ALA 102   8.415   2.262   3.930
  773    HA   ALA 102           HA       ALA 102   7.839   0.909   1.563
  774   1HB   ALA 102          1HB       ALA 102   6.325   3.218   2.776
  775   2HB   ALA 102          2HB       ALA 102   5.696   2.052   1.612
  776   3HB   ALA 102          3HB       ALA 102   6.153   1.523   3.231
  777    H    ALA 103           H        ALA 103   8.543   4.343   2.095
  778    HA   ALA 103           HA       ALA 103   8.012   5.201  -0.532
  779   1HB   ALA 103          1HB       ALA 103   9.260   7.209   0.054
  780   2HB   ALA 103          2HB       ALA 103   8.182   6.735   1.366
  781   3HB   ALA 103          3HB       ALA 103   9.910   6.401   1.481
  782    H    ARG 104           H        ARG 104  10.861   3.814   0.954
  783    HA   ARG 104           HA       ARG 104  12.664   4.479  -1.159
  784   1HB   ARG 104          1HB       ARG 104  13.086   3.790   1.359
  785   2HB   ARG 104          2HB       ARG 104  13.129   2.168   0.689
  786   1HG   ARG 104          1HG       ARG 104  14.874   4.419  -0.283
  787   2HG   ARG 104          2HG       ARG 104  15.350   3.276   0.970
  788   1HD   ARG 104          1HD       ARG 104  15.079   1.430  -0.617
  789   2HD   ARG 104          2HD       ARG 104  14.609   2.579  -1.870
  790    HE   ARG 104           HE       ARG 104  17.106   3.337  -0.828
  791   1HH1  ARG 104          1HH1      ARG 104  15.689   0.799  -2.776
  792   2HH1  ARG 104          2HH1      ARG 104  17.149   0.483  -3.659
  793   1HH2  ARG 104          1HH2      ARG 104  19.017   2.946  -1.982
  794   2HH2  ARG 104          2HH2      ARG 104  19.044   1.713  -3.209
  795    H    THR 105           H        THR 105  10.938   1.512  -0.221
  796    HA   THR 105           HA       THR 105  11.933  -0.040  -2.377
  797    HB   THR 105           HB       THR 105   9.406  -0.510  -0.786
  798    HG1  THR 105           HG1      THR 105  11.542  -1.971  -0.015
  799   1HG2  THR 105          1HG2      THR 105  11.221  -2.434  -2.251
  800   2HG2  THR 105          2HG2      THR 105   9.785  -2.863  -1.323
  801   3HG2  THR 105          3HG2      THR 105   9.627  -1.912  -2.799
  802    H    TYR 106           H        TYR 106   9.032   1.929  -1.942
  803    HA   TYR 106           HA       TYR 106   7.618   1.097  -4.211
  804   1HB   TYR 106          1HB       TYR 106   6.521   2.450  -2.546
  805   2HB   TYR 106          2HB       TYR 106   7.649   3.775  -2.812
  806    HD1  TYR 106           HD1      TYR 106   7.125   5.464  -4.334
  807    HD2  TYR 106           HD2      TYR 106   5.035   1.765  -4.552
  808    HE1  TYR 106           HE1      TYR 106   5.626   6.418  -6.032
  809    HE2  TYR 106           HE2      TYR 106   3.528   2.711  -6.251
  810    HH   TYR 106           HH       TYR 106   4.166   5.616  -7.867
  811    H    ASN 107           H        ASN 107  10.057   3.631  -3.821
  812    HA   ASN 107           HA       ASN 107   9.908   4.768  -6.356
  813   1HB   ASN 107          1HB       ASN 107  11.216   5.752  -4.527
  814   2HB   ASN 107          2HB       ASN 107  12.352   4.411  -4.602
  815   1HD2  ASN 107          2HD2      ASN 107  11.245   7.329  -6.129
  816   2HD2  ASN 107          1HD2      ASN 107  12.572   7.485  -7.229
  817    H    VAL 108           H        VAL 108  11.684   1.936  -5.238
  818    HA   VAL 108           HA       VAL 108  13.067   1.433  -7.664
  819    HB   VAL 108           HB       VAL 108  12.300  -0.531  -5.491
  820   1HG1  VAL 108          1HG1      VAL 108  14.448  -0.698  -7.606
  821   2HG1  VAL 108          2HG1      VAL 108  14.162  -1.874  -6.323
  822   3HG1  VAL 108          3HG1      VAL 108  12.949  -1.627  -7.579
  823   1HG2  VAL 108          1HG2      VAL 108  14.796   1.127  -5.831
  824   2HG2  VAL 108          2HG2      VAL 108  13.574   1.317  -4.575
  825   3HG2  VAL 108          3HG2      VAL 108  14.568  -0.139  -4.626
  826    H    LEU 109           H        LEU 109  10.138  -0.009  -6.245
  827    HA   LEU 109           HA       LEU 109   9.582  -1.759  -8.371
  828   1HB   LEU 109          1HB       LEU 109   7.682  -0.518  -6.382
  829   2HB   LEU 109          2HB       LEU 109   7.315  -1.891  -7.409
  830    HG   LEU 109           HG       LEU 109   9.422  -1.830  -5.246
  831   1HD1  LEU 109          1HD1      LEU 109   7.164  -1.819  -4.343
  832   2HD1  LEU 109          2HD1      LEU 109   6.745  -3.207  -5.345
  833   3HD1  LEU 109          3HD1      LEU 109   7.947  -3.375  -4.066
  834   1HD2  LEU 109          1HD2      LEU 109   9.630  -4.228  -5.664
  835   2HD2  LEU 109          2HD2      LEU 109   8.483  -4.102  -6.998
  836   3HD2  LEU 109          3HD2      LEU 109  10.048  -3.293  -7.100
  837    H    ALA 110           H        ALA 110   8.682   1.594  -7.807
  838    HA   ALA 110           HA       ALA 110   6.799   1.795  -9.910
  839   1HB   ALA 110          1HB       ALA 110   6.911   3.413  -8.074
  840   2HB   ALA 110          2HB       ALA 110   8.472   3.978  -8.672
  841   3HB   ALA 110          3HB       ALA 110   7.019   4.203  -9.647
  842    H    SER 111           H        SER 111  10.299   2.334  -9.761
  843    HA   SER 111           HA       SER 111  10.456   3.372 -12.411
  844   1HB   SER 111          1HB       SER 111  12.938   2.983 -12.117
  845   2HB   SER 111          2HB       SER 111  12.182   4.018 -10.908
  846    HG   SER 111           HG       SER 111  12.083   1.442 -10.108
  847    H    GLU 112           H        GLU 112  10.083   0.221 -11.205
  848    HA   GLU 112           HA       GLU 112  11.237  -1.124 -13.466
  849   1HB   GLU 112          1HB       GLU 112   9.553  -1.963 -11.126
  850   2HB   GLU 112          2HB       GLU 112   9.864  -3.059 -12.455
  851   1HG   GLU 112          1HG       GLU 112  11.965  -1.748 -10.752
  852   2HG   GLU 112          2HG       GLU 112  11.391  -3.407 -10.580
  853    H    GLY 113           H        GLY 113   8.478   0.692 -12.977
  854   1HA   GLY 113          1HA       GLY 113   6.511   0.953 -14.137
  855   2HA   GLY 113          2HA       GLY 113   7.286   0.067 -15.446
  856    H    ARG 114           H        ARG 114   6.445  -0.903 -12.156
  857    HA   ARG 114           HA       ARG 114   5.001  -3.201 -13.299
  858   1HB   ARG 114          1HB       ARG 114   7.242  -3.637 -12.201
  859   2HB   ARG 114          2HB       ARG 114   6.518  -3.122 -10.688
  860   1HG   ARG 114          1HG       ARG 114   5.052  -4.975 -10.653
  861   2HG   ARG 114          2HG       ARG 114   5.434  -5.394 -12.326
  862   1HD   ARG 114          1HD       ARG 114   7.751  -5.863 -11.666
  863   2HD   ARG 114          2HD       ARG 114   7.347  -5.476  -9.995
  864    HE   ARG 114           HE       ARG 114   6.191  -7.491  -9.817
  865   1HH1  ARG 114          1HH1      ARG 114   7.414  -7.032 -13.076
  866   2HH1  ARG 114          2HH1      ARG 114   7.179  -8.695 -13.533
  867   1HH2  ARG 114          1HH2      ARG 114   5.913  -9.659 -10.398
  868   2HH2  ARG 114          2HH2      ARG 114   6.310 -10.193 -12.007
  869    H    ARG 115           H        ARG 115   3.087  -3.845 -12.274
  870    HA   ARG 115           HA       ARG 115   1.602  -1.773 -11.061
  871   1HB   ARG 115          1HB       ARG 115   1.060  -4.676 -11.569
  872   2HB   ARG 115          2HB       ARG 115  -0.059  -3.715 -10.614
  873   1HG   ARG 115          1HG       ARG 115  -0.349  -2.175 -12.484
  874   2HG   ARG 115          2HG       ARG 115   0.791  -3.121 -13.441
  875   1HD   ARG 115          1HD       ARG 115  -0.664  -4.993 -13.482
  876   2HD   ARG 115          2HD       ARG 115  -1.717  -4.286 -12.260
  877    HE   ARG 115           HE       ARG 115  -1.999  -2.489 -14.155
  878   1HH1  ARG 115          1HH1      ARG 115  -1.780  -5.968 -14.522
  879   2HH1  ARG 115          2HH1      ARG 115  -2.887  -6.026 -15.859
  880   1HH2  ARG 115          1HH2      ARG 115  -3.441  -2.563 -15.936
  881   2HH2  ARG 115          2HH2      ARG 115  -3.811  -4.091 -16.679
  882    H    VAL 116           H        VAL 116   2.408  -1.060  -9.196
  883    HA   VAL 116           HA       VAL 116   2.356  -2.928  -6.926
  884    HB   VAL 116           HB       VAL 116   4.640  -2.191  -7.294
  885   1HG1  VAL 116          1HG1      VAL 116   4.199  -0.137  -8.525
  886   2HG1  VAL 116          2HG1      VAL 116   3.591   0.627  -7.057
  887   3HG1  VAL 116          3HG1      VAL 116   5.290   0.162  -7.173
  888   1HG2  VAL 116          1HG2      VAL 116   3.951  -2.484  -4.988
  889   2HG2  VAL 116          2HG2      VAL 116   5.115  -1.165  -5.112
  890   3HG2  VAL 116          3HG2      VAL 116   3.398  -0.810  -4.916
  891    H    ALA 117           H        ALA 117   1.116  -2.385  -5.222
  892    HA   ALA 117           HA       ALA 117  -0.378   0.141  -5.414
  893   1HB   ALA 117          1HB       ALA 117  -1.759  -1.875  -5.441
  894   2HB   ALA 117          2HB       ALA 117  -1.065  -2.380  -3.902
  895   3HB   ALA 117          3HB       ALA 117  -2.057  -0.924  -3.988
  896    H    LEU 118           H        LEU 118   0.684   1.660  -4.262
  897    HA   LEU 118           HA       LEU 118   1.991   0.934  -1.773
  898   1HB   LEU 118          1HB       LEU 118   3.094   2.496  -3.310
  899   2HB   LEU 118          2HB       LEU 118   1.744   3.605  -3.158
  900    HG   LEU 118           HG       LEU 118   2.269   3.854  -0.740
  901   1HD1  LEU 118          1HD1      LEU 118   4.724   2.248  -1.438
  902   2HD1  LEU 118          2HD1      LEU 118   4.419   3.066   0.094
  903   3HD1  LEU 118          3HD1      LEU 118   3.397   1.716  -0.403
  904   1HD2  LEU 118          1HD2      LEU 118   3.081   5.481  -2.354
  905   2HD2  LEU 118          2HD2      LEU 118   4.262   5.242  -1.067
  906   3HD2  LEU 118          3HD2      LEU 118   4.515   4.498  -2.645
  907    H    ALA 119           H        ALA 119   0.554   0.546  -0.204
  908    HA   ALA 119           HA       ALA 119  -1.681   2.380   0.202
  909   1HB   ALA 119          1HB       ALA 119  -2.109  -0.035   0.323
  910   2HB   ALA 119          2HB       ALA 119  -0.980  -0.162   1.672
  911   3HB   ALA 119          3HB       ALA 119  -2.466   0.772   1.850
  912    H    MET 120           H        MET 120  -0.816   4.222   1.011
  913    HA   MET 120           HA       MET 120   1.080   4.077   3.215
  914   1HB   MET 120          1HB       MET 120   0.109   6.271   1.425
  915   2HB   MET 120          2HB       MET 120   0.871   6.672   2.957
  916   1HG   MET 120          1HG       MET 120   2.143   4.957   0.843
  917   2HG   MET 120          2HG       MET 120   2.394   6.694   0.997
  918   1HE   MET 120          1HE       MET 120   5.807   5.303   2.273
  919   2HE   MET 120          2HE       MET 120   5.004   6.416   1.164
  920   3HE   MET 120          3HE       MET 120   4.822   4.674   0.952
  921    H    ILE 121           H        ILE 121   0.164   3.659   5.103
  922    HA   ILE 121           HA       ILE 121  -2.137   5.304   5.922
  923    HB   ILE 121           HB       ILE 121  -1.016   2.830   7.266
  924   1HG1  ILE 121          1HG1      ILE 121  -3.545   3.146   5.631
  925   2HG1  ILE 121          2HG1      ILE 121  -2.090   2.311   5.098
  926   1HG2  ILE 121          1HG2      ILE 121  -3.054   2.914   8.625
  927   2HG2  ILE 121          2HG2      ILE 121  -2.071   4.363   8.830
  928   3HG2  ILE 121          3HG2      ILE 121  -3.521   4.415   7.825
  929   1HD1  ILE 121          1HD1      ILE 121  -3.789   0.740   5.835
  930   2HD1  ILE 121          2HD1      ILE 121  -2.377   0.672   6.888
  931   3HD1  ILE 121          3HD1      ILE 121  -3.834   1.510   7.420
  932    H    VAL 122           H        VAL 122  -1.092   7.189   6.494
  933    HA   VAL 122           HA       VAL 122   0.886   6.930   8.656
  934    HB   VAL 122           HB       VAL 122   2.015   8.975   7.818
  935   1HG1  VAL 122          1HG1      VAL 122   1.918   6.689   5.855
  936   2HG1  VAL 122          2HG1      VAL 122   3.201   7.892   5.974
  937   3HG1  VAL 122          3HG1      VAL 122   2.918   6.772   7.306
  938   1HG2  VAL 122          1HG2      VAL 122   1.617   9.687   5.494
  939   2HG2  VAL 122          2HG2      VAL 122   0.237   8.592   5.413
  940   3HG2  VAL 122          3HG2      VAL 122   0.214   9.956   6.530
  941    H    GLY 123           H        GLY 123   1.209   9.336   9.573
  942   1HA   GLY 123          1HA       GLY 123   0.130  11.291  10.365
  943   2HA   GLY 123          2HA       GLY 123  -1.417  10.575   9.940
  944    H    GLY 124           H        GLY 124  -2.500   9.365  11.407
  945   1HA   GLY 124          1HA       GLY 124  -2.953   8.296  13.412
  946   2HA   GLY 124          2HA       GLY 124  -1.247   8.412  13.822
  947    H    LEU 125           H        LEU 125  -0.626  10.918  13.952
  948    HA   LEU 125           HA       LEU 125  -0.721  12.875  15.082
  949   1HB   LEU 125          1HB       LEU 125  -3.694  12.362  15.146
  950   2HB   LEU 125          2HB       LEU 125  -2.932  13.844  15.686
  951    HG   LEU 125           HG       LEU 125  -2.852  12.773  12.864
  952   1HD1  LEU 125          1HD1      LEU 125  -4.393  15.082  14.042
  953   2HD1  LEU 125          2HD1      LEU 125  -4.338  14.629  12.338
  954   3HD1  LEU 125          3HD1      LEU 125  -5.077  13.543  13.516
  955   1HD2  LEU 125          1HD2      LEU 125  -1.887  14.955  12.313
  956   2HD2  LEU 125          2HD2      LEU 125  -1.860  15.373  14.026
  957   3HD2  LEU 125          3HD2      LEU 125  -0.858  14.053  13.425
  958    H    GLU 126           H        GLU 126  -0.418  13.534  17.149
  959    HA   GLU 126           HA       GLU 126  -0.355  11.557  19.172
  960   1HB   GLU 126          1HB       GLU 126   0.639  14.203  18.785
  961   2HB   GLU 126          2HB       GLU 126  -0.197  14.153  20.332
  962   1HG   GLU 126          1HG       GLU 126   2.056  12.368  19.444
  963   2HG   GLU 126          2HG       GLU 126   2.129  13.652  20.652
  964    H    HIS 127           H        HIS 127  -1.510  11.492  21.163
  965    HA   HIS 127           HA       HIS 127  -4.112  12.850  21.115
  966   1HB   HIS 127          1HB       HIS 127  -4.335  10.578  20.107
  967   2HB   HIS 127          2HB       HIS 127  -3.777   9.886  21.625
  968    HD1  HIS 127           HD1      HIS 127  -5.625   9.087  23.050
  969    HD2  HIS 127           HD2      HIS 127  -6.781  12.303  20.671
  970    HE1  HIS 127           HE1      HIS 127  -8.052   9.491  23.580
  971    HE2  HIS 127           HE2      HIS 127  -8.699  11.511  22.217
  972    H    HIS 128           H        HIS 128  -1.363  12.243  22.825
  973    HA   HIS 128           HA       HIS 128  -2.429  11.735  25.423
  974   1HB   HIS 128          1HB       HIS 128   0.230  12.837  24.508
  975   2HB   HIS 128          2HB       HIS 128  -0.166  12.592  26.207
  976    HD1  HIS 128           HD1      HIS 128   0.966  10.831  23.180
  977    HD2  HIS 128           HD2      HIS 128  -0.542   9.837  26.925
  978    HE1  HIS 128           HE1      HIS 128   1.461   8.385  23.485
  979    HE2  HIS 128           HE2      HIS 128   0.285   7.761  25.624
  980    H    HIS 129           H        HIS 129  -2.613  13.209  27.189
  981    HA   HIS 129           HA       HIS 129  -3.825  15.650  26.222
  982   1HB   HIS 129          1HB       HIS 129  -4.640  15.887  28.605
  983   2HB   HIS 129          2HB       HIS 129  -5.225  14.491  27.714
  984    HD1  HIS 129           HD1      HIS 129  -4.709  12.198  28.659
  985    HD2  HIS 129           HD2      HIS 129  -2.799  15.276  30.700
  986    HE1  HIS 129           HE1      HIS 129  -3.771  11.154  30.737
  987    HE2  HIS 129           HE2      HIS 129  -2.852  13.083  32.066
  988    H    HIS 130           H        HIS 130  -2.037  16.837  25.647
  989    HA   HIS 130           HA       HIS 130  -0.870  18.230  27.967
  990   1HB   HIS 130          1HB       HIS 130   0.903  17.106  26.678
  991   2HB   HIS 130          2HB       HIS 130   0.346  17.891  25.206
  992    HD1  HIS 130           HD1      HIS 130   1.818  18.829  28.590
  993    HD2  HIS 130           HD2      HIS 130   1.534  20.291  24.703
  994    HE1  HIS 130           HE1      HIS 130   3.231  20.906  28.536
  995    HE2  HIS 130           HE2      HIS 130   2.856  21.891  26.250
  996    H    HIS 131           H        HIS 131  -1.079  20.468  27.967
  997    HA   HIS 131           HA       HIS 131  -3.329  21.479  26.637
  998   1HB   HIS 131          1HB       HIS 131  -1.102  22.863  28.117
  999   2HB   HIS 131          2HB       HIS 131  -2.468  23.738  27.434
 1000    HD1  HIS 131           HD1      HIS 131  -1.402  22.065  30.444
 1001    HD2  HIS 131           HD2      HIS 131  -5.036  22.753  28.549
 1002    HE1  HIS 131           HE1      HIS 131  -3.159  21.747  32.216
 1003    HE2  HIS 131           HE2      HIS 131  -5.346  22.267  31.072
 1004    H    HIS 132           H        HIS 132  -3.537  21.866  24.571
 1005    HA   HIS 132           HA       HIS 132  -1.260  22.978  23.076
 1006   1HB   HIS 132          1HB       HIS 132  -3.650  21.360  22.215
 1007   2HB   HIS 132          2HB       HIS 132  -2.760  22.340  21.057
 1008    HD1  HIS 132           HD1      HIS 132  -2.265  19.997  19.884
 1009    HD2  HIS 132           HD2      HIS 132  -0.474  20.591  23.595
 1010    HE1  HIS 132           HE1      HIS 132  -0.453  18.257  20.056
 1011    HE2  HIS 132           HE2      HIS 132   0.746  18.770  22.213
  Start of MODEL   16
    1   1H    MET   1          1HT       MET   1  16.939  25.399 -29.305
    2   2H    MET   1          2HT       MET   1  17.055  23.837 -28.658
    3   3H    MET   1          3HT       MET   1  18.226  24.999 -28.281
    4    HA   MET   1           HA       MET   1  16.683  26.310 -27.082
    5   1HB   MET   1          1HB       MET   1  14.724  25.828 -28.490
    6   2HB   MET   1          2HB       MET   1  14.635  24.208 -27.816
    7   1HG   MET   1          1HG       MET   1  14.213  25.166 -25.599
    8   2HG   MET   1          2HG       MET   1  14.264  26.783 -26.302
    9   1HE   MET   1          1HE       MET   1  10.460  26.352 -25.531
   10   2HE   MET   1          2HE       MET   1  11.890  27.364 -25.315
   11   3HE   MET   1          3HE       MET   1  11.816  25.771 -24.564
   12    HA   PRO   2           HA       PRO   2  16.697  22.784 -23.973
   13   1HB   PRO   2          1HB       PRO   2  16.319  20.170 -24.986
   14   2HB   PRO   2          2HB       PRO   2  15.122  21.170 -24.162
   15   1HG   PRO   2          1HG       PRO   2  15.024  20.372 -26.838
   16   2HG   PRO   2          2HG       PRO   2  14.065  21.667 -26.103
   17   1HD   PRO   2          1HD       PRO   2  16.570  21.843 -27.724
   18   2HD   PRO   2          2HD       PRO   2  15.168  22.938 -27.683
   19    H    LEU   3           H        LEU   3  18.879  23.050 -23.662
   20    HA   LEU   3           HA       LEU   3  20.742  21.433 -25.234
   21   1HB   LEU   3          1HB       LEU   3  21.237  23.611 -23.201
   22   2HB   LEU   3          2HB       LEU   3  22.491  22.773 -24.097
   23    HG   LEU   3           HG       LEU   3  20.350  24.532 -25.296
   24   1HD1  LEU   3          1HD1      LEU   3  23.313  24.973 -24.958
   25   2HD1  LEU   3          2HD1      LEU   3  22.187  26.058 -25.775
   26   3HD1  LEU   3          3HD1      LEU   3  22.039  25.776 -24.040
   27   1HD2  LEU   3          1HD2      LEU   3  22.684  23.120 -26.584
   28   2HD2  LEU   3          2HD2      LEU   3  20.981  22.717 -26.797
   29   3HD2  LEU   3          3HD2      LEU   3  21.602  24.260 -27.381
   30    H    ASN   4           H        ASN   4  18.907  20.758 -22.756
   31    HA   ASN   4           HA       ASN   4  20.977  19.246 -21.311
   32   1HB   ASN   4          1HB       ASN   4  18.486  20.427 -20.062
   33   2HB   ASN   4          2HB       ASN   4  19.812  19.621 -19.229
   34   1HD2  ASN   4          2HD2      ASN   4  21.785  20.714 -18.976
   35   2HD2  ASN   4          1HD2      ASN   4  21.883  22.437 -19.138
   36    H    GLN   5           H        GLN   5  19.918  17.411 -20.021
   37    HA   GLN   5           HA       GLN   5  18.276  15.867 -21.804
   38   1HB   GLN   5          1HB       GLN   5  19.481  15.334 -19.097
   39   2HB   GLN   5          2HB       GLN   5  18.328  14.220 -19.811
   40   1HG   GLN   5          1HG       GLN   5  20.658  13.542 -20.164
   41   2HG   GLN   5          2HG       GLN   5  19.790  13.812 -21.672
   42   1HE2  GLN   5          2HE2      GLN   5  22.209  15.084 -19.497
   43   2HE2  GLN   5          1HE2      GLN   5  22.963  16.140 -20.645
   44    H    GLU   6           H        GLU   6  16.497  17.397 -21.803
   45    HA   GLU   6           HA       GLU   6  14.963  17.630 -19.357
   46   1HB   GLU   6          1HB       GLU   6  14.545  18.782 -22.117
   47   2HB   GLU   6          2HB       GLU   6  13.466  19.071 -20.757
   48   1HG   GLU   6          1HG       GLU   6  16.358  19.871 -20.990
   49   2HG   GLU   6          2HG       GLU   6  14.950  20.933 -20.965
   50    H    HIS   7           H        HIS   7  12.975  16.810 -18.983
   51    HA   HIS   7           HA       HIS   7  12.263  14.498 -20.640
   52   1HB   HIS   7          1HB       HIS   7  11.540  15.271 -17.811
   53   2HB   HIS   7          2HB       HIS   7  10.791  13.921 -18.654
   54    HD1  HIS   7           HD1      HIS   7  11.868  11.743 -18.275
   55    HD2  HIS   7           HD2      HIS   7  14.510  14.903 -17.680
   56    HE1  HIS   7           HE1      HIS   7  14.015  10.696 -17.487
   57    HE2  HIS   7           HE2      HIS   7  15.505  12.645 -16.894
   58    HA   PRO   8           HA       PRO   8   8.815  16.903 -22.289
   59   1HB   PRO   8          1HB       PRO   8   8.133  14.199 -23.303
   60   2HB   PRO   8          2HB       PRO   8   8.275  15.725 -24.183
   61   1HG   PRO   8          1HG       PRO   8  10.144  13.836 -24.412
   62   2HG   PRO   8          2HG       PRO   8  10.577  15.556 -24.373
   63   1HD   PRO   8          1HD       PRO   8  10.785  13.499 -22.210
   64   2HD   PRO   8          2HD       PRO   8  11.903  14.815 -22.624
   65    H    ASP   9           H        ASP   9   8.422  13.552 -21.134
   66    HA   ASP   9           HA       ASP   9   5.971  14.330 -19.740
   67   1HB   ASP   9          1HB       ASP   9   5.797  12.259 -20.962
   68   2HB   ASP   9          2HB       ASP   9   7.261  11.635 -20.209
   69    H    TYR  10           H        TYR  10   6.063  14.946 -17.708
   70    HA   TYR  10           HA       TYR  10   8.469  14.486 -16.155
   71   1HB   TYR  10          1HB       TYR  10   5.949  16.026 -15.490
   72   2HB   TYR  10          2HB       TYR  10   7.395  15.969 -14.488
   73    HD1  TYR  10           HD1      TYR  10   9.467  17.070 -15.239
   74    HD2  TYR  10           HD2      TYR  10   5.845  17.423 -17.445
   75    HE1  TYR  10           HE1      TYR  10  10.399  18.996 -16.448
   76    HE2  TYR  10           HE2      TYR  10   6.767  19.351 -18.661
   77    HH   TYR  10           HH       TYR  10  10.086  20.190 -18.540
   78    H    THR  11           H        THR  11   8.657  12.634 -15.089
   79    HA   THR  11           HA       THR  11   6.283  11.197 -14.244
   80    HB   THR  11           HB       THR  11   8.161   9.973 -15.329
   81    HG1  THR  11           HG1      THR  11   6.676   9.183 -13.421
   82   1HG2  THR  11          1HG2      THR  11  10.031  11.225 -14.366
   83   2HG2  THR  11          2HG2      THR  11   9.648  10.578 -12.771
   84   3HG2  THR  11          3HG2      THR  11  10.191   9.497 -14.056
   85    H    TYR  12           H        TYR  12   5.851  10.613 -12.104
   86    HA   TYR  12           HA       TYR  12   7.371  11.960 -10.007
   87   1HB   TYR  12          1HB       TYR  12   5.186  12.809  -9.025
   88   2HB   TYR  12          2HB       TYR  12   5.743  13.635 -10.476
   89    HD1  TYR  12           HD1      TYR  12   3.163  11.481  -9.045
   90    HD2  TYR  12           HD2      TYR  12   4.576  13.325 -12.610
   91    HE1  TYR  12           HE1      TYR  12   1.005  11.025 -10.133
   92    HE2  TYR  12           HE2      TYR  12   2.423  12.877 -13.705
   93    HH   TYR  12           HH       TYR  12   0.552  11.252 -13.468
   94    H    ALA  13           H        ALA  13   7.489  10.797  -8.182
   95    HA   ALA  13           HA       ALA  13   5.466   8.814  -7.562
   96   1HB   ALA  13          1HB       ALA  13   8.359   8.015  -7.887
   97   2HB   ALA  13          2HB       ALA  13   7.047   6.981  -7.323
   98   3HB   ALA  13          3HB       ALA  13   7.046   7.581  -8.982
   99    H    LEU  14           H        LEU  14   5.171  10.457  -5.920
  100    HA   LEU  14           HA       LEU  14   5.206  11.050  -3.725
  101   1HB   LEU  14          1HB       LEU  14   5.723   8.577  -3.446
  102   2HB   LEU  14          2HB       LEU  14   7.412   9.028  -3.331
  103    HG   LEU  14           HG       LEU  14   6.845  10.411  -1.332
  104   1HD1  LEU  14          1HD1      LEU  14   4.703  10.045  -0.229
  105   2HD1  LEU  14          2HD1      LEU  14   4.487  10.788  -1.813
  106   3HD1  LEU  14          3HD1      LEU  14   4.163   9.067  -1.595
  107   1HD2  LEU  14          1HD2      LEU  14   7.751   8.163  -1.101
  108   2HD2  LEU  14          2HD2      LEU  14   6.599   8.519   0.185
  109   3HD2  LEU  14          3HD2      LEU  14   6.121   7.492  -1.168
  110    H    ARG  15           H        ARG  15   6.355  12.488  -2.335
  111    HA   ARG  15           HA       ARG  15   8.736  13.671  -3.547
  112   1HB   ARG  15          1HB       ARG  15   7.050  14.488  -1.175
  113   2HB   ARG  15          2HB       ARG  15   8.508  15.335  -1.662
  114   1HG   ARG  15          1HG       ARG  15   6.137  14.964  -3.465
  115   2HG   ARG  15          2HG       ARG  15   6.349  16.358  -2.407
  116   1HD   ARG  15          1HD       ARG  15   8.573  16.732  -3.547
  117   2HD   ARG  15          2HD       ARG  15   8.082  15.508  -4.721
  118    HE   ARG  15           HE       ARG  15   6.125  17.572  -4.372
  119   1HH1  ARG  15          1HH1      ARG  15   9.152  16.862  -6.003
  120   2HH1  ARG  15          2HH1      ARG  15   8.793  17.889  -7.364
  121   1HH2  ARG  15          1HH2      ARG  15   5.680  18.936  -6.131
  122   2HH2  ARG  15          2HH2      ARG  15   6.830  19.083  -7.425
  123    H    ALA  16           H        ALA  16   7.732  12.560  -0.344
  124    HA   ALA  16           HA       ALA  16  10.131  11.081   0.089
  125   1HB   ALA  16          1HB       ALA  16   9.711  13.579   1.737
  126   2HB   ALA  16          2HB       ALA  16  10.955  12.358   2.005
  127   3HB   ALA  16          3HB       ALA  16  10.983  13.342   0.540
  128    H    ALA  17           H        ALA  17  10.083  10.021   2.221
  129    HA   ALA  17           HA       ALA  17   7.430  10.034   3.477
  130   1HB   ALA  17          1HB       ALA  17   9.056   7.576   2.824
  131   2HB   ALA  17          2HB       ALA  17   7.548   7.598   3.740
  132   3HB   ALA  17          3HB       ALA  17   7.555   8.070   2.040
  133    H    ASP  18           H        ASP  18   7.777  10.852   5.413
  134    HA   ASP  18           HA       ASP  18  10.321  10.360   6.770
  135   1HB   ASP  18          1HB       ASP  18   8.077  12.217   7.596
  136   2HB   ASP  18          2HB       ASP  18   9.703  12.169   8.264
  137    H    GLY  19           H        GLY  19  10.142  10.051   9.193
  138   1HA   GLY  19          1HA       GLY  19   8.508   7.863   9.883
  139   2HA   GLY  19          2HA       GLY  19   9.357   8.904  11.023
  140    H    ARG  20           H        ARG  20   6.375   7.905   9.954
  141    HA   ARG  20           HA       ARG  20   4.258   8.416  10.616
  142   1HB   ARG  20          1HB       ARG  20   5.504  10.646  12.240
  143   2HB   ARG  20          2HB       ARG  20   3.864  10.037  12.401
  144   1HG   ARG  20          1HG       ARG  20   4.602   7.990  13.302
  145   2HG   ARG  20          2HG       ARG  20   6.273   8.300  12.830
  146   1HD   ARG  20          1HD       ARG  20   6.010   8.639  15.214
  147   2HD   ARG  20          2HD       ARG  20   6.355  10.174  14.423
  148    HE   ARG  20           HE       ARG  20   4.301  10.942  15.074
  149   1HH1  ARG  20          1HH1      ARG  20   4.422   7.477  15.532
  150   2HH1  ARG  20          2HH1      ARG  20   2.871   7.396  16.324
  151   1HH2  ARG  20          1HH2      ARG  20   2.333  10.863  16.205
  152   2HH2  ARG  20          2HH2      ARG  20   1.701   9.328  16.726
  153    H    HIS  21           H        HIS  21   5.833   9.847   8.378
  154    HA   HIS  21           HA       HIS  21   3.695  11.752   7.771
  155   1HB   HIS  21          1HB       HIS  21   6.630  12.463   7.796
  156   2HB   HIS  21          2HB       HIS  21   5.434  13.392   6.902
  157    HD1  HIS  21           HD1      HIS  21   7.218  13.692   9.843
  158    HD2  HIS  21           HD2      HIS  21   3.168  13.991   8.982
  159    HE1  HIS  21           HE1      HIS  21   6.234  15.052  11.710
  160    HE2  HIS  21           HE2      HIS  21   3.751  15.014  11.282
  161    H    ALA  22           H        ALA  22   3.356  12.119   5.569
  162    HA   ALA  22           HA       ALA  22   5.189  10.914   3.647
  163   1HB   ALA  22          1HB       ALA  22   3.402   9.793   2.432
  164   2HB   ALA  22          2HB       ALA  22   3.522   9.170   4.077
  165   3HB   ALA  22          3HB       ALA  22   2.235  10.299   3.654
  166    H    LYS  23           H        LYS  23   5.329  12.077   1.774
  167    HA   LYS  23           HA       LYS  23   3.569  14.434   1.602
  168   1HB   LYS  23          1HB       LYS  23   6.560  14.257   1.228
  169   2HB   LYS  23          2HB       LYS  23   5.605  15.655   0.746
  170   1HG   LYS  23          1HG       LYS  23   5.167  16.278   2.908
  171   2HG   LYS  23          2HG       LYS  23   5.369  14.642   3.534
  172   1HD   LYS  23          1HD       LYS  23   7.775  14.800   3.223
  173   2HD   LYS  23          2HD       LYS  23   7.597  16.411   2.521
  174   1HE   LYS  23          1HE       LYS  23   6.918  17.345   4.564
  175   2HE   LYS  23          2HE       LYS  23   6.590  15.765   5.274
  176   1HZ   LYS  23          1HZ       LYS  23   9.301  16.715   4.524
  177   2HZ   LYS  23          2HZ       LYS  23   8.653  16.820   6.083
  178   3HZ   LYS  23          3HZ       LYS  23   8.911  15.300   5.374
  179    H    VAL  24           H        VAL  24   2.369  14.314  -0.159
  180    HA   VAL  24           HA       VAL  24   3.573  13.203  -2.613
  181    HB   VAL  24           HB       VAL  24   0.621  13.468  -2.019
  182   1HG1  VAL  24          1HG1      VAL  24   2.116  11.983  -4.177
  183   2HG1  VAL  24          2HG1      VAL  24   0.370  11.952  -3.932
  184   3HG1  VAL  24          3HG1      VAL  24   1.171  13.457  -4.388
  185   1HG2  VAL  24          1HG2      VAL  24   1.604  11.874  -0.466
  186   2HG2  VAL  24          2HG2      VAL  24   0.621  11.037  -1.668
  187   3HG2  VAL  24          3HG2      VAL  24   2.379  11.025  -1.804
  188    H    ASN  25           H        ASN  25   4.171  14.713  -3.981
  189    HA   ASN  25           HA       ASN  25   4.336  16.622  -5.177
  190   1HB   ASN  25          1HB       ASN  25   2.026  16.075  -5.909
  191   2HB   ASN  25          2HB       ASN  25   1.398  17.017  -4.560
  192   1HD2  ASN  25          2HD2      ASN  25   0.322  18.447  -5.935
  193   2HD2  ASN  25          1HD2      ASN  25   1.172  19.631  -6.867
  194    H    GLU  26           H        GLU  26   1.845  17.974  -3.081
  195    HA   GLU  26           HA       GLU  26   3.897  19.223  -1.417
  196   1HB   GLU  26          1HB       GLU  26   2.368  21.360  -1.576
  197   2HB   GLU  26          2HB       GLU  26   3.614  21.059  -2.776
  198   1HG   GLU  26          1HG       GLU  26   1.519  21.810  -3.783
  199   2HG   GLU  26          2HG       GLU  26   1.970  20.195  -4.322
  200    H    GLN  27           H        GLN  27   1.427  17.269  -1.483
  201    HA   GLN  27           HA       GLN  27  -0.072  18.414   0.759
  202   1HB   GLN  27          1HB       GLN  27  -1.355  17.698  -1.219
  203   2HB   GLN  27          2HB       GLN  27  -0.705  16.073  -1.055
  204   1HG   GLN  27          1HG       GLN  27  -1.825  15.859   1.113
  205   2HG   GLN  27          2HG       GLN  27  -2.503  17.475   0.913
  206   1HE2  GLN  27          2HE2      GLN  27  -2.108  15.245  -1.733
  207   2HE2  GLN  27          1HE2      GLN  27  -3.788  14.945  -1.994
  208    H    ILE  28           H        ILE  28   0.619  17.822   2.702
  209    HA   ILE  28           HA       ILE  28   2.073  15.346   3.096
  210    HB   ILE  28           HB       ILE  28   1.195  17.379   5.159
  211   1HG1  ILE  28          1HG1      ILE  28   3.852  17.081   3.733
  212   2HG1  ILE  28          2HG1      ILE  28   2.675  18.356   3.439
  213   1HG2  ILE  28          1HG2      ILE  28   2.949  16.361   6.549
  214   2HG2  ILE  28          2HG2      ILE  28   1.687  15.204   6.125
  215   3HG2  ILE  28          3HG2      ILE  28   3.239  15.163   5.289
  216   1HD1  ILE  28          1HD1      ILE  28   4.152  17.884   6.018
  217   2HD1  ILE  28          2HD1      ILE  28   4.502  19.141   4.831
  218   3HD1  ILE  28          3HD1      ILE  28   2.978  19.166   5.717
  219    H    LEU  29           H        LEU  29   0.762  13.628   2.905
  220    HA   LEU  29           HA       LEU  29  -1.875  13.659   4.126
  221   1HB   LEU  29          1HB       LEU  29  -0.462  11.679   2.346
  222   2HB   LEU  29          2HB       LEU  29  -2.035  11.368   3.058
  223    HG   LEU  29           HG       LEU  29  -1.443  13.697   1.228
  224   1HD1  LEU  29          1HD1      LEU  29  -1.198  11.599   0.019
  225   2HD1  LEU  29          2HD1      LEU  29  -2.766  11.056   0.619
  226   3HD1  LEU  29          3HD1      LEU  29  -2.670  12.437  -0.474
  227   1HD2  LEU  29          1HD2      LEU  29  -4.028  12.551   2.281
  228   2HD2  LEU  29          2HD2      LEU  29  -3.299  14.086   2.750
  229   3HD2  LEU  29          3HD2      LEU  29  -3.889  13.857   1.103
  230    H    GLN  30           H        GLN  30  -2.064  13.145   6.166
  231    HA   GLN  30           HA       GLN  30  -0.201  11.221   7.362
  232   1HB   GLN  30          1HB       GLN  30  -2.016  13.284   8.624
  233   2HB   GLN  30          2HB       GLN  30  -1.047  12.133   9.536
  234   1HG   GLN  30          1HG       GLN  30   0.986  13.081   8.662
  235   2HG   GLN  30          2HG       GLN  30   0.071  14.161   7.614
  236   1HE2  GLN  30          2HE2      GLN  30  -0.959  15.932   8.491
  237   2HE2  GLN  30          1HE2      GLN  30  -0.601  16.521  10.073
  238    H    GLN  31           H        GLN  31  -2.282  10.365   5.669
  239    HA   GLN  31           HA       GLN  31  -3.664   8.575   7.514
  240   1HB   GLN  31          1HB       GLN  31  -5.035  10.136   5.312
  241   2HB   GLN  31          2HB       GLN  31  -5.748   8.747   6.116
  242   1HG   GLN  31          1HG       GLN  31  -5.583   9.968   8.263
  243   2HG   GLN  31          2HG       GLN  31  -5.002  11.374   7.372
  244   1HE2  GLN  31          2HE2      GLN  31  -7.382  11.039   9.008
  245   2HE2  GLN  31          1HE2      GLN  31  -8.728  11.435   7.996
  246    H    SER  32           H        SER  32  -5.003   6.999   5.791
  247    HA   SER  32           HA       SER  32  -2.863   5.786   4.279
  248   1HB   SER  32          1HB       SER  32  -5.743   4.903   4.549
  249   2HB   SER  32          2HB       SER  32  -4.392   3.934   3.959
  250    HG   SER  32           HG       SER  32  -5.053   4.697   6.557
  251    H    PHE  33           H        PHE  33  -2.539   5.965   2.171
  252    HA   PHE  33           HA       PHE  33  -4.774   6.645   0.420
  253   1HB   PHE  33          1HB       PHE  33  -3.453   8.331  -0.784
  254   2HB   PHE  33          2HB       PHE  33  -3.702   8.793   0.893
  255    HD1  PHE  33           HD1      PHE  33  -1.264   7.825  -1.631
  256    HD2  PHE  33           HD2      PHE  33  -1.841   8.789   2.476
  257    HE1  PHE  33           HE1      PHE  33   1.160   8.150  -1.370
  258    HE2  PHE  33           HE2      PHE  33   0.583   9.118   2.741
  259    HZ   PHE  33           HZ       PHE  33   2.085   8.797   0.818
  260    H    ILE  34           H        ILE  34  -4.246   6.259  -1.876
  261    HA   ILE  34           HA       ILE  34  -2.394   3.975  -2.099
  262    HB   ILE  34           HB       ILE  34  -4.779   4.587  -3.853
  263   1HG1  ILE  34          1HG1      ILE  34  -4.556   2.513  -1.660
  264   2HG1  ILE  34          2HG1      ILE  34  -5.399   4.049  -1.486
  265   1HG2  ILE  34          1HG2      ILE  34  -3.040   2.134  -3.609
  266   2HG2  ILE  34          2HG2      ILE  34  -4.472   2.275  -4.628
  267   3HG2  ILE  34          3HG2      ILE  34  -3.055   3.273  -4.954
  268   1HD1  ILE  34          1HD1      ILE  34  -6.093   1.856  -3.426
  269   2HD1  ILE  34          2HD1      ILE  34  -6.949   2.242  -1.933
  270   3HD1  ILE  34          3HD1      ILE  34  -6.937   3.398  -3.265
  271    H    LEU  35           H        LEU  35  -0.554   4.571  -3.054
  272    HA   LEU  35           HA       LEU  35  -0.684   6.528  -5.245
  273   1HB   LEU  35          1HB       LEU  35   0.839   7.103  -3.417
  274   2HB   LEU  35          2HB       LEU  35   1.683   5.582  -3.624
  275    HG   LEU  35           HG       LEU  35   2.399   6.301  -5.877
  276   1HD1  LEU  35          1HD1      LEU  35   1.104   8.918  -5.122
  277   2HD1  LEU  35          2HD1      LEU  35   2.118   8.640  -6.538
  278   3HD1  LEU  35          3HD1      LEU  35   0.565   7.816  -6.390
  279   1HD2  LEU  35          1HD2      LEU  35   3.088   8.227  -3.662
  280   2HD2  LEU  35          2HD2      LEU  35   3.850   6.664  -3.954
  281   3HD2  LEU  35          3HD2      LEU  35   4.025   7.964  -5.133
  282    H    MET  36           H        MET  36  -0.599   5.783  -7.236
  283    HA   MET  36           HA       MET  36   0.828   3.254  -7.742
  284   1HB   MET  36          1HB       MET  36  -1.692   4.306  -9.043
  285   2HB   MET  36          2HB       MET  36  -0.766   2.952  -9.671
  286   1HG   MET  36          1HG       MET  36  -1.174   1.712  -7.611
  287   2HG   MET  36          2HG       MET  36  -2.097   3.072  -6.973
  288   1HE   MET  36          1HE       MET  36  -4.096   1.360  -6.485
  289   2HE   MET  36          2HE       MET  36  -3.164   0.038  -7.189
  290   3HE   MET  36          3HE       MET  36  -4.821   0.331  -7.720
  291    HA   PRO  37           HA       PRO  37   3.189   5.515 -10.807
  292   1HB   PRO  37          1HB       PRO  37   3.151   3.141 -12.536
  293   2HB   PRO  37          2HB       PRO  37   4.515   3.897 -11.708
  294   1HG   PRO  37          1HG       PRO  37   3.534   1.506 -10.954
  295   2HG   PRO  37          2HG       PRO  37   4.206   2.663  -9.789
  296   1HD   PRO  37          1HD       PRO  37   1.338   2.081 -10.445
  297   2HD   PRO  37          2HD       PRO  37   2.101   2.335  -8.860
  298    H    ASP  38           H        ASP  38   0.534   6.087 -10.948
  299    HA   ASP  38           HA       ASP  38  -0.031   6.388 -13.760
  300   1HB   ASP  38          1HB       ASP  38  -0.918   4.171 -13.477
  301   2HB   ASP  38          2HB       ASP  38  -1.725   4.625 -11.981
  302    H    GLU  39           H        GLU  39  -1.391   6.528 -10.479
  303    HA   GLU  39           HA       GLU  39  -1.864   9.331 -10.627
  304   1HB   GLU  39          1HB       GLU  39  -3.894   7.667 -11.692
  305   2HB   GLU  39          2HB       GLU  39  -4.481   8.254 -10.142
  306   1HG   GLU  39          1HG       GLU  39  -3.389  10.027 -12.310
  307   2HG   GLU  39          2HG       GLU  39  -5.101   9.663 -12.095
  308    H    LEU  40           H        LEU  40  -3.057  10.097  -8.658
  309    HA   LEU  40           HA       LEU  40  -2.366   8.392  -6.364
  310   1HB   LEU  40          1HB       LEU  40  -1.342  10.597  -6.352
  311   2HB   LEU  40          2HB       LEU  40  -2.910  11.358  -6.550
  312    HG   LEU  40           HG       LEU  40  -3.564  10.412  -4.316
  313   1HD1  LEU  40          1HD1      LEU  40  -1.939   8.602  -4.218
  314   2HD1  LEU  40          2HD1      LEU  40  -0.626   9.774  -4.146
  315   3HD1  LEU  40          3HD1      LEU  40  -1.786   9.670  -2.824
  316   1HD2  LEU  40          1HD2      LEU  40  -1.192  12.269  -4.390
  317   2HD2  LEU  40          2HD2      LEU  40  -2.886  12.729  -4.561
  318   3HD2  LEU  40          3HD2      LEU  40  -2.301  12.072  -3.032
  319    H    VAL  41           H        VAL  41  -3.918   7.481  -5.179
  320    HA   VAL  41           HA       VAL  41  -6.661   8.543  -5.409
  321    HB   VAL  41           HB       VAL  41  -5.846   5.680  -4.863
  322   1HG1  VAL  41          1HG1      VAL  41  -8.575   6.898  -5.275
  323   2HG1  VAL  41          2HG1      VAL  41  -8.231   5.179  -5.092
  324   3HG1  VAL  41          3HG1      VAL  41  -7.927   6.285  -3.754
  325   1HG2  VAL  41          1HG2      VAL  41  -6.786   5.189  -7.076
  326   2HG2  VAL  41          2HG2      VAL  41  -7.045   6.913  -7.343
  327   3HG2  VAL  41          3HG2      VAL  41  -5.405   6.283  -7.178
  328    H    GLU  42           H        GLU  42  -7.039   9.687  -3.606
  329    HA   GLU  42           HA       GLU  42  -6.342   8.426  -1.047
  330   1HB   GLU  42          1HB       GLU  42  -6.433  10.998  -0.298
  331   2HB   GLU  42          2HB       GLU  42  -4.959  10.200  -0.819
  332   1HG   GLU  42          1HG       GLU  42  -5.047  12.302  -1.896
  333   2HG   GLU  42          2HG       GLU  42  -5.390  11.078  -3.116
  334    H    HIS  43           H        HIS  43  -7.717  10.395   0.532
  335    HA   HIS  43           HA       HIS  43  -9.725  10.592   1.559
  336   1HB   HIS  43          1HB       HIS  43 -10.769  10.257  -1.257
  337   2HB   HIS  43          2HB       HIS  43 -11.822  10.525   0.124
  338    HD1  HIS  43           HD1      HIS  43 -10.445  12.331  -2.527
  339    HD2  HIS  43           HD2      HIS  43 -10.758  13.058   1.557
  340    HE1  HIS  43           HE1      HIS  43 -10.239  14.821  -2.263
  341    HE2  HIS  43           HE2      HIS  43 -10.185  15.202   0.223
  342    H    TRP  44           H        TRP  44  -8.434   8.204   1.628
  343    HA   TRP  44           HA       TRP  44 -10.486   6.140   1.335
  344   1HB   TRP  44          1HB       TRP  44  -8.064   5.860   0.505
  345   2HB   TRP  44          2HB       TRP  44  -7.622   5.718   2.200
  346    HD1  TRP  44           HD1      TRP  44 -10.687   4.070   0.493
  347    HE1  TRP  44           HE1      TRP  44 -10.479   1.516   0.773
  348    HE3  TRP  44           HE3      TRP  44  -6.092   3.870   2.727
  349    HZ2  TRP  44           HZ2      TRP  44  -8.615  -0.329   1.806
  350    HZ3  TRP  44           HZ3      TRP  44  -5.167   1.669   3.326
  351    HH2  TRP  44           HH2      TRP  44  -6.404  -0.385   2.874
  352    HA   PRO  45           HA       PRO  45 -11.466   6.899   5.591
  353   1HB   PRO  45          1HB       PRO  45 -13.114   4.481   5.413
  354   2HB   PRO  45          2HB       PRO  45 -13.607   6.159   5.653
  355   1HG   PRO  45          1HG       PRO  45 -14.089   4.854   3.353
  356   2HG   PRO  45          2HG       PRO  45 -13.719   6.588   3.390
  357   1HD   PRO  45          1HD       PRO  45 -11.919   4.280   2.730
  358   2HD   PRO  45          2HD       PRO  45 -12.084   5.849   1.912
  359    H    VAL  46           H        VAL  46  -9.018   5.707   5.478
  360    HA   VAL  46           HA       VAL  46  -9.251   3.807   7.706
  361    HB   VAL  46           HB       VAL  46  -7.260   3.525   5.440
  362   1HG1  VAL  46          1HG1      VAL  46  -6.290   2.893   7.581
  363   2HG1  VAL  46          2HG1      VAL  46  -7.665   1.836   7.907
  364   3HG1  VAL  46          3HG1      VAL  46  -6.563   1.467   6.579
  365   1HG2  VAL  46          1HG2      VAL  46  -9.589   1.773   6.215
  366   2HG2  VAL  46          2HG2      VAL  46  -9.484   2.792   4.779
  367   3HG2  VAL  46          3HG2      VAL  46  -8.401   1.412   4.962
  368    HA   PRO  47           HA       PRO  47  -6.364   7.086   9.003
  369   1HB   PRO  47          1HB       PRO  47  -7.665   7.140  11.543
  370   2HB   PRO  47          2HB       PRO  47  -7.749   8.349  10.264
  371   1HG   PRO  47          1HG       PRO  47  -9.866   6.763  11.097
  372   2HG   PRO  47          2HG       PRO  47  -9.771   7.607   9.543
  373   1HD   PRO  47          1HD       PRO  47  -9.223   4.738  10.182
  374   2HD   PRO  47          2HD       PRO  47  -9.988   5.448   8.743
  375    H    SER  48           H        SER  48  -7.213   3.983  10.154
  376    HA   SER  48           HA       SER  48  -4.624   3.612  11.371
  377   1HB   SER  48          1HB       SER  48  -7.125   3.225  13.040
  378   2HB   SER  48          2HB       SER  48  -5.471   2.886  13.547
  379    HG   SER  48           HG       SER  48  -5.424   5.359  12.742
  380    H    LEU  49           H        LEU  49  -4.281   1.312  11.976
  381    HA   LEU  49           HA       LEU  49  -5.154  -0.396   9.904
  382   1HB   LEU  49          1HB       LEU  49  -3.659  -0.842  12.464
  383   2HB   LEU  49          2HB       LEU  49  -4.172  -2.208  11.498
  384    HG   LEU  49           HG       LEU  49  -1.869  -1.694  11.014
  385   1HD1  LEU  49          1HD1      LEU  49  -1.991  -1.386   8.598
  386   2HD1  LEU  49          2HD1      LEU  49  -3.222  -2.509   9.175
  387   3HD1  LEU  49          3HD1      LEU  49  -3.666  -0.855   8.751
  388   1HD2  LEU  49          1HD2      LEU  49  -2.828   1.062  10.260
  389   2HD2  LEU  49          2HD2      LEU  49  -1.829   0.649  11.654
  390   3HD2  LEU  49          3HD2      LEU  49  -1.196   0.439  10.020
  391    H    GLY  50           H        GLY  50  -6.372   0.227  13.097
  392   1HA   GLY  50          1HA       GLY  50  -7.929  -2.103  13.437
  393   2HA   GLY  50          2HA       GLY  50  -8.188  -0.570  14.252
  394    H    GLN  51           H        GLN  51  -8.385   0.565  11.345
  395    HA   GLN  51           HA       GLN  51 -11.240  -0.090  11.067
  396   1HB   GLN  51          1HB       GLN  51  -9.750   2.364  10.115
  397   2HB   GLN  51          2HB       GLN  51 -11.478   2.081   9.942
  398   1HG   GLN  51          1HG       GLN  51 -11.671   2.005  12.403
  399   2HG   GLN  51          2HG       GLN  51  -9.959   2.403  12.521
  400   1HE2  GLN  51          2HE2      GLN  51 -12.170   3.728  10.136
  401   2HE2  GLN  51          1HE2      GLN  51 -12.141   5.351  10.747
  402    H    LEU  52           H        LEU  52  -8.528  -1.162   9.889
  403    HA   LEU  52           HA       LEU  52  -9.089  -1.037   7.057
  404   1HB   LEU  52          1HB       LEU  52  -6.771  -1.178   7.870
  405   2HB   LEU  52          2HB       LEU  52  -7.120  -2.732   8.604
  406    HG   LEU  52           HG       LEU  52  -7.545  -3.679   6.360
  407   1HD1  LEU  52          1HD1      LEU  52  -8.250  -1.644   5.221
  408   2HD1  LEU  52          2HD1      LEU  52  -6.623  -0.981   5.378
  409   3HD1  LEU  52          3HD1      LEU  52  -6.902  -2.403   4.374
  410   1HD2  LEU  52          1HD2      LEU  52  -5.211  -3.683   5.613
  411   2HD2  LEU  52          2HD2      LEU  52  -4.870  -2.325   6.686
  412   3HD2  LEU  52          3HD2      LEU  52  -5.339  -3.886   7.360
  413    H    GLN  53           H        GLN  53 -10.460  -2.311   6.057
  414    HA   GLN  53           HA       GLN  53 -11.128  -4.935   7.165
  415   1HB   GLN  53          1HB       GLN  53 -13.073  -2.731   6.480
  416   2HB   GLN  53          2HB       GLN  53 -13.555  -4.417   6.582
  417   1HG   GLN  53          1HG       GLN  53 -13.009  -4.504   8.903
  418   2HG   GLN  53          2HG       GLN  53 -12.278  -2.899   8.841
  419   1HE2  GLN  53          2HE2      GLN  53 -14.525  -3.969  10.454
  420   2HE2  GLN  53          1HE2      GLN  53 -15.864  -2.915  10.117
  421    HA   PRO  54           HA       PRO  54 -10.903  -6.375   2.980
  422   1HB   PRO  54          1HB       PRO  54 -13.525  -7.694   3.475
  423   2HB   PRO  54          2HB       PRO  54 -12.007  -8.389   2.894
  424   1HG   PRO  54          1HG       PRO  54 -12.819  -8.811   5.389
  425   2HG   PRO  54          2HG       PRO  54 -11.105  -8.532   5.025
  426   1HD   PRO  54          1HD       PRO  54 -13.122  -6.673   6.210
  427   2HD   PRO  54          2HD       PRO  54 -11.400  -6.864   6.596
  428    H    ALA  55           H        ALA  55 -13.988  -5.092   4.131
  429    HA   ALA  55           HA       ALA  55 -15.134  -4.521   1.627
  430   1HB   ALA  55          1HB       ALA  55 -16.416  -4.512   3.713
  431   2HB   ALA  55          2HB       ALA  55 -15.536  -3.080   4.246
  432   3HB   ALA  55          3HB       ALA  55 -16.597  -2.990   2.840
  433    H    HIS  56           H        HIS  56 -13.215  -2.493   3.825
  434    HA   HIS  56           HA       HIS  56 -13.212  -0.207   2.161
  435   1HB   HIS  56          1HB       HIS  56 -11.602  -1.058   4.540
  436   2HB   HIS  56          2HB       HIS  56 -11.092   0.343   3.610
  437    HD1  HIS  56           HD1      HIS  56 -12.054   0.549   6.586
  438    HD2  HIS  56           HD2      HIS  56 -14.422   1.249   3.234
  439    HE1  HIS  56           HE1      HIS  56 -13.903   2.064   7.362
  440    HE2  HIS  56           HE2      HIS  56 -15.257   2.568   5.293
  441    H    MET  57           H        MET  57 -11.096  -2.994   2.408
  442    HA   MET  57           HA       MET  57  -9.093  -1.793   0.681
  443   1HB   MET  57          1HB       MET  57  -8.542  -3.241   2.668
  444   2HB   MET  57          2HB       MET  57  -9.181  -4.608   1.769
  445   1HG   MET  57          1HG       MET  57  -7.486  -4.334   0.074
  446   2HG   MET  57          2HG       MET  57  -6.882  -2.884   0.874
  447   1HE   MET  57          1HE       MET  57  -4.417  -3.794   0.935
  448   2HE   MET  57          2HE       MET  57  -4.951  -5.232   0.063
  449   3HE   MET  57          3HE       MET  57  -3.976  -5.397   1.524
  450    H    ASP  58           H        ASP  58 -11.957  -3.460   0.244
  451    HA   ASP  58           HA       ASP  58 -11.388  -5.206  -1.874
  452   1HB   ASP  58          1HB       ASP  58 -13.532  -5.210  -0.660
  453   2HB   ASP  58          2HB       ASP  58 -13.934  -3.649  -1.364
  454    H    ALA  59           H        ALA  59 -12.026  -1.755  -1.813
  455    HA   ALA  59           HA       ALA  59 -12.283  -1.341  -4.587
  456   1HB   ALA  59          1HB       ALA  59 -11.255   0.561  -2.481
  457   2HB   ALA  59          2HB       ALA  59 -11.802   1.005  -4.100
  458   3HB   ALA  59          3HB       ALA  59 -12.945   0.333  -2.934
  459    H    VAL  60           H        VAL  60  -9.493  -1.558  -2.462
  460    HA   VAL  60           HA       VAL  60  -7.533  -0.679  -4.297
  461    HB   VAL  60           HB       VAL  60  -7.151  -2.685  -2.063
  462   1HG1  VAL  60          1HG1      VAL  60  -5.221  -0.787  -3.390
  463   2HG1  VAL  60          2HG1      VAL  60  -4.854  -1.830  -2.017
  464   3HG1  VAL  60          3HG1      VAL  60  -5.259  -2.540  -3.581
  465   1HG2  VAL  60          1HG2      VAL  60  -8.259  -0.704  -1.194
  466   2HG2  VAL  60          2HG2      VAL  60  -6.587  -0.774  -0.638
  467   3HG2  VAL  60          3HG2      VAL  60  -7.037   0.326  -1.940
  468    H    LEU  61           H        LEU  61  -8.893  -3.835  -3.524
  469    HA   LEU  61           HA       LEU  61  -7.239  -5.341  -5.267
  470   1HB   LEU  61          1HB       LEU  61  -9.999  -5.985  -4.222
  471   2HB   LEU  61          2HB       LEU  61  -8.883  -7.130  -4.943
  472    HG   LEU  61           HG       LEU  61  -8.419  -5.642  -2.356
  473   1HD1  LEU  61          1HD1      LEU  61  -9.171  -8.513  -2.882
  474   2HD1  LEU  61          2HD1      LEU  61  -8.724  -7.843  -1.312
  475   3HD1  LEU  61          3HD1      LEU  61 -10.185  -7.283  -2.127
  476   1HD2  LEU  61          1HD2      LEU  61  -6.343  -6.143  -3.541
  477   2HD2  LEU  61          2HD2      LEU  61  -6.508  -7.140  -2.095
  478   3HD2  LEU  61          3HD2      LEU  61  -6.827  -7.834  -3.685
  479    H    ALA  62           H        ALA  62 -10.260  -3.619  -5.655
  480    HA   ALA  62           HA       ALA  62 -10.984  -4.701  -8.175
  481   1HB   ALA  62          1HB       ALA  62 -12.529  -2.821  -8.324
  482   2HB   ALA  62          2HB       ALA  62 -12.589  -3.562  -6.724
  483   3HB   ALA  62          3HB       ALA  62 -11.727  -2.042  -6.961
  484    H    LEU  63           H        LEU  63  -8.836  -2.139  -7.185
  485    HA   LEU  63           HA       LEU  63  -8.581  -1.000  -9.811
  486   1HB   LEU  63          1HB       LEU  63  -6.903  -0.655  -7.328
  487   2HB   LEU  63          2HB       LEU  63  -6.693   0.269  -8.802
  488    HG   LEU  63           HG       LEU  63  -9.155   0.286  -7.055
  489   1HD1  LEU  63          1HD1      LEU  63  -7.274   1.404  -6.000
  490   2HD1  LEU  63          2HD1      LEU  63  -7.004   2.359  -7.459
  491   3HD1  LEU  63          3HD1      LEU  63  -8.482   2.578  -6.522
  492   1HD2  LEU  63          1HD2      LEU  63  -9.687   0.630  -9.413
  493   2HD2  LEU  63          2HD2      LEU  63  -9.911   2.112  -8.484
  494   3HD2  LEU  63          3HD2      LEU  63  -8.484   1.916  -9.502
  495    H    ASN  64           H        ASN  64  -7.660  -3.890  -8.724
  496    HA   ASN  64           HA       ASN  64  -6.283  -5.514  -9.474
  497   1HB   ASN  64          1HB       ASN  64  -6.960  -4.708 -11.713
  498   2HB   ASN  64          2HB       ASN  64  -5.600  -3.587 -11.705
  499   1HD2  ASN  64          2HD2      ASN  64  -6.585  -6.902 -11.991
  500   2HD2  ASN  64          1HD2      ASN  64  -5.072  -7.515 -12.556
  501    HA   PRO  65           HA       PRO  65  -2.358  -3.958  -7.861
  502   1HB   PRO  65          1HB       PRO  65  -2.523  -5.052  -5.406
  503   2HB   PRO  65          2HB       PRO  65  -3.315  -3.523  -5.804
  504   1HG   PRO  65          1HG       PRO  65  -4.511  -6.144  -5.269
  505   2HG   PRO  65          2HG       PRO  65  -5.274  -4.547  -5.289
  506   1HD   PRO  65          1HD       PRO  65  -5.211  -6.580  -7.385
  507   2HD   PRO  65          2HD       PRO  65  -6.189  -5.100  -7.291
  508    H    ALA  66           H        ALA  66  -0.674  -5.139  -8.622
  509    HA   ALA  66           HA       ALA  66  -0.741  -8.046  -8.510
  510   1HB   ALA  66          1HB       ALA  66   1.398  -6.202  -9.582
  511   2HB   ALA  66          2HB       ALA  66   1.352  -7.956  -9.766
  512   3HB   ALA  66          3HB       ALA  66   0.118  -6.957 -10.531
  513    H    VAL  67           H        VAL  67   0.857  -5.342  -7.004
  514    HA   VAL  67           HA       VAL  67   1.562  -7.050  -4.770
  515    HB   VAL  67           HB       VAL  67   3.625  -7.107  -6.047
  516   1HG1  VAL  67          1HG1      VAL  67   3.510  -4.096  -6.011
  517   2HG1  VAL  67          2HG1      VAL  67   4.875  -5.059  -6.573
  518   3HG1  VAL  67          3HG1      VAL  67   3.332  -5.139  -7.422
  519   1HG2  VAL  67          1HG2      VAL  67   3.842  -5.228  -3.697
  520   2HG2  VAL  67          2HG2      VAL  67   3.845  -6.990  -3.632
  521   3HG2  VAL  67          3HG2      VAL  67   5.175  -6.135  -4.411
  522    H    ILE  68           H        ILE  68   1.343  -6.023  -2.850
  523    HA   ILE  68           HA       ILE  68   0.641  -3.161  -2.979
  524    HB   ILE  68           HB       ILE  68  -0.450  -5.216  -1.048
  525   1HG1  ILE  68          1HG1      ILE  68  -1.820  -3.866  -3.385
  526   2HG1  ILE  68          2HG1      ILE  68  -1.257  -5.532  -3.378
  527   1HG2  ILE  68          1HG2      ILE  68  -0.333  -2.979  -0.098
  528   2HG2  ILE  68          2HG2      ILE  68  -1.188  -2.325  -1.494
  529   3HG2  ILE  68          3HG2      ILE  68  -2.010  -3.436  -0.399
  530   1HD1  ILE  68          1HD1      ILE  68  -3.648  -5.404  -2.991
  531   2HD1  ILE  68          2HD1      ILE  68  -2.816  -6.052  -1.578
  532   3HD1  ILE  68          3HD1      ILE  68  -3.377  -4.381  -1.581
  533    H    LEU  69           H        LEU  69   2.062  -1.922  -1.993
  534    HA   LEU  69           HA       LEU  69   3.748  -3.028   0.118
  535   1HB   LEU  69          1HB       LEU  69   3.835  -0.359  -1.293
  536   2HB   LEU  69          2HB       LEU  69   4.968  -0.874  -0.058
  537    HG   LEU  69           HG       LEU  69   4.607  -2.148  -2.771
  538   1HD1  LEU  69          1HD1      LEU  69   5.715   0.018  -2.858
  539   2HD1  LEU  69          2HD1      LEU  69   6.860  -0.510  -1.624
  540   3HD1  LEU  69          3HD1      LEU  69   6.847  -1.291  -3.206
  541   1HD2  LEU  69          1HD2      LEU  69   5.190  -3.810  -1.094
  542   2HD2  LEU  69          2HD2      LEU  69   6.560  -3.498  -2.158
  543   3HD2  LEU  69          3HD2      LEU  69   6.528  -2.803  -0.538
  544    H    LEU  70           H        LEU  70   3.071  -2.875   2.124
  545    HA   LEU  70           HA       LEU  70   1.033  -0.861   2.755
  546   1HB   LEU  70          1HB       LEU  70   0.535  -3.310   3.066
  547   2HB   LEU  70          2HB       LEU  70   1.765  -3.340   4.314
  548    HG   LEU  70           HG       LEU  70   0.446  -1.647   5.584
  549   1HD1  LEU  70          1HD1      LEU  70  -0.770  -0.650   3.750
  550   2HD1  LEU  70          2HD1      LEU  70  -1.594  -2.176   3.432
  551   3HD1  LEU  70          3HD1      LEU  70  -1.900  -1.306   4.935
  552   1HD2  LEU  70          1HD2      LEU  70   0.283  -4.027   6.100
  553   2HD2  LEU  70          2HD2      LEU  70  -1.264  -3.219   6.341
  554   3HD2  LEU  70          3HD2      LEU  70  -1.001  -4.207   4.905
  555    H    GLY  71           H        GLY  71   2.229   0.916   3.313
  556   1HA   GLY  71          1HA       GLY  71   4.385   0.636   5.263
  557   2HA   GLY  71          2HA       GLY  71   3.902   2.119   4.447
  558    H    THR  72           H        THR  72   3.800   0.434   7.344
  559    HA   THR  72           HA       THR  72   1.251   1.542   8.205
  560    HB   THR  72           HB       THR  72   1.763   0.286  10.339
  561    HG1  THR  72           HG1      THR  72   3.932  -0.031  10.314
  562   1HG2  THR  72          1HG2      THR  72   0.313  -0.624   8.589
  563   2HG2  THR  72          2HG2      THR  72   1.721  -1.294   7.765
  564   3HG2  THR  72          3HG2      THR  72   1.260  -1.899   9.356
  565    H    GLY  73           H        GLY  73   2.804   3.609   7.687
  566   1HA   GLY  73          1HA       GLY  73   3.574   5.576   8.542
  567   2HA   GLY  73          2HA       GLY  73   2.730   5.117  10.007
  568    H    GLU  74           H        GLU  74   3.850   4.300  11.715
  569    HA   GLU  74           HA       GLU  74   6.580   5.279  11.772
  570   1HB   GLU  74          1HB       GLU  74   5.033   6.060  13.468
  571   2HB   GLU  74          2HB       GLU  74   4.680   4.409  13.954
  572   1HG   GLU  74          1HG       GLU  74   6.974   4.145  14.742
  573   2HG   GLU  74          2HG       GLU  74   7.335   5.797  14.239
  574    H    ARG  75           H        ARG  75   4.900   2.380  12.993
  575    HA   ARG  75           HA       ARG  75   7.461   0.938  12.791
  576   1HB   ARG  75          1HB       ARG  75   6.449   1.571  15.146
  577   2HB   ARG  75          2HB       ARG  75   5.389   0.207  14.829
  578   1HG   ARG  75          1HG       ARG  75   7.393  -1.220  14.531
  579   2HG   ARG  75          2HG       ARG  75   8.393   0.158  14.994
  580   1HD   ARG  75          1HD       ARG  75   6.413  -1.369  16.656
  581   2HD   ARG  75          2HD       ARG  75   8.129  -1.103  16.960
  582    HE   ARG  75           HE       ARG  75   6.194   1.125  17.035
  583   1HH1  ARG  75          1HH1      ARG  75   8.766  -0.742  18.538
  584   2HH1  ARG  75          2HH1      ARG  75   8.821   0.274  19.950
  585   1HH2  ARG  75          1HH2      ARG  75   6.290   2.441  18.873
  586   2HH2  ARG  75          2HH2      ARG  75   7.422   2.075  20.149
  587    H    GLN  76           H        GLN  76   7.261  -1.351  12.373
  588    HA   GLN  76           HA       GLN  76   5.306  -1.949  10.410
  589   1HB   GLN  76          1HB       GLN  76   7.619  -2.922  10.547
  590   2HB   GLN  76          2HB       GLN  76   7.071  -3.901  11.900
  591   1HG   GLN  76          1HG       GLN  76   5.407  -4.959  10.430
  592   2HG   GLN  76          2HG       GLN  76   6.026  -4.008   9.079
  593   1HE2  GLN  76          2HE2      GLN  76   6.691  -5.757   7.889
  594   2HE2  GLN  76          1HE2      GLN  76   8.029  -6.760   8.350
  595    H    GLN  77           H        GLN  77   3.224  -1.900  11.140
  596    HA   GLN  77           HA       GLN  77   2.549  -3.592  13.450
  597   1HB   GLN  77          1HB       GLN  77   1.946  -1.180  13.616
  598   2HB   GLN  77          2HB       GLN  77   0.923  -1.365  12.199
  599   1HG   GLN  77          1HG       GLN  77  -0.471  -2.958  13.400
  600   2HG   GLN  77          2HG       GLN  77   0.564  -2.806  14.817
  601   1HE2  GLN  77          2HE2      GLN  77   0.488  -0.918  16.045
  602   2HE2  GLN  77          1HE2      GLN  77  -0.822   0.212  15.905
  603    H    PHE  78           H        PHE  78   1.498  -5.427  13.080
  604    HA   PHE  78           HA       PHE  78   0.662  -6.024  10.377
  605   1HB   PHE  78          1HB       PHE  78   0.713  -7.756  12.855
  606   2HB   PHE  78          2HB       PHE  78   0.347  -8.321  11.226
  607    HD1  PHE  78           HD1      PHE  78   2.135  -8.038   9.441
  608    HD2  PHE  78           HD2      PHE  78   2.917  -7.645  13.605
  609    HE1  PHE  78           HE1      PHE  78   4.534  -8.383   9.020
  610    HE2  PHE  78           HE2      PHE  78   5.318  -7.991  13.191
  611    HZ   PHE  78           HZ       PHE  78   6.128  -8.359  10.896
  612    HA   PRO  79           HA       PRO  79  -3.566  -4.951  11.260
  613   1HB   PRO  79          1HB       PRO  79  -4.181  -6.226   8.700
  614   2HB   PRO  79          2HB       PRO  79  -4.327  -4.531   9.164
  615   1HG   PRO  79          1HG       PRO  79  -2.464  -5.405   7.412
  616   2HG   PRO  79          2HG       PRO  79  -2.197  -4.022   8.489
  617   1HD   PRO  79          1HD       PRO  79  -1.228  -6.841   8.746
  618   2HD   PRO  79          2HD       PRO  79  -0.385  -5.318   9.100
  619    H    SER  80           H        SER  80  -5.738  -6.143  10.916
  620    HA   SER  80           HA       SER  80  -5.707  -8.470  12.471
  621   1HB   SER  80          1HB       SER  80  -7.948  -7.514  10.681
  622   2HB   SER  80          2HB       SER  80  -8.089  -8.514  12.128
  623    HG   SER  80           HG       SER  80  -8.301  -5.951  12.054
  624    H    THR  81           H        THR  81  -5.928 -10.609  11.998
  625    HA   THR  81           HA       THR  81  -4.896 -11.583   9.574
  626    HB   THR  81           HB       THR  81  -5.951 -13.796  10.533
  627    HG1  THR  81           HG1      THR  81  -5.751 -12.780  13.048
  628   1HG2  THR  81          1HG2      THR  81  -4.022 -14.041  12.020
  629   2HG2  THR  81          2HG2      THR  81  -3.559 -13.272  10.502
  630   3HG2  THR  81          3HG2      THR  81  -3.752 -12.299  11.960
  631    H    ASP  82           H        ASP  82  -8.060 -10.729  10.549
  632    HA   ASP  82           HA       ASP  82  -9.679 -12.194   8.819
  633   1HB   ASP  82          1HB       ASP  82 -10.588 -10.795  10.596
  634   2HB   ASP  82          2HB       ASP  82  -9.977  -9.347   9.807
  635    H    VAL  83           H        VAL  83  -7.877  -9.202   8.285
  636    HA   VAL  83           HA       VAL  83  -8.900  -8.882   5.598
  637    HB   VAL  83           HB       VAL  83  -6.659  -7.354   6.929
  638   1HG1  VAL  83          1HG1      VAL  83  -7.267  -5.588   5.334
  639   2HG1  VAL  83          2HG1      VAL  83  -6.744  -7.065   4.526
  640   3HG1  VAL  83          3HG1      VAL  83  -8.460  -6.667   4.612
  641   1HG2  VAL  83          1HG2      VAL  83  -9.612  -6.740   6.921
  642   2HG2  VAL  83          2HG2      VAL  83  -8.656  -7.238   8.317
  643   3HG2  VAL  83          3HG2      VAL  83  -8.342  -5.685   7.543
  644    H    LEU  84           H        LEU  84  -5.932  -9.937   7.158
  645    HA   LEU  84           HA       LEU  84  -4.185  -9.828   4.984
  646   1HB   LEU  84          1HB       LEU  84  -4.171 -11.753   7.309
  647   2HB   LEU  84          2HB       LEU  84  -2.820 -11.455   6.234
  648    HG   LEU  84           HG       LEU  84  -4.059  -9.410   8.079
  649   1HD1  LEU  84          1HD1      LEU  84  -2.862 -11.148   9.298
  650   2HD1  LEU  84          2HD1      LEU  84  -1.451 -10.910   8.267
  651   3HD1  LEU  84          3HD1      LEU  84  -1.980  -9.621   9.347
  652   1HD2  LEU  84          1HD2      LEU  84  -2.154  -8.019   7.467
  653   2HD2  LEU  84          2HD2      LEU  84  -1.599  -9.258   6.340
  654   3HD2  LEU  84          3HD2      LEU  84  -3.124  -8.420   6.048
  655    H    ALA  85           H        ALA  85  -6.617 -12.180   5.783
  656    HA   ALA  85           HA       ALA  85  -5.619 -14.372   4.333
  657   1HB   ALA  85          1HB       ALA  85  -8.488 -13.698   4.960
  658   2HB   ALA  85          2HB       ALA  85  -7.865 -15.281   4.493
  659   3HB   ALA  85          3HB       ALA  85  -7.377 -14.558   6.026
  660    H    ALA  86           H        ALA  86  -7.331 -11.509   3.311
  661    HA   ALA  86           HA       ALA  86  -8.432 -12.534   0.912
  662   1HB   ALA  86          1HB       ALA  86  -7.707  -9.681   1.564
  663   2HB   ALA  86          2HB       ALA  86  -8.808 -10.220   0.295
  664   3HB   ALA  86          3HB       ALA  86  -9.224 -10.473   1.990
  665    H    CYS  87           H        CYS  87  -5.425 -10.763   1.568
  666    HA   CYS  87           HA       CYS  87  -4.612 -10.707  -1.163
  667   1HB   CYS  87          1HB       CYS  87  -2.918 -10.363   1.321
  668   2HB   CYS  87          2HB       CYS  87  -2.497  -9.855  -0.312
  669    HG   CYS  87           HG       CYS  87  -3.309  -7.738   1.562
  670    H    LEU  88           H        LEU  88  -3.962 -12.820   1.566
  671    HA   LEU  88           HA       LEU  88  -1.801 -14.223   0.410
  672   1HB   LEU  88          1HB       LEU  88  -2.389 -14.086   2.852
  673   2HB   LEU  88          2HB       LEU  88  -3.700 -15.204   2.540
  674    HG   LEU  88           HG       LEU  88  -0.888 -15.991   1.851
  675   1HD1  LEU  88          1HD1      LEU  88  -2.165 -16.194   4.577
  676   2HD1  LEU  88          2HD1      LEU  88  -0.640 -16.936   4.094
  677   3HD1  LEU  88          3HD1      LEU  88  -0.787 -15.180   4.150
  678   1HD2  LEU  88          1HD2      LEU  88  -3.313 -17.538   2.768
  679   2HD2  LEU  88          2HD2      LEU  88  -2.729 -17.423   1.108
  680   3HD2  LEU  88          3HD2      LEU  88  -1.749 -18.230   2.334
  681    H    THR  89           H        THR  89  -5.293 -14.827   0.471
  682    HA   THR  89           HA       THR  89  -5.170 -17.459  -0.518
  683    HB   THR  89           HB       THR  89  -7.601 -16.979  -1.227
  684    HG1  THR  89           HG1      THR  89  -7.371 -14.757   0.496
  685   1HG2  THR  89          1HG2      THR  89  -7.003 -18.185   0.806
  686   2HG2  THR  89          2HG2      THR  89  -6.754 -16.659   1.654
  687   3HG2  THR  89          3HG2      THR  89  -8.368 -17.110   1.103
  688    H    ARG  90           H        ARG  90  -5.672 -14.363  -2.228
  689    HA   ARG  90           HA       ARG  90  -5.899 -15.669  -4.772
  690   1HB   ARG  90          1HB       ARG  90  -6.934 -13.440  -4.244
  691   2HB   ARG  90          2HB       ARG  90  -5.316 -12.747  -4.274
  692   1HG   ARG  90          1HG       ARG  90  -5.082 -13.581  -6.617
  693   2HG   ARG  90          2HG       ARG  90  -6.781 -14.046  -6.560
  694   1HD   ARG  90          1HD       ARG  90  -7.356 -11.683  -6.062
  695   2HD   ARG  90          2HD       ARG  90  -5.654 -11.264  -6.268
  696    HE   ARG  90           HE       ARG  90  -7.502 -12.158  -8.376
  697   1HH1  ARG  90          1HH1      ARG  90  -4.367 -10.904  -7.448
  698   2HH1  ARG  90          2HH1      ARG  90  -3.910 -10.462  -9.062
  699   1HH2  ARG  90          1HH2      ARG  90  -6.932 -11.545 -10.502
  700   2HH2  ARG  90          2HH2      ARG  90  -5.374 -10.823 -10.808
  701    H    GLY  91           H        GLY  91  -3.296 -14.409  -2.859
  702   1HA   GLY  91          1HA       GLY  91  -1.041 -15.042  -3.202
  703   2HA   GLY  91          2HA       GLY  91  -1.415 -15.366  -4.888
  704    H    ILE  92           H        ILE  92  -2.008 -12.491  -2.904
  705    HA   ILE  92           HA       ILE  92  -0.500 -10.921  -4.885
  706    HB   ILE  92           HB       ILE  92  -2.541  -9.980  -2.856
  707   1HG1  ILE  92          1HG1      ILE  92  -2.734 -10.207  -5.869
  708   2HG1  ILE  92          2HG1      ILE  92  -3.520 -11.281  -4.717
  709   1HG2  ILE  92          1HG2      ILE  92  -0.873  -8.271  -3.270
  710   2HG2  ILE  92          2HG2      ILE  92  -1.075  -8.461  -5.012
  711   3HG2  ILE  92          3HG2      ILE  92  -2.397  -7.819  -4.037
  712   1HD1  ILE  92          1HD1      ILE  92  -5.073  -9.646  -5.613
  713   2HD1  ILE  92          2HD1      ILE  92  -4.843  -9.412  -3.879
  714   3HD1  ILE  92          3HD1      ILE  92  -4.048  -8.335  -5.028
  715    H    GLY  93           H        GLY  93   1.411 -10.118  -4.305
  716   1HA   GLY  93          1HA       GLY  93   2.582 -10.631  -1.799
  717   2HA   GLY  93          2HA       GLY  93   3.217  -9.532  -3.018
  718    H    LEU  94           H        LEU  94   2.238  -9.693   0.081
  719    HA   LEU  94           HA       LEU  94   1.425  -6.863   0.117
  720   1HB   LEU  94          1HB       LEU  94  -0.455  -8.316   0.726
  721   2HB   LEU  94          2HB       LEU  94   0.523  -9.079   1.963
  722    HG   LEU  94           HG       LEU  94   0.642  -6.910   3.165
  723   1HD1  LEU  94          1HD1      LEU  94  -1.319  -6.007   1.059
  724   2HD1  LEU  94          2HD1      LEU  94  -0.881  -5.109   2.514
  725   3HD1  LEU  94          3HD1      LEU  94   0.331  -5.417   1.270
  726   1HD2  LEU  94          1HD2      LEU  94  -1.037  -8.578   3.761
  727   2HD2  LEU  94          2HD2      LEU  94  -1.660  -6.940   3.975
  728   3HD2  LEU  94          3HD2      LEU  94  -2.146  -7.893   2.572
  729    H    GLU  95           H        GLU  95   3.327  -5.919   0.604
  730    HA   GLU  95           HA       GLU  95   4.970  -7.125   2.710
  731   1HB   GLU  95          1HB       GLU  95   5.693  -4.897   0.801
  732   2HB   GLU  95          2HB       GLU  95   6.786  -5.739   1.890
  733   1HG   GLU  95          1HG       GLU  95   5.379  -6.888  -0.510
  734   2HG   GLU  95          2HG       GLU  95   7.101  -6.552  -0.344
  735    H    ALA  96           H        ALA  96   4.198  -6.450   4.625
  736    HA   ALA  96           HA       ALA  96   3.418  -3.698   5.054
  737   1HB   ALA  96          1HB       ALA  96   2.944  -4.414   7.348
  738   2HB   ALA  96          2HB       ALA  96   2.191  -5.492   6.175
  739   3HB   ALA  96          3HB       ALA  96   3.663  -5.987   7.010
  740    H    MET  97           H        MET  97   4.861  -2.165   5.427
  741    HA   MET  97           HA       MET  97   7.249  -2.745   7.013
  742   1HB   MET  97          1HB       MET  97   7.314  -1.573   4.222
  743   2HB   MET  97          2HB       MET  97   8.677  -1.555   5.331
  744   1HG   MET  97          1HG       MET  97   8.788  -3.959   5.312
  745   2HG   MET  97          2HG       MET  97   7.328  -4.051   4.331
  746   1HE   MET  97          1HE       MET  97   7.196  -3.229   1.801
  747   2HE   MET  97          2HE       MET  97   8.548  -2.490   0.944
  748   3HE   MET  97          3HE       MET  97   7.790  -1.646   2.295
  749    H    THR  98           H        THR  98   8.554  -0.401   6.879
  750    HA   THR  98           HA       THR  98   6.695   1.449   8.117
  751    HB   THR  98           HB       THR  98   8.743   2.786   8.595
  752    HG1  THR  98           HG1      THR  98  10.729   1.277   8.147
  753   1HG2  THR  98          1HG2      THR  98   7.985   1.102  10.198
  754   2HG2  THR  98          2HG2      THR  98   8.919  -0.134   9.354
  755   3HG2  THR  98          3HG2      THR  98   9.747   1.190  10.172
  756    H    ASN  99           H        ASN  99   6.854   3.811   7.523
  757    HA   ASN  99           HA       ASN  99   6.200   4.321   4.886
  758   1HB   ASN  99          1HB       ASN  99   7.104   6.040   7.147
  759   2HB   ASN  99          2HB       ASN  99   7.071   6.748   5.537
  760   1HD2  ASN  99          2HD2      ASN  99   5.434   8.174   6.165
  761   2HD2  ASN  99          1HD2      ASN  99   3.798   7.637   6.348
  762    H    ALA 100           H        ALA 100   9.359   4.651   6.448
  763    HA   ALA 100           HA       ALA 100  10.707   5.736   4.229
  764   1HB   ALA 100          1HB       ALA 100  11.852   4.109   6.494
  765   2HB   ALA 100          2HB       ALA 100  12.753   5.168   5.407
  766   3HB   ALA 100          3HB       ALA 100  11.568   5.850   6.523
  767    H    ALA 101           H        ALA 101  10.535   2.388   5.427
  768    HA   ALA 101           HA       ALA 101  12.188   1.273   3.445
  769   1HB   ALA 101          1HB       ALA 101  11.682   0.139   5.547
  770   2HB   ALA 101          2HB       ALA 101  10.006  -0.065   5.037
  771   3HB   ALA 101          3HB       ALA 101  11.300  -0.880   4.159
  772    H    ALA 102           H        ALA 102   8.670   1.665   3.616
  773    HA   ALA 102           HA       ALA 102   8.039   0.172   1.322
  774   1HB   ALA 102          1HB       ALA 102   6.378   0.816   3.001
  775   2HB   ALA 102          2HB       ALA 102   6.524   2.500   2.496
  776   3HB   ALA 102          3HB       ALA 102   5.885   1.296   1.376
  777    H    ALA 103           H        ALA 103   8.786   3.608   1.735
  778    HA   ALA 103           HA       ALA 103   8.106   4.466  -0.841
  779   1HB   ALA 103          1HB       ALA 103   8.485   5.981   1.043
  780   2HB   ALA 103          2HB       ALA 103  10.208   5.605   0.995
  781   3HB   ALA 103          3HB       ALA 103   9.449   6.435  -0.364
  782    H    ARG 104           H        ARG 104  11.192   3.246   0.426
  783    HA   ARG 104           HA       ARG 104  12.550   3.762  -2.054
  784   1HB   ARG 104          1HB       ARG 104  13.353   2.399   0.498
  785   2HB   ARG 104          2HB       ARG 104  14.373   2.305  -0.932
  786   1HG   ARG 104          1HG       ARG 104  15.186   4.083   0.417
  787   2HG   ARG 104          2HG       ARG 104  14.397   4.805  -0.985
  788   1HD   ARG 104          1HD       ARG 104  12.353   5.100   0.418
  789   2HD   ARG 104          2HD       ARG 104  13.294   4.557   1.807
  790    HE   ARG 104           HE       ARG 104  13.898   7.003   0.253
  791   1HH1  ARG 104          1HH1      ARG 104  13.827   5.194   3.254
  792   2HH1  ARG 104          2HH1      ARG 104  14.347   6.540   4.228
  793   1HH2  ARG 104          1HH2      ARG 104  14.575   8.774   1.529
  794   2HH2  ARG 104          2HH2      ARG 104  14.778   8.581   3.246
  795    H    THR 105           H        THR 105  11.022   0.982  -0.544
  796    HA   THR 105           HA       THR 105  11.878  -0.929  -2.459
  797    HB   THR 105           HB       THR 105   9.324  -0.955  -0.832
  798    HG1  THR 105           HG1      THR 105  10.981  -0.807   0.631
  799   1HG2  THR 105          1HG2      THR 105  10.935  -3.206  -2.048
  800   2HG2  THR 105          2HG2      THR 105   9.494  -3.392  -1.048
  801   3HG2  THR 105          3HG2      THR 105   9.376  -2.620  -2.628
  802    H    TYR 106           H        TYR 106   9.199   1.322  -2.253
  803    HA   TYR 106           HA       TYR 106   7.698   0.497  -4.464
  804   1HB   TYR 106          1HB       TYR 106   7.021   2.178  -2.720
  805   2HB   TYR 106          2HB       TYR 106   8.097   3.335  -3.493
  806    HD1  TYR 106           HD1      TYR 106   5.161   1.160  -4.187
  807    HD2  TYR 106           HD2      TYR 106   7.290   4.700  -5.199
  808    HE1  TYR 106           HE1      TYR 106   3.328   1.828  -5.677
  809    HE2  TYR 106           HE2      TYR 106   5.461   5.377  -6.699
  810    HH   TYR 106           HH       TYR 106   2.417   3.869  -6.655
  811    H    ASN 107           H        ASN 107  10.384   2.772  -4.188
  812    HA   ASN 107           HA       ASN 107  10.590   3.645  -6.805
  813   1HB   ASN 107          1HB       ASN 107  11.971   4.712  -5.236
  814   2HB   ASN 107          2HB       ASN 107  12.622   3.192  -4.636
  815   1HD2  ASN 107          2HD2      ASN 107  14.365   2.290  -5.615
  816   2HD2  ASN 107          1HD2      ASN 107  15.271   3.064  -6.869
  817    H    VAL 108           H        VAL 108  11.879   0.686  -5.356
  818    HA   VAL 108           HA       VAL 108  13.334  -0.152  -7.639
  819    HB   VAL 108           HB       VAL 108  12.232  -1.836  -5.380
  820   1HG1  VAL 108          1HG1      VAL 108  13.968  -3.444  -6.001
  821   2HG1  VAL 108          2HG1      VAL 108  12.840  -3.176  -7.329
  822   3HG1  VAL 108          3HG1      VAL 108  14.433  -2.421  -7.360
  823   1HG2  VAL 108          1HG2      VAL 108  14.458  -1.617  -4.394
  824   2HG2  VAL 108          2HG2      VAL 108  14.939  -0.545  -5.709
  825   3HG2  VAL 108          3HG2      VAL 108  13.683  -0.043  -4.578
  826    H    LEU 109           H        LEU 109  10.139  -1.091  -6.372
  827    HA   LEU 109           HA       LEU 109   9.586  -2.954  -8.427
  828   1HB   LEU 109          1HB       LEU 109   7.687  -1.450  -6.625
  829   2HB   LEU 109          2HB       LEU 109   7.248  -2.823  -7.625
  830    HG   LEU 109           HG       LEU 109   9.200  -2.873  -5.320
  831   1HD1  LEU 109          1HD1      LEU 109   6.426  -4.018  -5.592
  832   2HD1  LEU 109          2HD1      LEU 109   7.505  -4.232  -4.213
  833   3HD1  LEU 109          3HD1      LEU 109   6.883  -2.628  -4.608
  834   1HD2  LEU 109          1HD2      LEU 109   8.189  -5.109  -7.076
  835   2HD2  LEU 109          2HD2      LEU 109   9.827  -4.455  -7.070
  836   3HD2  LEU 109          3HD2      LEU 109   9.208  -5.296  -5.649
  837    H    ALA 110           H        ALA 110   8.867   0.487  -8.070
  838    HA   ALA 110           HA       ALA 110   7.212   0.710 -10.356
  839   1HB   ALA 110          1HB       ALA 110   7.258   2.407  -8.592
  840   2HB   ALA 110          2HB       ALA 110   8.908   2.831  -9.042
  841   3HB   ALA 110          3HB       ALA 110   7.587   3.112 -10.174
  842    H    SER 111           H        SER 111  10.663   0.629  -9.915
  843    HA   SER 111           HA       SER 111  11.314   1.642 -12.512
  844   1HB   SER 111          1HB       SER 111  12.967   0.051 -10.536
  845   2HB   SER 111          2HB       SER 111  13.598   0.799 -12.004
  846    HG   SER 111           HG       SER 111  12.544   2.047  -9.689
  847    H    GLU 112           H        GLU 112  10.683  -1.530 -11.139
  848    HA   GLU 112           HA       GLU 112  11.528  -3.029 -13.411
  849   1HB   GLU 112          1HB       GLU 112  11.262  -4.054 -11.185
  850   2HB   GLU 112          2HB       GLU 112   9.532  -3.748 -11.248
  851   1HG   GLU 112          1HG       GLU 112   9.471  -5.191 -13.311
  852   2HG   GLU 112          2HG       GLU 112  11.132  -5.649 -12.938
  853    H    GLY 113           H        GLY 113   8.500  -1.555 -12.398
  854   1HA   GLY 113          1HA       GLY 113   6.919  -0.754 -14.024
  855   2HA   GLY 113          2HA       GLY 113   7.431  -2.048 -15.099
  856    H    ARG 114           H        ARG 114   7.159  -3.127 -11.944
  857    HA   ARG 114           HA       ARG 114   4.986  -4.850 -12.532
  858   1HB   ARG 114          1HB       ARG 114   6.900  -5.233 -10.881
  859   2HB   ARG 114          2HB       ARG 114   6.027  -4.181  -9.779
  860   1HG   ARG 114          1HG       ARG 114   4.127  -5.716  -9.814
  861   2HG   ARG 114          2HG       ARG 114   5.004  -6.768 -10.927
  862   1HD   ARG 114          1HD       ARG 114   5.751  -6.087  -8.085
  863   2HD   ARG 114          2HD       ARG 114   5.219  -7.652  -8.700
  864    HE   ARG 114           HE       ARG 114   7.530  -6.826 -10.101
  865   1HH1  ARG 114          1HH1      ARG 114   6.548  -8.053  -6.947
  866   2HH1  ARG 114          2HH1      ARG 114   8.122  -8.688  -6.576
  867   1HH2  ARG 114          1HH2      ARG 114   9.574  -7.659  -9.610
  868   2HH2  ARG 114          2HH2      ARG 114   9.837  -8.492  -8.099
  869    H    ARG 115           H        ARG 115   2.847  -4.729 -11.939
  870    HA   ARG 115           HA       ARG 115   1.691  -2.188 -11.454
  871   1HB   ARG 115          1HB       ARG 115   0.491  -3.929 -12.670
  872   2HB   ARG 115          2HB       ARG 115   0.512  -4.968 -11.257
  873   1HG   ARG 115          1HG       ARG 115  -1.667  -4.039 -11.478
  874   2HG   ARG 115          2HG       ARG 115  -0.896  -3.299 -10.076
  875   1HD   ARG 115          1HD       ARG 115  -0.436  -1.290 -11.324
  876   2HD   ARG 115          2HD       ARG 115  -1.022  -2.037 -12.812
  877    HE   ARG 115           HE       ARG 115  -3.085  -2.152 -10.933
  878   1HH1  ARG 115          1HH1      ARG 115  -1.302   0.298 -12.723
  879   2HH1  ARG 115          2HH1      ARG 115  -2.641   1.407 -12.758
  880   1HH2  ARG 115          1HH2      ARG 115  -4.832  -0.688 -10.995
  881   2HH2  ARG 115          2HH2      ARG 115  -4.632   0.856 -11.772
  882    H    VAL 116           H        VAL 116   2.658  -1.394  -9.580
  883    HA   VAL 116           HA       VAL 116   2.155  -2.876  -7.102
  884    HB   VAL 116           HB       VAL 116   4.499  -2.375  -7.493
  885   1HG1  VAL 116          1HG1      VAL 116   3.682   0.524  -7.540
  886   2HG1  VAL 116          2HG1      VAL 116   5.338  -0.078  -7.545
  887   3HG1  VAL 116          3HG1      VAL 116   4.275  -0.416  -8.910
  888   1HG2  VAL 116          1HG2      VAL 116   3.341  -0.683  -5.282
  889   2HG2  VAL 116          2HG2      VAL 116   3.743  -2.398  -5.188
  890   3HG2  VAL 116          3HG2      VAL 116   5.023  -1.203  -5.401
  891    H    ALA 117           H        ALA 117   0.943  -2.078  -5.516
  892    HA   ALA 117           HA       ALA 117  -0.127   0.648  -5.840
  893   1HB   ALA 117          1HB       ALA 117  -1.383  -1.720  -4.445
  894   2HB   ALA 117          2HB       ALA 117  -2.080  -0.103  -4.563
  895   3HB   ALA 117          3HB       ALA 117  -1.856  -1.076  -6.019
  896    H    LEU 118           H        LEU 118   0.717   2.044  -4.435
  897    HA   LEU 118           HA       LEU 118   2.019   1.060  -2.034
  898   1HB   LEU 118          1HB       LEU 118   3.075   2.819  -3.436
  899   2HB   LEU 118          2HB       LEU 118   1.735   3.887  -3.067
  900    HG   LEU 118           HG       LEU 118   2.373   3.816  -0.669
  901   1HD1  LEU 118          1HD1      LEU 118   4.757   2.273  -1.682
  902   2HD1  LEU 118          2HD1      LEU 118   4.555   2.904  -0.047
  903   3HD1  LEU 118          3HD1      LEU 118   3.474   1.646  -0.647
  904   1HD2  LEU 118          1HD2      LEU 118   4.379   5.212  -0.885
  905   2HD2  LEU 118          2HD2      LEU 118   4.569   4.678  -2.553
  906   3HD2  LEU 118          3HD2      LEU 118   3.164   5.636  -2.089
  907    H    ALA 119           H        ALA 119   0.401   0.395  -0.690
  908    HA   ALA 119           HA       ALA 119  -1.761   2.196   0.006
  909   1HB   ALA 119          1HB       ALA 119  -2.183  -0.224  -0.101
  910   2HB   ALA 119          2HB       ALA 119  -1.014  -0.481   1.194
  911   3HB   ALA 119          3HB       ALA 119  -2.497   0.422   1.511
  912    H    MET 120           H        MET 120  -0.652   3.938   0.820
  913    HA   MET 120           HA       MET 120   1.353   3.519   2.882
  914   1HB   MET 120          1HB       MET 120   1.348   5.203   0.837
  915   2HB   MET 120          2HB       MET 120   0.485   6.226   1.976
  916   1HG   MET 120          1HG       MET 120   2.802   6.767   2.064
  917   2HG   MET 120          2HG       MET 120   2.360   5.955   3.566
  918   1HE   MET 120          1HE       MET 120   6.125   4.946   2.607
  919   2HE   MET 120          2HE       MET 120   5.136   5.859   3.749
  920   3HE   MET 120          3HE       MET 120   5.323   6.431   2.091
  921    H    ILE 121           H        ILE 121   0.309   2.983   4.740
  922    HA   ILE 121           HA       ILE 121  -1.914   4.617   5.672
  923    HB   ILE 121           HB       ILE 121  -0.596   2.208   6.948
  924   1HG1  ILE 121          1HG1      ILE 121  -3.181   2.500   5.400
  925   2HG1  ILE 121          2HG1      ILE 121  -1.741   1.634   4.875
  926   1HG2  ILE 121          1HG2      ILE 121  -2.554   2.174   8.434
  927   2HG2  ILE 121          2HG2      ILE 121  -1.609   3.650   8.626
  928   3HG2  ILE 121          3HG2      ILE 121  -3.119   3.681   7.715
  929   1HD1  ILE 121          1HD1      ILE 121  -3.503   0.903   7.200
  930   2HD1  ILE 121          2HD1      ILE 121  -3.453   0.104   5.630
  931   3HD1  ILE 121          3HD1      ILE 121  -2.053   0.037   6.698
  932    H    VAL 122           H        VAL 122  -1.071   6.565   6.218
  933    HA   VAL 122           HA       VAL 122   1.340   6.675   7.844
  934    HB   VAL 122           HB       VAL 122  -0.325   8.965   6.791
  935   1HG1  VAL 122          1HG1      VAL 122   1.709  10.287   7.148
  936   2HG1  VAL 122          2HG1      VAL 122   1.122   9.579   8.652
  937   3HG1  VAL 122          3HG1      VAL 122   2.509   8.870   7.825
  938   1HG2  VAL 122          1HG2      VAL 122   1.342   9.124   4.998
  939   2HG2  VAL 122          2HG2      VAL 122   2.111   7.652   5.591
  940   3HG2  VAL 122          3HG2      VAL 122   0.469   7.593   4.950
  941    H    GLY 123           H        GLY 123   1.378   7.110   9.960
  942   1HA   GLY 123          1HA       GLY 123  -1.186   7.584  11.308
  943   2HA   GLY 123          2HA       GLY 123   0.257   6.917  12.064
  944    H    GLY 124           H        GLY 124   0.333   8.418  13.733
  945   1HA   GLY 124          1HA       GLY 124   1.617  10.377  14.351
  946   2HA   GLY 124          2HA       GLY 124   1.065  11.142  12.866
  947    H    LEU 125           H        LEU 125  -1.119   9.270  14.765
  948    HA   LEU 125           HA       LEU 125  -2.514  11.754  15.515
  949   1HB   LEU 125          1HB       LEU 125  -3.690   9.072  14.780
  950   2HB   LEU 125          2HB       LEU 125  -4.612  10.463  15.316
  951    HG   LEU 125           HG       LEU 125  -2.978  10.333  12.776
  952   1HD1  LEU 125          1HD1      LEU 125  -5.960  10.222  13.216
  953   2HD1  LEU 125          2HD1      LEU 125  -5.155  10.332  11.650
  954   3HD1  LEU 125          3HD1      LEU 125  -4.934   8.902  12.655
  955   1HD2  LEU 125          1HD2      LEU 125  -4.063  12.457  12.237
  956   2HD2  LEU 125          2HD2      LEU 125  -4.854  12.457  13.813
  957   3HD2  LEU 125          3HD2      LEU 125  -3.099  12.588  13.708
  958    H    GLU 126           H        GLU 126  -0.891   9.090  16.703
  959    HA   GLU 126           HA       GLU 126  -2.574   8.578  18.983
  960   1HB   GLU 126          1HB       GLU 126   0.297   7.768  18.993
  961   2HB   GLU 126          2HB       GLU 126  -1.110   6.897  19.572
  962   1HG   GLU 126          1HG       GLU 126  -0.575   5.641  17.756
  963   2HG   GLU 126          2HG       GLU 126  -1.693   6.786  17.013
  964    H    HIS 127           H        HIS 127  -2.643  10.928  19.552
  965    HA   HIS 127           HA       HIS 127  -0.284  11.930  20.919
  966   1HB   HIS 127          1HB       HIS 127  -1.686  13.510  19.671
  967   2HB   HIS 127          2HB       HIS 127  -3.070  13.096  20.676
  968    HD1  HIS 127           HD1      HIS 127  -3.523  14.851  22.343
  969    HD2  HIS 127           HD2      HIS 127   0.546  14.495  21.548
  970    HE1  HIS 127           HE1      HIS 127  -2.391  16.570  23.790
  971    HE2  HIS 127           HE2      HIS 127   0.022  16.518  23.072
  972    H    HIS 128           H        HIS 128   0.005  10.430  22.574
  973    HA   HIS 128           HA       HIS 128  -2.168  10.248  24.540
  974   1HB   HIS 128          1HB       HIS 128   0.296   8.517  24.258
  975   2HB   HIS 128          2HB       HIS 128  -0.975   8.299  25.452
  976    HD1  HIS 128           HD1      HIS 128   0.011   6.400  22.933
  977    HD2  HIS 128           HD2      HIS 128  -3.545   8.515  23.397
  978    HE1  HIS 128           HE1      HIS 128  -1.664   5.258  21.439
  979    HE2  HIS 128           HE2      HIS 128  -3.838   6.481  21.825
  980    H    HIS 129           H        HIS 129  -1.871  12.184  25.552
  981    HA   HIS 129           HA       HIS 129  -1.113  13.599  27.147
  982   1HB   HIS 129          1HB       HIS 129   0.772  11.328  27.792
  983   2HB   HIS 129          2HB       HIS 129   0.649  12.800  28.744
  984    HD1  HIS 129           HD1      HIS 129  -1.073  12.841  30.532
  985    HD2  HIS 129           HD2      HIS 129  -1.678   9.737  27.828
  986    HE1  HIS 129           HE1      HIS 129  -2.903  11.421  31.524
  987    HE2  HIS 129           HE2      HIS 129  -3.359   9.641  29.796
  988    H    HIS 130           H        HIS 130   0.162  15.361  27.108
  989    HA   HIS 130           HA       HIS 130   2.532  15.326  25.411
  990   1HB   HIS 130          1HB       HIS 130   1.013  17.284  25.305
  991   2HB   HIS 130          2HB       HIS 130   1.320  17.607  27.007
  992    HD1  HIS 130           HD1      HIS 130   3.145  17.582  23.672
  993    HD2  HIS 130           HD2      HIS 130   3.507  19.174  27.500
  994    HE1  HIS 130           HE1      HIS 130   5.102  19.154  23.574
  995    HE2  HIS 130           HE2      HIS 130   5.424  19.942  25.943
  996    H    HIS 131           H        HIS 131   3.210  13.604  27.038
  997    HA   HIS 131           HA       HIS 131   4.300  14.720  29.516
  998   1HB   HIS 131          1HB       HIS 131   2.912  12.586  29.468
  999   2HB   HIS 131          2HB       HIS 131   4.274  11.821  28.656
 1000    HD1  HIS 131           HD1      HIS 131   5.428  10.391  30.312
 1001    HD2  HIS 131           HD2      HIS 131   4.215  14.015  31.960
 1002    HE1  HIS 131           HE1      HIS 131   6.269  10.380  32.684
 1003    HE2  HIS 131           HE2      HIS 131   5.739  12.680  33.565
 1004    H    HIS 132           H        HIS 132   5.456  15.476  27.070
 1005    HA   HIS 132           HA       HIS 132   8.190  14.838  27.572
 1006   1HB   HIS 132          1HB       HIS 132   8.698  13.978  25.301
 1007   2HB   HIS 132          2HB       HIS 132   7.668  12.882  26.209
 1008    HD1  HIS 132           HD1      HIS 132   7.905  14.670  23.042
 1009    HD2  HIS 132           HD2      HIS 132   4.883  12.964  25.338
 1010    HE1  HIS 132           HE1      HIS 132   5.929  14.439  21.503
 1011    HE2  HIS 132           HE2      HIS 132   4.162  13.273  22.868
  Start of MODEL   17
    1   1H    MET   1          1HT       MET   1  -2.911  16.024 -32.054
    2   2H    MET   1          2HT       MET   1  -1.234  16.088 -32.315
    3   3H    MET   1          3HT       MET   1  -1.942  17.019 -31.088
    4    HA   MET   1           HA       MET   1  -2.576  15.049 -29.886
    5   1HB   MET   1          1HB       MET   1  -1.009  13.558 -32.006
    6   2HB   MET   1          2HB       MET   1  -1.781  12.857 -30.592
    7   1HG   MET   1          1HG       MET   1  -3.192  12.351 -32.380
    8   2HG   MET   1          2HG       MET   1  -3.970  13.698 -31.552
    9   1HE   MET   1          1HE       MET   1  -4.738  12.771 -34.500
   10   2HE   MET   1          2HE       MET   1  -4.886  14.332 -35.305
   11   3HE   MET   1          3HE       MET   1  -5.510  14.121 -33.669
   12    HA   PRO   2           HA       PRO   2   1.353  16.177 -28.091
   13   1HB   PRO   2          1HB       PRO   2   0.461  14.423 -25.888
   14   2HB   PRO   2          2HB       PRO   2   0.903  16.133 -25.854
   15   1HG   PRO   2          1HG       PRO   2  -1.646  15.343 -25.606
   16   2HG   PRO   2          2HG       PRO   2  -1.212  16.829 -26.475
   17   1HD   PRO   2          1HD       PRO   2  -1.962  14.144 -27.570
   18   2HD   PRO   2          2HD       PRO   2  -2.416  15.762 -28.143
   19    H    LEU   3           H        LEU   3   0.359  12.898 -27.097
   20    HA   LEU   3           HA       LEU   3   1.514  10.948 -26.953
   21   1HB   LEU   3          1HB       LEU   3   1.292  11.457 -29.541
   22   2HB   LEU   3          2HB       LEU   3   3.029  11.653 -29.439
   23    HG   LEU   3           HG       LEU   3   2.321   9.401 -30.204
   24   1HD1  LEU   3          1HD1      LEU   3   4.494   9.675 -29.151
   25   2HD1  LEU   3          2HD1      LEU   3   3.769   9.421 -27.563
   26   3HD1  LEU   3          3HD1      LEU   3   3.788   8.111 -28.745
   27   1HD2  LEU   3          1HD2      LEU   3   1.217   9.150 -27.414
   28   2HD2  LEU   3          2HD2      LEU   3   0.282   9.193 -28.909
   29   3HD2  LEU   3          3HD2      LEU   3   1.365   7.840 -28.585
   30    H    ASN   4           H        ASN   4   2.554  12.084 -25.111
   31    HA   ASN   4           HA       ASN   4   5.354  12.774 -25.652
   32   1HB   ASN   4          1HB       ASN   4   3.431  13.742 -23.557
   33   2HB   ASN   4          2HB       ASN   4   5.169  13.889 -23.323
   34   1HD2  ASN   4          2HD2      ASN   4   5.105  16.119 -23.347
   35   2HD2  ASN   4          1HD2      ASN   4   4.834  17.025 -24.795
   36    H    GLN   5           H        GLN   5   6.091  10.638 -25.581
   37    HA   GLN   5           HA       GLN   5   6.207   9.428 -22.917
   38   1HB   GLN   5          1HB       GLN   5   7.359   8.540 -25.573
   39   2HB   GLN   5          2HB       GLN   5   7.585   7.675 -24.060
   40   1HG   GLN   5          1HG       GLN   5   5.122   7.419 -23.908
   41   2HG   GLN   5          2HG       GLN   5   4.993   8.149 -25.508
   42   1HE2  GLN   5          2HE2      GLN   5   6.031   5.378 -23.699
   43   2HE2  GLN   5          1HE2      GLN   5   6.203   4.298 -25.043
   44    H    GLU   6           H        GLU   6   7.754  11.581 -24.965
   45    HA   GLU   6           HA       GLU   6  10.401  11.615 -24.213
   46   1HB   GLU   6          1HB       GLU   6   9.374  13.104 -25.891
   47   2HB   GLU   6          2HB       GLU   6   8.540  13.969 -24.610
   48   1HG   GLU   6          1HG       GLU   6  10.593  14.811 -23.745
   49   2HG   GLU   6          2HG       GLU   6  11.529  13.786 -24.833
   50    H    HIS   7           H        HIS   7  11.539  12.594 -22.498
   51    HA   HIS   7           HA       HIS   7  10.249  12.039 -20.017
   52   1HB   HIS   7          1HB       HIS   7  12.993  13.167 -20.586
   53   2HB   HIS   7          2HB       HIS   7  12.432  12.629 -19.006
   54    HD1  HIS   7           HD1      HIS   7  12.363  10.115 -18.562
   55    HD2  HIS   7           HD2      HIS   7  13.476  11.091 -22.450
   56    HE1  HIS   7           HE1      HIS   7  13.197   7.976 -19.591
   57    HE2  HIS   7           HE2      HIS   7  13.635   8.551 -22.007
   58    HA   PRO   8           HA       PRO   8   9.074  16.301 -19.330
   59   1HB   PRO   8          1HB       PRO   8   6.877  15.739 -17.909
   60   2HB   PRO   8          2HB       PRO   8   6.931  15.473 -19.653
   61   1HG   PRO   8          1HG       PRO   8   6.974  13.507 -17.450
   62   2HG   PRO   8          2HG       PRO   8   6.448  13.306 -19.128
   63   1HD   PRO   8          1HD       PRO   8   8.975  12.589 -17.956
   64   2HD   PRO   8          2HD       PRO   8   8.442  12.368 -19.634
   65    H    ASP   9           H        ASP   9   7.667  16.698 -16.848
   66    HA   ASP   9           HA       ASP   9   9.891  17.054 -15.087
   67   1HB   ASP   9          1HB       ASP   9   8.127  18.725 -15.154
   68   2HB   ASP   9          2HB       ASP   9   6.927  17.522 -14.691
   69    H    TYR  10           H        TYR  10  10.305  16.061 -13.142
   70    HA   TYR  10           HA       TYR  10   9.084  13.438 -12.766
   71   1HB   TYR  10          1HB       TYR  10  11.468  14.712 -11.394
   72   2HB   TYR  10          2HB       TYR  10  10.924  13.055 -11.160
   73    HD1  TYR  10           HD1      TYR  10  11.539  11.341 -12.682
   74    HD2  TYR  10           HD2      TYR  10  12.369  15.405 -13.632
   75    HE1  TYR  10           HE1      TYR  10  12.938  10.611 -14.569
   76    HE2  TYR  10           HE2      TYR  10  13.770  14.685 -15.519
   77    HH   TYR  10           HH       TYR  10  13.895  11.343 -16.540
   78    H    THR  11           H        THR  11   7.082  14.550 -12.173
   79    HA   THR  11           HA       THR  11   6.896  16.275  -9.949
   80    HB   THR  11           HB       THR  11   4.673  14.588 -11.107
   81    HG1  THR  11           HG1      THR  11   6.092  16.785 -12.132
   82   1HG2  THR  11          1HG2      THR  11   4.105  15.791  -9.051
   83   2HG2  THR  11          2HG2      THR  11   4.676  17.298  -9.767
   84   3HG2  THR  11          3HG2      THR  11   3.264  16.483 -10.438
   85    H    TYR  12           H        TYR  12   6.149  12.808 -10.309
   86    HA   TYR  12           HA       TYR  12   5.330  12.596  -7.560
   87   1HB   TYR  12          1HB       TYR  12   5.771  10.461  -9.657
   88   2HB   TYR  12          2HB       TYR  12   5.089  10.176  -8.059
   89    HD1  TYR  12           HD1      TYR  12   4.443  11.337 -11.429
   90    HD2  TYR  12           HD2      TYR  12   2.866  11.146  -7.481
   91    HE1  TYR  12           HE1      TYR  12   2.200  11.831 -12.307
   92    HE2  TYR  12           HE2      TYR  12   0.619  11.637  -8.349
   93    HH   TYR  12           HH       TYR  12  -0.136  11.528 -11.673
   94    H    ALA  13           H        ALA  13   7.047  13.084  -6.263
   95    HA   ALA  13           HA       ALA  13   9.091  11.008  -6.084
   96   1HB   ALA  13          1HB       ALA  13   9.752  13.954  -6.117
   97   2HB   ALA  13          2HB       ALA  13  10.888  12.637  -5.824
   98   3HB   ALA  13          3HB       ALA  13  10.117  12.803  -7.402
   99    H    LEU  14           H        LEU  14   9.919  10.719  -4.011
  100    HA   LEU  14           HA       LEU  14   8.400  12.067  -1.891
  101   1HB   LEU  14          1HB       LEU  14   9.756   9.379  -1.990
  102   2HB   LEU  14          2HB       LEU  14   9.283  10.118  -0.476
  103    HG   LEU  14           HG       LEU  14   7.605   8.538  -1.063
  104   1HD1  LEU  14          1HD1      LEU  14   6.621  11.311  -1.702
  105   2HD1  LEU  14          2HD1      LEU  14   5.612   9.939  -1.243
  106   3HD1  LEU  14          3HD1      LEU  14   6.777  10.600  -0.096
  107   1HD2  LEU  14          1HD2      LEU  14   8.077   8.311  -3.435
  108   2HD2  LEU  14          2HD2      LEU  14   6.361   8.618  -3.169
  109   3HD2  LEU  14          3HD2      LEU  14   7.412   9.916  -3.738
  110    H    ARG  15           H        ARG  15   9.644  13.883  -1.588
  111    HA   ARG  15           HA       ARG  15  12.472  13.491  -0.976
  112   1HB   ARG  15          1HB       ARG  15  12.312  16.118  -0.785
  113   2HB   ARG  15          2HB       ARG  15  12.436  15.316  -2.340
  114   1HG   ARG  15          1HG       ARG  15  10.786  16.916  -2.649
  115   2HG   ARG  15          2HG       ARG  15   9.888  15.422  -2.401
  116   1HD   ARG  15          1HD       ARG  15   9.466  16.042  -0.085
  117   2HD   ARG  15          2HD       ARG  15  10.414  17.517  -0.295
  118    HE   ARG  15           HE       ARG  15   8.155  17.131  -2.089
  119   1HH1  ARG  15          1HH1      ARG  15   9.392  18.722   0.788
  120   2HH1  ARG  15          2HH1      ARG  15   8.191  19.976   0.745
  121   1HH2  ARG  15          1HH2      ARG  15   6.618  18.769  -2.150
  122   2HH2  ARG  15          2HH2      ARG  15   6.594  19.999  -0.917
  123    H    ALA  16           H        ALA  16   9.832  13.091   0.681
  124    HA   ALA  16           HA       ALA  16  11.197  13.320   3.175
  125   1HB   ALA  16          1HB       ALA  16   9.586  14.765   4.308
  126   2HB   ALA  16          2HB       ALA  16  10.382  15.625   2.989
  127   3HB   ALA  16          3HB       ALA  16   8.736  15.026   2.785
  128    H    ALA  17           H        ALA  17  10.817  11.248   3.693
  129    HA   ALA  17           HA       ALA  17   8.010  10.355   3.724
  130   1HB   ALA  17          1HB       ALA  17   8.726   8.125   3.059
  131   2HB   ALA  17          2HB       ALA  17   9.186   9.318   1.844
  132   3HB   ALA  17          3HB       ALA  17  10.397   8.679   2.956
  133    H    ASP  18           H        ASP  18   7.495  10.306   5.789
  134    HA   ASP  18           HA       ASP  18   9.227   8.781   7.628
  135   1HB   ASP  18          1HB       ASP  18   7.482  11.181   8.246
  136   2HB   ASP  18          2HB       ASP  18   8.199  10.150   9.476
  137    H    GLY  19           H        GLY  19   7.909   7.836   9.468
  138   1HA   GLY  19          1HA       GLY  19   5.482   6.646   8.488
  139   2HA   GLY  19          2HA       GLY  19   6.154   6.473  10.106
  140    H    ARG  20           H        ARG  20   6.218   9.607   9.883
  141    HA   ARG  20           HA       ARG  20   3.467   9.953  10.876
  142   1HB   ARG  20          1HB       ARG  20   6.030  11.302  11.726
  143   2HB   ARG  20          2HB       ARG  20   4.433  11.809  12.262
  144   1HG   ARG  20          1HG       ARG  20   4.091   9.841  13.480
  145   2HG   ARG  20          2HG       ARG  20   5.408   9.003  12.658
  146   1HD   ARG  20          1HD       ARG  20   5.751  11.365  14.500
  147   2HD   ARG  20          2HD       ARG  20   5.968   9.680  14.974
  148    HE   ARG  20           HE       ARG  20   7.623  11.049  12.939
  149   1HH1  ARG  20          1HH1      ARG  20   7.233   8.772  15.581
  150   2HH1  ARG  20          2HH1      ARG  20   8.903   8.278  15.570
  151   1HH2  ARG  20          1HH2      ARG  20   9.820  10.392  12.915
  152   2HH2  ARG  20          2HH2      ARG  20  10.370   9.199  14.050
  153    H    HIS  21           H        HIS  21   5.683  10.895   8.486
  154    HA   HIS  21           HA       HIS  21   3.876  13.018   7.602
  155   1HB   HIS  21          1HB       HIS  21   6.873  13.363   7.808
  156   2HB   HIS  21          2HB       HIS  21   5.787  14.481   7.001
  157    HD1  HIS  21           HD1      HIS  21   7.552  14.209  10.026
  158    HD2  HIS  21           HD2      HIS  21   3.667  15.338   9.053
  159    HE1  HIS  21           HE1      HIS  21   6.718  15.547  11.988
  160    HE2  HIS  21           HE2      HIS  21   4.310  16.070  11.450
  161    H    ALA  22           H        ALA  22   3.672  13.127   5.407
  162    HA   ALA  22           HA       ALA  22   5.541  11.636   3.732
  163   1HB   ALA  22          1HB       ALA  22   3.770  10.033   4.271
  164   2HB   ALA  22          2HB       ALA  22   2.560  11.164   3.664
  165   3HB   ALA  22          3HB       ALA  22   3.747  10.466   2.561
  166    H    LYS  23           H        LYS  23   6.171  13.017   2.222
  167    HA   LYS  23           HA       LYS  23   4.222  15.019   1.291
  168   1HB   LYS  23          1HB       LYS  23   7.238  15.208   1.296
  169   2HB   LYS  23          2HB       LYS  23   6.130  16.455   0.740
  170   1HG   LYS  23          1HG       LYS  23   5.206  16.609   3.017
  171   2HG   LYS  23          2HG       LYS  23   6.391  15.417   3.553
  172   1HD   LYS  23          1HD       LYS  23   8.178  16.972   2.711
  173   2HD   LYS  23          2HD       LYS  23   6.913  18.180   2.476
  174   1HE   LYS  23          1HE       LYS  23   6.352  18.057   4.850
  175   2HE   LYS  23          2HE       LYS  23   7.603  16.839   5.087
  176   1HZ   LYS  23          1HZ       LYS  23   9.182  18.583   4.179
  177   2HZ   LYS  23          2HZ       LYS  23   7.935  19.701   4.427
  178   3HZ   LYS  23          3HZ       LYS  23   8.575  18.838   5.743
  179    H    VAL  24           H        VAL  24   3.343  13.880  -0.373
  180    HA   VAL  24           HA       VAL  24   5.065  12.793  -2.453
  181    HB   VAL  24           HB       VAL  24   2.043  12.975  -2.413
  182   1HG1  VAL  24          1HG1      VAL  24   3.916  11.302  -4.086
  183   2HG1  VAL  24          2HG1      VAL  24   2.155  11.203  -4.109
  184   3HG1  VAL  24          3HG1      VAL  24   2.963  12.677  -4.643
  185   1HG2  VAL  24          1HG2      VAL  24   2.816  11.663  -0.516
  186   2HG2  VAL  24          2HG2      VAL  24   2.068  10.619  -1.725
  187   3HG2  VAL  24          3HG2      VAL  24   3.825  10.686  -1.584
  188    H    ASN  25           H        ASN  25   5.946  14.232  -3.768
  189    HA   ASN  25           HA       ASN  25   6.232  15.960  -5.216
  190   1HB   ASN  25          1HB       ASN  25   4.138  15.285  -6.305
  191   2HB   ASN  25          2HB       ASN  25   3.214  16.205  -5.131
  192   1HD2  ASN  25          2HD2      ASN  25   2.272  17.513  -6.668
  193   2HD2  ASN  25          1HD2      ASN  25   3.149  18.736  -7.521
  194    H    GLU  26           H        GLU  26   3.418  17.098  -3.387
  195    HA   GLU  26           HA       GLU  26   5.099  19.006  -1.963
  196   1HB   GLU  26          1HB       GLU  26   4.477  20.240  -3.958
  197   2HB   GLU  26          2HB       GLU  26   2.782  19.840  -3.716
  198   1HG   GLU  26          1HG       GLU  26   3.168  22.106  -3.042
  199   2HG   GLU  26          2HG       GLU  26   2.800  21.134  -1.621
  200    H    GLN  27           H        GLN  27   1.911  17.567  -2.438
  201    HA   GLN  27           HA       GLN  27   0.751  18.757  -0.135
  202   1HB   GLN  27          1HB       GLN  27  -0.559  17.911  -2.079
  203   2HB   GLN  27          2HB       GLN  27  -0.149  16.269  -1.600
  204   1HG   GLN  27          1HG       GLN  27  -1.302  16.602   0.529
  205   2HG   GLN  27          2HG       GLN  27  -1.715  18.245   0.046
  206   1HE2  GLN  27          2HE2      GLN  27  -1.727  15.532  -2.156
  207   2HE2  GLN  27          1HE2      GLN  27  -3.444  15.469  -2.382
  208    H    ILE  28           H        ILE  28   1.281  18.330   1.877
  209    HA   ILE  28           HA       ILE  28   2.579  15.881   2.654
  210    HB   ILE  28           HB       ILE  28   1.444  18.045   4.438
  211   1HG1  ILE  28          1HG1      ILE  28   4.269  17.757   3.392
  212   2HG1  ILE  28          2HG1      ILE  28   3.093  18.917   2.782
  213   1HG2  ILE  28          1HG2      ILE  28   3.059  17.192   6.079
  214   2HG2  ILE  28          2HG2      ILE  28   1.898  15.954   5.598
  215   3HG2  ILE  28          3HG2      ILE  28   3.535  15.929   4.943
  216   1HD1  ILE  28          1HD1      ILE  28   3.015  19.993   4.967
  217   2HD1  ILE  28          2HD1      ILE  28   4.179  18.823   5.588
  218   3HD1  ILE  28          3HD1      ILE  28   4.658  19.956   4.325
  219    H    LEU  29           H        LEU  29   1.331  14.115   2.565
  220    HA   LEU  29           HA       LEU  29  -1.480  14.287   3.265
  221   1HB   LEU  29          1HB       LEU  29   0.205  12.072   2.113
  222   2HB   LEU  29          2HB       LEU  29  -1.487  11.873   2.529
  223    HG   LEU  29           HG       LEU  29  -0.473  13.903   0.537
  224   1HD1  LEU  29          1HD1      LEU  29  -1.713  11.196   0.058
  225   2HD1  LEU  29          2HD1      LEU  29  -1.353  12.400  -1.180
  226   3HD1  LEU  29          3HD1      LEU  29  -0.040  11.646  -0.273
  227   1HD2  LEU  29          1HD2      LEU  29  -2.826  14.053  -0.103
  228   2HD2  LEU  29          2HD2      LEU  29  -3.248  12.902   1.165
  229   3HD2  LEU  29          3HD2      LEU  29  -2.596  14.483   1.592
  230    H    GLN  30           H        GLN  30  -1.597  14.495   5.437
  231    HA   GLN  30           HA       GLN  30  -0.338  12.529   7.173
  232   1HB   GLN  30          1HB       GLN  30  -1.511  13.831   8.982
  233   2HB   GLN  30          2HB       GLN  30  -0.371  14.766   8.026
  234   1HG   GLN  30          1HG       GLN  30  -2.153  15.782   6.786
  235   2HG   GLN  30          2HG       GLN  30  -3.344  14.737   7.559
  236   1HE2  GLN  30          2HE2      GLN  30  -3.950  15.140   9.674
  237   2HE2  GLN  30          1HE2      GLN  30  -3.608  16.639  10.468
  238    H    GLN  31           H        GLN  31  -2.066  11.453   5.303
  239    HA   GLN  31           HA       GLN  31  -4.286  10.465   6.953
  240   1HB   GLN  31          1HB       GLN  31  -4.491  11.174   4.013
  241   2HB   GLN  31          2HB       GLN  31  -5.780  10.534   5.022
  242   1HG   GLN  31          1HG       GLN  31  -5.791  12.564   6.343
  243   2HG   GLN  31          2HG       GLN  31  -4.444  13.203   5.403
  244   1HE2  GLN  31          2HE2      GLN  31  -5.579  14.985   4.705
  245   2HE2  GLN  31          1HE2      GLN  31  -6.871  14.887   3.561
  246    H    SER  32           H        SER  32  -5.298   8.719   4.986
  247    HA   SER  32           HA       SER  32  -2.987   6.988   4.427
  248   1HB   SER  32          1HB       SER  32  -4.650   6.085   6.089
  249   2HB   SER  32          2HB       SER  32  -5.856   6.103   4.804
  250    HG   SER  32           HG       SER  32  -4.353   4.137   5.318
  251    H    PHE  33           H        PHE  33  -2.689   6.345   2.350
  252    HA   PHE  33           HA       PHE  33  -4.783   6.820   0.387
  253   1HB   PHE  33          1HB       PHE  33  -3.330   8.207  -1.040
  254   2HB   PHE  33          2HB       PHE  33  -3.663   8.986   0.501
  255    HD1  PHE  33           HD1      PHE  33  -1.895   9.048   2.254
  256    HD2  PHE  33           HD2      PHE  33  -1.126   7.669  -1.700
  257    HE1  PHE  33           HE1      PHE  33   0.518   9.346   2.623
  258    HE2  PHE  33           HE2      PHE  33   1.289   7.964  -1.336
  259    HZ   PHE  33           HZ       PHE  33   2.114   8.803   0.827
  260    H    ILE  34           H        ILE  34  -4.144   6.056  -1.791
  261    HA   ILE  34           HA       ILE  34  -2.296   3.765  -1.573
  262    HB   ILE  34           HB       ILE  34  -4.597   4.020  -3.514
  263   1HG1  ILE  34          1HG1      ILE  34  -4.518   2.396  -0.963
  264   2HG1  ILE  34          2HG1      ILE  34  -5.351   3.940  -1.119
  265   1HG2  ILE  34          1HG2      ILE  34  -4.255   1.612  -3.819
  266   2HG2  ILE  34          2HG2      ILE  34  -2.811   2.536  -4.234
  267   3HG2  ILE  34          3HG2      ILE  34  -2.892   1.670  -2.700
  268   1HD1  ILE  34          1HD1      ILE  34  -5.964   1.439  -2.674
  269   2HD1  ILE  34          2HD1      ILE  34  -6.892   2.079  -1.317
  270   3HD1  ILE  34          3HD1      ILE  34  -6.802   2.983  -2.829
  271    H    LEU  35           H        LEU  35  -0.440   4.246  -2.542
  272    HA   LEU  35           HA       LEU  35  -0.485   5.957  -4.935
  273   1HB   LEU  35          1HB       LEU  35   0.879   6.793  -3.104
  274   2HB   LEU  35          2HB       LEU  35   1.748   5.275  -3.020
  275    HG   LEU  35           HG       LEU  35   2.701   5.703  -5.254
  276   1HD1  LEU  35          1HD1      LEU  35   1.314   8.370  -5.029
  277   2HD1  LEU  35          2HD1      LEU  35   2.460   7.896  -6.283
  278   3HD1  LEU  35          3HD1      LEU  35   0.901   7.081  -6.160
  279   1HD2  LEU  35          1HD2      LEU  35   4.206   7.510  -4.582
  280   2HD2  LEU  35          2HD2      LEU  35   3.107   7.937  -3.269
  281   3HD2  LEU  35          3HD2      LEU  35   3.928   6.377  -3.260
  282    H    MET  36           H        MET  36  -0.203   5.017  -6.840
  283    HA   MET  36           HA       MET  36   1.337   2.506  -6.951
  284   1HB   MET  36          1HB       MET  36  -1.118   3.222  -8.574
  285   2HB   MET  36          2HB       MET  36  -0.152   1.768  -8.782
  286   1HG   MET  36          1HG       MET  36  -0.736   1.074  -6.502
  287   2HG   MET  36          2HG       MET  36  -1.738   2.514  -6.334
  288   1HE   MET  36          1HE       MET  36  -1.277  -0.941  -8.115
  289   2HE   MET  36          2HE       MET  36  -1.260   0.176  -9.479
  290   3HE   MET  36          3HE       MET  36  -2.610  -0.939  -9.270
  291    HA   PRO  37           HA       PRO  37   3.692   4.516 -10.175
  292   1HB   PRO  37          1HB       PRO  37   3.999   1.945 -11.539
  293   2HB   PRO  37          2HB       PRO  37   5.216   2.915 -10.706
  294   1HG   PRO  37          1HG       PRO  37   4.343   0.563  -9.726
  295   2HG   PRO  37          2HG       PRO  37   4.821   1.909  -8.674
  296   1HD   PRO  37          1HD       PRO  37   2.071   1.030  -9.491
  297   2HD   PRO  37          2HD       PRO  37   2.665   1.518  -7.889
  298    H    ASP  38           H        ASP  38   0.805   4.338 -10.523
  299    HA   ASP  38           HA       ASP  38   0.662   4.469 -13.431
  300   1HB   ASP  38          1HB       ASP  38  -0.035   2.180 -12.881
  301   2HB   ASP  38          2HB       ASP  38  -1.209   2.802 -11.727
  302    H    GLU  39           H        GLU  39  -1.615   4.506 -10.686
  303    HA   GLU  39           HA       GLU  39  -1.969   7.379 -11.107
  304   1HB   GLU  39          1HB       GLU  39  -4.194   5.355 -10.833
  305   2HB   GLU  39          2HB       GLU  39  -4.427   7.083 -10.618
  306   1HG   GLU  39          1HG       GLU  39  -3.544   7.395 -12.941
  307   2HG   GLU  39          2HG       GLU  39  -3.595   5.642 -13.120
  308    H    LEU  40           H        LEU  40  -3.629   8.047  -9.147
  309    HA   LEU  40           HA       LEU  40  -2.461   6.940  -6.694
  310   1HB   LEU  40          1HB       LEU  40  -1.162   8.895  -7.148
  311   2HB   LEU  40          2HB       LEU  40  -2.590   9.833  -7.529
  312    HG   LEU  40           HG       LEU  40  -3.280   9.683  -5.141
  313   1HD1  LEU  40          1HD1      LEU  40  -2.109   7.641  -4.533
  314   2HD1  LEU  40          2HD1      LEU  40  -0.558   8.444  -4.774
  315   3HD1  LEU  40          3HD1      LEU  40  -1.633   8.975  -3.482
  316   1HD2  LEU  40          1HD2      LEU  40  -1.622  11.281  -4.315
  317   2HD2  LEU  40          2HD2      LEU  40  -0.551  10.858  -5.651
  318   3HD2  LEU  40          3HD2      LEU  40  -2.099  11.638  -5.975
  319    H    VAL  41           H        VAL  41  -3.985   6.397  -5.289
  320    HA   VAL  41           HA       VAL  41  -6.627   7.653  -5.463
  321    HB   VAL  41           HB       VAL  41  -5.752   5.385  -3.660
  322   1HG1  VAL  41          1HG1      VAL  41  -7.706   6.582  -2.847
  323   2HG1  VAL  41          2HG1      VAL  41  -8.495   6.385  -4.412
  324   3HG1  VAL  41          3HG1      VAL  41  -8.155   4.973  -3.412
  325   1HG2  VAL  41          1HG2      VAL  41  -7.180   5.259  -6.315
  326   2HG2  VAL  41          2HG2      VAL  41  -5.533   4.718  -5.993
  327   3HG2  VAL  41          3HG2      VAL  41  -6.894   3.892  -5.236
  328    H    GLU  42           H        GLU  42  -6.599   9.569  -4.485
  329    HA   GLU  42           HA       GLU  42  -4.804  10.100  -2.285
  330   1HB   GLU  42          1HB       GLU  42  -5.172  11.728  -4.122
  331   2HB   GLU  42          2HB       GLU  42  -6.846  11.896  -3.612
  332   1HG   GLU  42          1HG       GLU  42  -6.035  12.722  -1.418
  333   2HG   GLU  42          2HG       GLU  42  -4.392  12.672  -2.055
  334    H    HIS  43           H        HIS  43  -8.206   9.509  -2.781
  335    HA   HIS  43           HA       HIS  43  -8.701  10.104   0.058
  336   1HB   HIS  43          1HB       HIS  43 -10.064  11.457  -1.437
  337   2HB   HIS  43          2HB       HIS  43 -10.645  10.013  -2.258
  338    HD1  HIS  43           HD1      HIS  43 -10.623  11.237   1.367
  339    HD2  HIS  43           HD2      HIS  43 -13.112   9.376  -1.401
  340    HE1  HIS  43           HE1      HIS  43 -12.810  10.866   2.555
  341    HE2  HIS  43           HE2      HIS  43 -14.361   9.971   0.780
  342    H    TRP  44           H        TRP  44  -8.354   8.272   1.134
  343    HA   TRP  44           HA       TRP  44 -10.154   6.040   0.523
  344   1HB   TRP  44          1HB       TRP  44  -7.840   5.498  -0.295
  345   2HB   TRP  44          2HB       TRP  44  -7.266   5.669   1.360
  346    HD1  TRP  44           HD1      TRP  44 -10.339   3.718  -0.019
  347    HE1  TRP  44           HE1      TRP  44 -10.176   1.288   0.825
  348    HE3  TRP  44           HE3      TRP  44  -5.878   4.022   2.464
  349    HZ2  TRP  44           HZ2      TRP  44  -8.383  -0.287   2.332
  350    HZ3  TRP  44           HZ3      TRP  44  -5.008   2.007   3.575
  351    HH2  TRP  44           HH2      TRP  44  -6.237  -0.103   3.511
  352    HA   PRO  45           HA       PRO  45 -10.978   7.399   4.686
  353   1HB   PRO  45          1HB       PRO  45 -13.255   5.580   4.613
  354   2HB   PRO  45          2HB       PRO  45 -13.235   7.343   4.663
  355   1HG   PRO  45          1HG       PRO  45 -14.024   5.960   2.477
  356   2HG   PRO  45          2HG       PRO  45 -13.226   7.539   2.372
  357   1HD   PRO  45          1HD       PRO  45 -12.062   4.801   1.993
  358   2HD   PRO  45          2HD       PRO  45 -11.800   6.278   1.038
  359    H    VAL  46           H        VAL  46  -8.952   5.775   4.976
  360    HA   VAL  46           HA       VAL  46  -9.864   4.111   7.220
  361    HB   VAL  46           HB       VAL  46  -7.664   3.261   5.315
  362   1HG1  VAL  46          1HG1      VAL  46  -7.603   1.200   6.644
  363   2HG1  VAL  46          2HG1      VAL  46  -7.199   2.616   7.616
  364   3HG1  VAL  46          3HG1      VAL  46  -8.797   1.882   7.748
  365   1HG2  VAL  46          1HG2      VAL  46  -9.864   2.932   4.319
  366   2HG2  VAL  46          2HG2      VAL  46  -9.132   1.385   4.742
  367   3HG2  VAL  46          3HG2      VAL  46 -10.400   2.067   5.760
  368    HA   PRO  47           HA       PRO  47  -6.861   7.338   8.479
  369   1HB   PRO  47          1HB       PRO  47  -8.219   7.092  11.071
  370   2HB   PRO  47          2HB       PRO  47  -8.018   8.511  10.042
  371   1HG   PRO  47          1HG       PRO  47 -10.404   7.306  10.356
  372   2HG   PRO  47          2HG       PRO  47  -9.926   8.064   8.825
  373   1HD   PRO  47          1HD       PRO  47  -9.924   5.167   9.590
  374   2HD   PRO  47          2HD       PRO  47 -10.426   5.929   8.064
  375    H    SER  48           H        SER  48  -7.769   4.427  10.264
  376    HA   SER  48           HA       SER  48  -5.008   3.933  10.943
  377   1HB   SER  48          1HB       SER  48  -5.866   5.468  12.753
  378   2HB   SER  48          2HB       SER  48  -7.045   4.226  13.169
  379    HG   SER  48           HG       SER  48  -4.362   4.372  13.727
  380    H    LEU  49           H        LEU  49  -5.156   1.894  12.622
  381    HA   LEU  49           HA       LEU  49  -6.384  -0.174  11.074
  382   1HB   LEU  49          1HB       LEU  49  -5.054  -0.304  13.781
  383   2HB   LEU  49          2HB       LEU  49  -5.529  -1.692  12.824
  384    HG   LEU  49           HG       LEU  49  -3.376   0.316  12.172
  385   1HD1  LEU  49          1HD1      LEU  49  -2.761  -1.372  13.812
  386   2HD1  LEU  49          2HD1      LEU  49  -3.303  -2.646  12.720
  387   3HD1  LEU  49          3HD1      LEU  49  -1.920  -1.643  12.285
  388   1HD2  LEU  49          1HD2      LEU  49  -2.965  -1.007  10.153
  389   2HD2  LEU  49          2HD2      LEU  49  -4.394  -1.980  10.501
  390   3HD2  LEU  49          3HD2      LEU  49  -4.565  -0.265  10.128
  391    H    GLY  50           H        GLY  50  -7.697  -1.902  12.252
  392   1HA   GLY  50          1HA       GLY  50  -9.351  -2.289  14.010
  393   2HA   GLY  50          2HA       GLY  50  -9.729  -0.573  13.930
  394    H    GLN  51           H        GLN  51 -10.197   0.065  11.468
  395    HA   GLN  51           HA       GLN  51 -12.413  -1.662  10.669
  396   1HB   GLN  51          1HB       GLN  51 -12.670   0.852  10.946
  397   2HB   GLN  51          2HB       GLN  51 -11.676   1.028   9.506
  398   1HG   GLN  51          1HG       GLN  51 -13.347  -0.352   8.273
  399   2HG   GLN  51          2HG       GLN  51 -14.367  -0.301   9.709
  400   1HE2  GLN  51          2HE2      GLN  51 -15.353   1.636  10.292
  401   2HE2  GLN  51          1HE2      GLN  51 -15.486   2.967   9.189
  402    H    LEU  52           H        LEU  52  -9.263  -1.655  10.100
  403    HA   LEU  52           HA       LEU  52  -9.186  -1.781   7.243
  404   1HB   LEU  52          1HB       LEU  52  -7.207  -1.149   8.585
  405   2HB   LEU  52          2HB       LEU  52  -7.151  -2.775   9.242
  406    HG   LEU  52           HG       LEU  52  -6.755  -3.660   6.965
  407   1HD1  LEU  52          1HD1      LEU  52  -7.837  -1.901   5.682
  408   2HD1  LEU  52          2HD1      LEU  52  -6.603  -0.749   6.196
  409   3HD1  LEU  52          3HD1      LEU  52  -6.163  -2.111   5.166
  410   1HD2  LEU  52          1HD2      LEU  52  -4.873  -3.199   8.438
  411   2HD2  LEU  52          2HD2      LEU  52  -4.451  -2.870   6.758
  412   3HD2  LEU  52          3HD2      LEU  52  -4.810  -1.536   7.855
  413    H    GLN  53           H        GLN  53 -10.847  -3.230   6.833
  414    HA   GLN  53           HA       GLN  53  -9.974  -6.032   6.947
  415   1HB   GLN  53          1HB       GLN  53 -12.770  -4.970   7.431
  416   2HB   GLN  53          2HB       GLN  53 -12.409  -6.663   7.135
  417   1HG   GLN  53          1HG       GLN  53 -11.010  -6.706   9.147
  418   2HG   GLN  53          2HG       GLN  53 -11.419  -5.018   9.452
  419   1HE2  GLN  53          2HE2      GLN  53 -11.903  -7.391  11.079
  420   2HE2  GLN  53          1HE2      GLN  53 -13.613  -7.444  11.337
  421    HA   PRO  54           HA       PRO  54 -10.770  -6.318   2.567
  422   1HB   PRO  54          1HB       PRO  54 -12.878  -8.194   2.524
  423   2HB   PRO  54          2HB       PRO  54 -11.155  -8.535   2.365
  424   1HG   PRO  54          1HG       PRO  54 -12.914  -8.733   4.748
  425   2HG   PRO  54          2HG       PRO  54 -11.498  -9.702   4.309
  426   1HD   PRO  54          1HD       PRO  54 -11.385  -7.849   6.239
  427   2HD   PRO  54          2HD       PRO  54 -10.012  -8.133   5.150
  428    H    ALA  55           H        ALA  55 -13.411  -5.710   4.740
  429    HA   ALA  55           HA       ALA  55 -15.436  -4.998   2.957
  430   1HB   ALA  55          1HB       ALA  55 -15.773  -5.284   5.359
  431   2HB   ALA  55          2HB       ALA  55 -14.839  -3.820   5.665
  432   3HB   ALA  55          3HB       ALA  55 -16.375  -3.722   4.804
  433    H    HIS  56           H        HIS  56 -12.709  -3.115   4.200
  434    HA   HIS  56           HA       HIS  56 -13.493  -0.902   2.415
  435   1HB   HIS  56          1HB       HIS  56 -12.445  -0.961   5.131
  436   2HB   HIS  56          2HB       HIS  56 -11.471   0.057   4.077
  437    HD1  HIS  56           HD1      HIS  56 -12.179   2.401   4.368
  438    HD2  HIS  56           HD2      HIS  56 -15.426  -0.194   4.469
  439    HE1  HIS  56           HE1      HIS  56 -14.201   3.864   4.632
  440    HE2  HIS  56           HE2      HIS  56 -16.156   2.282   4.744
  441    H    MET  57           H        MET  57 -11.256  -3.381   2.904
  442    HA   MET  57           HA       MET  57  -9.074  -2.142   1.444
  443   1HB   MET  57          1HB       MET  57  -8.746  -3.757   3.351
  444   2HB   MET  57          2HB       MET  57  -9.395  -5.021   2.319
  445   1HG   MET  57          1HG       MET  57  -7.027  -5.185   2.295
  446   2HG   MET  57          2HG       MET  57  -7.545  -4.583   0.721
  447   1HE   MET  57          1HE       MET  57  -4.055  -2.857   1.378
  448   2HE   MET  57          2HE       MET  57  -4.964  -3.923   0.307
  449   3HE   MET  57          3HE       MET  57  -4.541  -4.458   1.933
  450    H    ASP  58           H        ASP  58 -11.955  -3.560   0.686
  451    HA   ASP  58           HA       ASP  58 -11.476  -5.363  -1.361
  452   1HB   ASP  58          1HB       ASP  58 -13.684  -5.040  -0.389
  453   2HB   ASP  58          2HB       ASP  58 -13.763  -3.409  -1.044
  454    H    ALA  59           H        ALA  59 -11.738  -1.840  -1.505
  455    HA   ALA  59           HA       ALA  59 -11.721  -1.505  -4.268
  456   1HB   ALA  59          1HB       ALA  59 -12.175   0.305  -2.681
  457   2HB   ALA  59          2HB       ALA  59 -10.480   0.302  -2.197
  458   3HB   ALA  59          3HB       ALA  59 -10.927   0.756  -3.842
  459    H    VAL  60           H        VAL  60  -9.033  -1.894  -2.012
  460    HA   VAL  60           HA       VAL  60  -6.966  -1.334  -3.864
  461    HB   VAL  60           HB       VAL  60  -6.759  -3.099  -1.420
  462   1HG1  VAL  60          1HG1      VAL  60  -4.711  -1.425  -2.867
  463   2HG1  VAL  60          2HG1      VAL  60  -4.429  -2.336  -1.384
  464   3HG1  VAL  60          3HG1      VAL  60  -4.818  -3.186  -2.879
  465   1HG2  VAL  60          1HG2      VAL  60  -7.809  -0.996  -0.799
  466   2HG2  VAL  60          2HG2      VAL  60  -6.159  -1.068  -0.181
  467   3HG2  VAL  60          3HG2      VAL  60  -6.525  -0.098  -1.607
  468    H    LEU  61           H        LEU  61  -8.527  -4.317  -2.800
  469    HA   LEU  61           HA       LEU  61  -6.858  -6.039  -4.342
  470   1HB   LEU  61          1HB       LEU  61  -9.598  -6.528  -3.173
  471   2HB   LEU  61          2HB       LEU  61  -8.530  -7.765  -3.809
  472    HG   LEU  61           HG       LEU  61  -7.931  -6.023  -1.414
  473   1HD1  LEU  61          1HD1      LEU  61  -8.749  -8.919  -1.576
  474   2HD1  LEU  61          2HD1      LEU  61  -8.271  -8.060  -0.112
  475   3HD1  LEU  61          3HD1      LEU  61  -9.740  -7.591  -0.969
  476   1HD2  LEU  61          1HD2      LEU  61  -6.458  -8.392  -2.562
  477   2HD2  LEU  61          2HD2      LEU  61  -5.919  -6.714  -2.609
  478   3HD2  LEU  61          3HD2      LEU  61  -6.055  -7.554  -1.064
  479    H    ALA  62           H        ALA  62  -9.909  -4.400  -4.886
  480    HA   ALA  62           HA       ALA  62 -10.628  -5.753  -7.271
  481   1HB   ALA  62          1HB       ALA  62 -12.238  -4.496  -5.923
  482   2HB   ALA  62          2HB       ALA  62 -11.421  -2.994  -6.350
  483   3HB   ALA  62          3HB       ALA  62 -12.223  -3.946  -7.598
  484    H    LEU  63           H        LEU  63  -8.423  -3.159  -6.597
  485    HA   LEU  63           HA       LEU  63  -8.186  -2.180  -9.257
  486   1HB   LEU  63          1HB       LEU  63  -6.226  -2.127  -6.961
  487   2HB   LEU  63          2HB       LEU  63  -6.005  -1.262  -8.469
  488    HG   LEU  63           HG       LEU  63  -8.235  -0.788  -6.488
  489   1HD1  LEU  63          1HD1      LEU  63  -7.100   1.334  -6.064
  490   2HD1  LEU  63          2HD1      LEU  63  -6.073  -0.040  -5.655
  491   3HD1  LEU  63          3HD1      LEU  63  -5.795   0.853  -7.149
  492   1HD2  LEU  63          1HD2      LEU  63  -7.517   0.663  -9.033
  493   2HD2  LEU  63          2HD2      LEU  63  -8.939  -0.350  -8.779
  494   3HD2  LEU  63          3HD2      LEU  63  -8.757   1.157  -7.879
  495    H    ASN  64           H        ASN  64  -7.130  -4.995  -7.671
  496    HA   ASN  64           HA       ASN  64  -5.835  -6.760  -8.214
  497   1HB   ASN  64          1HB       ASN  64  -6.621  -5.790 -10.952
  498   2HB   ASN  64          2HB       ASN  64  -5.621  -7.222 -10.731
  499   1HD2  ASN  64          2HD2      ASN  64  -8.756  -5.805 -10.160
  500   2HD2  ASN  64          1HD2      ASN  64  -9.593  -7.291  -9.862
  501    HA   PRO  65           HA       PRO  65  -1.933  -4.452  -8.971
  502   1HB   PRO  65          1HB       PRO  65  -1.177  -4.834  -6.243
  503   2HB   PRO  65          2HB       PRO  65  -1.565  -3.314  -7.049
  504   1HG   PRO  65          1HG       PRO  65  -3.073  -4.483  -5.039
  505   2HG   PRO  65          2HG       PRO  65  -3.664  -3.267  -6.184
  506   1HD   PRO  65          1HD       PRO  65  -4.015  -6.233  -6.213
  507   2HD   PRO  65          2HD       PRO  65  -5.154  -4.955  -6.688
  508    H    ALA  66           H        ALA  66   0.259  -5.353  -8.690
  509    HA   ALA  66           HA       ALA  66   0.209  -8.263  -8.740
  510   1HB   ALA  66          1HB       ALA  66   2.475  -6.339  -9.271
  511   2HB   ALA  66          2HB       ALA  66   2.514  -8.083  -9.536
  512   3HB   ALA  66          3HB       ALA  66   1.434  -7.069 -10.493
  513    H    VAL  67           H        VAL  67   1.395  -5.608  -6.812
  514    HA   VAL  67           HA       VAL  67   1.810  -7.430  -4.586
  515    HB   VAL  67           HB       VAL  67   4.024  -7.390  -5.595
  516   1HG1  VAL  67          1HG1      VAL  67   5.312  -5.317  -5.798
  517   2HG1  VAL  67          2HG1      VAL  67   3.881  -5.313  -6.829
  518   3HG1  VAL  67          3HG1      VAL  67   3.886  -4.393  -5.323
  519   1HG2  VAL  67          1HG2      VAL  67   3.919  -7.476  -3.172
  520   2HG2  VAL  67          2HG2      VAL  67   5.337  -6.567  -3.697
  521   3HG2  VAL  67          3HG2      VAL  67   3.916  -5.713  -3.092
  522    H    ILE  68           H        ILE  68   1.613  -6.404  -2.562
  523    HA   ILE  68           HA       ILE  68   0.770  -3.580  -2.698
  524    HB   ILE  68           HB       ILE  68  -0.429  -5.719  -0.924
  525   1HG1  ILE  68          1HG1      ILE  68  -1.629  -4.271  -3.299
  526   2HG1  ILE  68          2HG1      ILE  68  -1.089  -5.947  -3.300
  527   1HG2  ILE  68          1HG2      ILE  68  -1.156  -2.811  -1.278
  528   2HG2  ILE  68          2HG2      ILE  68  -2.057  -3.982  -0.314
  529   3HG2  ILE  68          3HG2      ILE  68  -0.413  -3.538   0.147
  530   1HD1  ILE  68          1HD1      ILE  68  -2.781  -6.493  -1.631
  531   2HD1  ILE  68          2HD1      ILE  68  -3.322  -4.814  -1.631
  532   3HD1  ILE  68          3HD1      ILE  68  -3.499  -5.798  -3.084
  533    H    LEU  69           H        LEU  69   1.788  -2.253  -1.360
  534    HA   LEU  69           HA       LEU  69   3.406  -3.407   0.811
  535   1HB   LEU  69          1HB       LEU  69   3.693  -0.777  -0.651
  536   2HB   LEU  69          2HB       LEU  69   4.669  -1.259   0.722
  537    HG   LEU  69           HG       LEU  69   4.605  -2.657  -1.953
  538   1HD1  LEU  69          1HD1      LEU  69   6.877  -1.774  -2.201
  539   2HD1  LEU  69          2HD1      LEU  69   5.682  -0.483  -2.080
  540   3HD1  LEU  69          3HD1      LEU  69   6.691  -0.883  -0.690
  541   1HD2  LEU  69          1HD2      LEU  69   5.049  -4.191  -0.103
  542   2HD2  LEU  69          2HD2      LEU  69   6.492  -3.938  -1.084
  543   3HD2  LEU  69          3HD2      LEU  69   6.333  -3.129   0.475
  544    H    LEU  70           H        LEU  70   2.641  -3.108   2.789
  545    HA   LEU  70           HA       LEU  70   0.659  -0.975   3.202
  546   1HB   LEU  70          1HB       LEU  70  -0.095  -3.276   3.674
  547   2HB   LEU  70          2HB       LEU  70   1.197  -3.454   4.844
  548    HG   LEU  70           HG       LEU  70   0.184  -1.665   6.216
  549   1HD1  LEU  70          1HD1      LEU  70  -2.077  -0.894   5.712
  550   2HD1  LEU  70          2HD1      LEU  70  -0.946  -0.436   4.439
  551   3HD1  LEU  70          3HD1      LEU  70  -2.048  -1.789   4.193
  552   1HD2  LEU  70          1HD2      LEU  70  -0.334  -4.004   6.668
  553   2HD2  LEU  70          2HD2      LEU  70  -1.724  -2.971   7.005
  554   3HD2  LEU  70          3HD2      LEU  70  -1.679  -3.935   5.529
  555    H    GLY  71           H        GLY  71   1.419   0.796   4.123
  556   1HA   GLY  71          1HA       GLY  71   3.736   0.569   5.928
  557   2HA   GLY  71          2HA       GLY  71   3.239   2.032   5.085
  558    H    THR  72           H        THR  72   2.968   0.182   7.933
  559    HA   THR  72           HA       THR  72   0.639   1.630   8.889
  560    HB   THR  72           HB       THR  72   1.075   0.267  11.006
  561    HG1  THR  72           HG1      THR  72   3.331  -0.202  10.290
  562   1HG2  THR  72          1HG2      THR  72   0.130  -1.774  10.026
  563   2HG2  THR  72          2HG2      THR  72  -0.643  -0.332   9.371
  564   3HG2  THR  72          3HG2      THR  72   0.558  -1.200   8.415
  565    H    GLY  73           H        GLY  73   1.830   3.698   8.654
  566   1HA   GLY  73          1HA       GLY  73   2.850   5.514   9.610
  567   2HA   GLY  73          2HA       GLY  73   2.687   4.681  11.149
  568    H    GLU  74           H        GLU  74   4.609   4.891  12.086
  569    HA   GLU  74           HA       GLU  74   7.032   4.311  10.526
  570   1HB   GLU  74          1HB       GLU  74   6.756   6.484  11.877
  571   2HB   GLU  74          2HB       GLU  74   6.925   5.479  13.308
  572   1HG   GLU  74          1HG       GLU  74   9.037   6.482  12.781
  573   2HG   GLU  74          2HG       GLU  74   9.132   4.744  12.498
  574    H    ARG  75           H        ARG  75   4.966   2.481  11.784
  575    HA   ARG  75           HA       ARG  75   6.808   0.861  13.420
  576   1HB   ARG  75          1HB       ARG  75   3.805   1.091  13.744
  577   2HB   ARG  75          2HB       ARG  75   4.872   0.082  14.707
  578   1HG   ARG  75          1HG       ARG  75   5.003   3.086  14.599
  579   2HG   ARG  75          2HG       ARG  75   4.162   2.159  15.842
  580   1HD   ARG  75          1HD       ARG  75   7.095   1.874  15.221
  581   2HD   ARG  75          2HD       ARG  75   6.453   2.932  16.477
  582    HE   ARG  75           HE       ARG  75   5.788   0.072  16.567
  583   1HH1  ARG  75          1HH1      ARG  75   7.559   2.804  17.851
  584   2HH1  ARG  75          2HH1      ARG  75   7.900   2.042  19.377
  585   1HH2  ARG  75          1HH2      ARG  75   6.245  -0.957  18.573
  586   2HH2  ARG  75          2HH2      ARG  75   7.159  -0.103  19.785
  587    H    GLN  76           H        GLN  76   6.303  -1.476  13.329
  588    HA   GLN  76           HA       GLN  76   5.013  -2.211  10.796
  589   1HB   GLN  76          1HB       GLN  76   7.349  -3.012  11.169
  590   2HB   GLN  76          2HB       GLN  76   6.776  -3.919  12.562
  591   1HG   GLN  76          1HG       GLN  76   5.317  -5.235  11.114
  592   2HG   GLN  76          2HG       GLN  76   5.882  -4.319   9.716
  593   1HE2  GLN  76          2HE2      GLN  76   6.714  -6.103   8.680
  594   2HE2  GLN  76          1HE2      GLN  76   8.142  -6.922   9.230
  595    H    GLN  77           H        GLN  77   2.891  -2.268  11.296
  596    HA   GLN  77           HA       GLN  77   2.064  -3.733  13.692
  597   1HB   GLN  77          1HB       GLN  77   0.424  -2.016  11.818
  598   2HB   GLN  77          2HB       GLN  77  -0.133  -2.721  13.330
  599   1HG   GLN  77          1HG       GLN  77   1.523  -1.381  14.549
  600   2HG   GLN  77          2HG       GLN  77   2.031  -0.650  13.028
  601   1HE2  GLN  77          2HE2      GLN  77  -0.443  -0.815  15.444
  602   2HE2  GLN  77          1HE2      GLN  77  -1.330   0.572  14.926
  603    H    PHE  78           H        PHE  78   0.946  -5.594  13.607
  604    HA   PHE  78           HA       PHE  78   1.125  -7.051  11.133
  605   1HB   PHE  78          1HB       PHE  78   0.048  -7.890  13.832
  606   2HB   PHE  78          2HB       PHE  78   0.330  -8.968  12.469
  607    HD1  PHE  78           HD1      PHE  78   1.796  -7.271  15.280
  608    HD2  PHE  78           HD2      PHE  78   2.670  -9.299  11.641
  609    HE1  PHE  78           HE1      PHE  78   4.122  -7.585  16.017
  610    HE2  PHE  78           HE2      PHE  78   4.997  -9.620  12.374
  611    HZ   PHE  78           HZ       PHE  78   5.726  -8.761  14.564
  612    HA   PRO  79           HA       PRO  79  -2.930  -5.815   9.809
  613   1HB   PRO  79          1HB       PRO  79  -2.555  -7.875   7.743
  614   2HB   PRO  79          2HB       PRO  79  -2.778  -6.134   7.562
  615   1HG   PRO  79          1HG       PRO  79  -0.412  -7.318   7.087
  616   2HG   PRO  79          2HG       PRO  79  -0.527  -5.687   7.776
  617   1HD   PRO  79          1HD       PRO  79   0.041  -8.288   9.145
  618   2HD   PRO  79          2HD       PRO  79   0.772  -6.691   9.408
  619    H    SER  80           H        SER  80  -5.010  -6.674   9.697
  620    HA   SER  80           HA       SER  80  -5.558  -8.882  11.353
  621   1HB   SER  80          1HB       SER  80  -7.395  -7.527   9.362
  622   2HB   SER  80          2HB       SER  80  -7.885  -8.504  10.746
  623    HG   SER  80           HG       SER  80  -6.297  -6.664  11.724
  624    H    THR  81           H        THR  81  -6.273 -10.942  10.880
  625    HA   THR  81           HA       THR  81  -5.025 -12.239   8.737
  626    HB   THR  81           HB       THR  81  -7.354 -13.308  10.337
  627    HG1  THR  81           HG1      THR  81  -4.573 -13.403  11.003
  628   1HG2  THR  81          1HG2      THR  81  -4.986 -14.678   9.049
  629   2HG2  THR  81          2HG2      THR  81  -6.243 -15.471   9.999
  630   3HG2  THR  81          3HG2      THR  81  -6.647 -14.714   8.457
  631    H    ASP  82           H        ASP  82  -8.267 -10.969   9.113
  632    HA   ASP  82           HA       ASP  82  -9.601 -12.206   7.016
  633   1HB   ASP  82          1HB       ASP  82  -9.891  -9.328   7.912
  634   2HB   ASP  82          2HB       ASP  82 -11.066 -10.230   6.965
  635    H    VAL  83           H        VAL  83  -7.523  -9.355   6.983
  636    HA   VAL  83           HA       VAL  83  -7.939  -8.780   4.211
  637    HB   VAL  83           HB       VAL  83  -5.681  -7.853   6.000
  638   1HG1  VAL  83          1HG1      VAL  83  -5.229  -7.510   3.636
  639   2HG1  VAL  83          2HG1      VAL  83  -6.782  -6.695   3.442
  640   3HG1  VAL  83          3HG1      VAL  83  -5.523  -5.968   4.442
  641   1HG2  VAL  83          1HG2      VAL  83  -7.815  -7.286   7.001
  642   2HG2  VAL  83          2HG2      VAL  83  -7.032  -5.837   6.370
  643   3HG2  VAL  83          3HG2      VAL  83  -8.363  -6.577   5.481
  644    H    LEU  84           H        LEU  84  -5.460 -10.408   6.113
  645    HA   LEU  84           HA       LEU  84  -3.548 -10.778   4.104
  646   1HB   LEU  84          1HB       LEU  84  -4.144 -12.505   6.508
  647   2HB   LEU  84          2HB       LEU  84  -2.683 -12.593   5.541
  648    HG   LEU  84           HG       LEU  84  -3.555 -10.185   7.146
  649   1HD1  LEU  84          1HD1      LEU  84  -1.400 -12.222   7.689
  650   2HD1  LEU  84          2HD1      LEU  84  -1.707 -10.763   8.632
  651   3HD1  LEU  84          3HD1      LEU  84  -2.912 -12.049   8.579
  652   1HD2  LEU  84          1HD2      LEU  84  -1.003 -10.756   5.643
  653   2HD2  LEU  84          2HD2      LEU  84  -2.241  -9.586   5.186
  654   3HD2  LEU  84          3HD2      LEU  84  -1.307  -9.348   6.663
  655    H    ALA  85           H        ALA  85  -6.255 -12.829   5.117
  656    HA   ALA  85           HA       ALA  85  -5.673 -15.040   3.489
  657   1HB   ALA  85          1HB       ALA  85  -8.375 -14.093   4.438
  658   2HB   ALA  85          2HB       ALA  85  -7.983 -15.710   3.855
  659   3HB   ALA  85          3HB       ALA  85  -7.264 -15.115   5.351
  660    H    ALA  86           H        ALA  86  -7.605 -12.145   2.878
  661    HA   ALA  86           HA       ALA  86  -8.640 -12.967   0.378
  662   1HB   ALA  86          1HB       ALA  86  -9.654 -11.189   1.723
  663   2HB   ALA  86          2HB       ALA  86  -8.247 -10.166   1.425
  664   3HB   ALA  86          3HB       ALA  86  -9.290 -10.641   0.086
  665    H    CYS  87           H        CYS  87  -5.636 -11.465   1.322
  666    HA   CYS  87           HA       CYS  87  -4.889 -10.671  -1.328
  667   1HB   CYS  87          1HB       CYS  87  -3.166 -11.069   1.130
  668   2HB   CYS  87          2HB       CYS  87  -2.680 -10.244  -0.348
  669    HG   CYS  87           HG       CYS  87  -5.102  -9.194   1.833
  670    H    LEU  88           H        LEU  88  -4.383 -13.484   0.713
  671    HA   LEU  88           HA       LEU  88  -2.445 -14.719  -0.972
  672   1HB   LEU  88          1HB       LEU  88  -4.239 -15.908   1.144
  673   2HB   LEU  88          2HB       LEU  88  -2.902 -16.744   0.378
  674    HG   LEU  88           HG       LEU  88  -2.677 -14.284   2.114
  675   1HD1  LEU  88          1HD1      LEU  88  -3.241 -16.289   3.378
  676   2HD1  LEU  88          2HD1      LEU  88  -1.897 -17.150   2.627
  677   3HD1  LEU  88          3HD1      LEU  88  -1.581 -15.784   3.698
  678   1HD2  LEU  88          1HD2      LEU  88  -0.974 -14.319   0.371
  679   2HD2  LEU  88          2HD2      LEU  88  -0.264 -14.648   1.951
  680   3HD2  LEU  88          3HD2      LEU  88  -0.539 -15.969   0.816
  681    H    THR  89           H        THR  89  -5.951 -14.815  -0.763
  682    HA   THR  89           HA       THR  89  -6.244 -16.992  -2.599
  683    HB   THR  89           HB       THR  89  -8.659 -16.163  -2.680
  684    HG1  THR  89           HG1      THR  89  -9.140 -14.676  -0.924
  685   1HG2  THR  89          1HG2      THR  89  -9.144 -16.990  -0.420
  686   2HG2  THR  89          2HG2      THR  89  -7.934 -17.991  -1.224
  687   3HG2  THR  89          3HG2      THR  89  -7.440 -16.827   0.004
  688    H    ARG  90           H        ARG  90  -6.193 -13.479  -2.851
  689    HA   ARG  90           HA       ARG  90  -6.825 -13.420  -5.636
  690   1HB   ARG  90          1HB       ARG  90  -6.035 -11.489  -3.588
  691   2HB   ARG  90          2HB       ARG  90  -5.344 -11.137  -5.162
  692   1HG   ARG  90          1HG       ARG  90  -7.364  -9.926  -5.013
  693   2HG   ARG  90          2HG       ARG  90  -7.665 -11.272  -6.107
  694   1HD   ARG  90          1HD       ARG  90  -8.337 -11.413  -3.184
  695   2HD   ARG  90          2HD       ARG  90  -9.451 -10.726  -4.362
  696    HE   ARG  90           HE       ARG  90  -8.803 -13.184  -5.381
  697   1HH1  ARG  90          1HH1      ARG  90 -10.169 -11.990  -2.381
  698   2HH1  ARG  90          2HH1      ARG  90 -11.069 -13.441  -2.063
  699   1HH2  ARG  90          1HH2      ARG  90 -10.048 -15.079  -4.991
  700   2HH2  ARG  90          2HH2      ARG  90 -11.024 -15.181  -3.553
  701    H    GLY  91           H        GLY  91  -3.973 -14.035  -3.797
  702   1HA   GLY  91          1HA       GLY  91  -2.017 -15.033  -4.602
  703   2HA   GLY  91          2HA       GLY  91  -2.519 -14.642  -6.242
  704    H    ILE  92           H        ILE  92  -2.515 -12.269  -3.702
  705    HA   ILE  92           HA       ILE  92  -0.440 -10.799  -5.179
  706    HB   ILE  92           HB       ILE  92  -2.454  -9.695  -3.208
  707   1HG1  ILE  92          1HG1      ILE  92  -2.523  -9.557  -6.230
  708   2HG1  ILE  92          2HG1      ILE  92  -3.507 -10.655  -5.267
  709   1HG2  ILE  92          1HG2      ILE  92  -0.438  -8.346  -3.437
  710   2HG2  ILE  92          2HG2      ILE  92  -0.634  -8.329  -5.189
  711   3HG2  ILE  92          3HG2      ILE  92  -1.821  -7.527  -4.161
  712   1HD1  ILE  92          1HD1      ILE  92  -4.639  -8.793  -4.237
  713   2HD1  ILE  92          2HD1      ILE  92  -3.596  -7.655  -5.088
  714   3HD1  ILE  92          3HD1      ILE  92  -4.730  -8.656  -5.993
  715    H    GLY  93           H        GLY  93   1.367 -10.056  -4.138
  716   1HA   GLY  93          1HA       GLY  93   1.936 -11.183  -1.527
  717   2HA   GLY  93          2HA       GLY  93   3.059 -10.300  -2.553
  718    H    LEU  94           H        LEU  94   1.418 -10.172   0.283
  719    HA   LEU  94           HA       LEU  94   1.254  -7.235   0.264
  720   1HB   LEU  94          1HB       LEU  94  -0.848  -8.279   0.843
  721   2HB   LEU  94          2HB       LEU  94  -0.067  -9.275   2.055
  722    HG   LEU  94           HG       LEU  94   0.410  -7.275   3.402
  723   1HD1  LEU  94          1HD1      LEU  94   0.589  -5.638   1.607
  724   2HD1  LEU  94          2HD1      LEU  94  -1.136  -5.801   1.275
  725   3HD1  LEU  94          3HD1      LEU  94  -0.594  -5.129   2.812
  726   1HD2  LEU  94          1HD2      LEU  94  -1.651  -8.522   3.777
  727   2HD2  LEU  94          2HD2      LEU  94  -1.885  -6.800   4.080
  728   3HD2  LEU  94          3HD2      LEU  94  -2.481  -7.523   2.585
  729    H    GLU  95           H        GLU  95   3.001  -6.296   1.070
  730    HA   GLU  95           HA       GLU  95   4.458  -7.678   3.228
  731   1HB   GLU  95          1HB       GLU  95   5.523  -5.523   1.395
  732   2HB   GLU  95          2HB       GLU  95   6.445  -6.504   2.526
  733   1HG   GLU  95          1HG       GLU  95   5.781  -8.511   1.183
  734   2HG   GLU  95          2HG       GLU  95   5.105  -7.403  -0.009
  735    H    ALA  96           H        ALA  96   4.144  -6.857   5.181
  736    HA   ALA  96           HA       ALA  96   3.173  -4.135   5.490
  737   1HB   ALA  96          1HB       ALA  96   3.656  -6.274   7.565
  738   2HB   ALA  96          2HB       ALA  96   2.859  -4.724   7.840
  739   3HB   ALA  96          3HB       ALA  96   2.115  -5.925   6.783
  740    H    MET  97           H        MET  97   4.513  -2.502   5.732
  741    HA   MET  97           HA       MET  97   7.064  -2.888   7.136
  742   1HB   MET  97          1HB       MET  97   6.759  -1.512   4.456
  743   2HB   MET  97          2HB       MET  97   8.222  -1.521   5.425
  744   1HG   MET  97          1HG       MET  97   8.369  -3.949   5.168
  745   2HG   MET  97          2HG       MET  97   6.910  -3.924   4.178
  746   1HE   MET  97          1HE       MET  97   9.711  -4.676   1.549
  747   2HE   MET  97          2HE       MET  97   8.172  -5.203   2.231
  748   3HE   MET  97          3HE       MET  97   9.635  -5.252   3.214
  749    H    THR  98           H        THR  98   8.115  -0.443   6.989
  750    HA   THR  98           HA       THR  98   6.122   1.322   8.175
  751    HB   THR  98           HB       THR  98   8.113   2.765   8.691
  752    HG1  THR  98           HG1      THR  98  10.149   2.019   8.242
  753   1HG2  THR  98          1HG2      THR  98   9.024   1.297  10.435
  754   2HG2  THR  98          2HG2      THR  98   7.266   1.173  10.342
  755   3HG2  THR  98          3HG2      THR  98   8.278  -0.095   9.650
  756    H    ASN  99           H        ASN  99   6.000   3.587   7.416
  757    HA   ASN  99           HA       ASN  99   5.531   3.737   4.672
  758   1HB   ASN  99          1HB       ASN  99   5.972   5.943   6.686
  759   2HB   ASN  99          2HB       ASN  99   5.502   6.247   5.018
  760   1HD2  ASN  99          2HD2      ASN  99   4.053   6.907   7.400
  761   2HD2  ASN  99          1HD2      ASN  99   2.542   6.070   7.322
  762    H    ALA 100           H        ALA 100   8.367   4.750   6.519
  763    HA   ALA 100           HA       ALA 100   9.716   6.048   4.423
  764   1HB   ALA 100          1HB       ALA 100  10.895   4.663   6.828
  765   2HB   ALA 100          2HB       ALA 100  11.705   5.854   5.810
  766   3HB   ALA 100          3HB       ALA 100  10.311   6.327   6.780
  767    H    ALA 101           H        ALA 101   9.755   2.675   5.495
  768    HA   ALA 101           HA       ALA 101  11.863   1.912   3.712
  769   1HB   ALA 101          1HB       ALA 101  11.455   0.727   5.818
  770   2HB   ALA 101          2HB       ALA 101   9.898   0.175   5.201
  771   3HB   ALA 101          3HB       ALA 101  11.392  -0.362   4.433
  772    H    ALA 102           H        ALA 102   8.345   1.721   3.667
  773    HA   ALA 102           HA       ALA 102   8.120   0.072   1.384
  774   1HB   ALA 102          1HB       ALA 102   6.311   0.382   3.002
  775   2HB   ALA 102          2HB       ALA 102   6.137   2.058   2.481
  776   3HB   ALA 102          3HB       ALA 102   5.784   0.745   1.358
  777    H    ALA 103           H        ALA 103   8.302   3.570   1.795
  778    HA   ALA 103           HA       ALA 103   7.663   4.322  -0.841
  779   1HB   ALA 103          1HB       ALA 103   7.753   5.907   1.034
  780   2HB   ALA 103          2HB       ALA 103   9.506   5.725   1.093
  781   3HB   ALA 103          3HB       ALA 103   8.742   6.440  -0.326
  782    H    ARG 104           H        ARG 104  10.626   3.213   0.632
  783    HA   ARG 104           HA       ARG 104  12.368   3.969  -1.482
  784   1HB   ARG 104          1HB       ARG 104  13.047   3.501   0.884
  785   2HB   ARG 104          2HB       ARG 104  12.757   1.796   0.582
  786   1HG   ARG 104          1HG       ARG 104  14.543   1.674  -0.970
  787   2HG   ARG 104          2HG       ARG 104  14.715   3.432  -1.006
  788   1HD   ARG 104          1HD       ARG 104  15.261   1.617   1.342
  789   2HD   ARG 104          2HD       ARG 104  16.463   2.457   0.361
  790    HE   ARG 104           HE       ARG 104  14.908   4.470   1.265
  791   1HH1  ARG 104          1HH1      ARG 104  16.657   1.879   2.846
  792   2HH1  ARG 104          2HH1      ARG 104  16.808   2.735   4.352
  793   1HH2  ARG 104          1HH2      ARG 104  15.121   5.600   3.245
  794   2HH2  ARG 104          2HH2      ARG 104  15.953   4.852   4.576
  795    H    THR 105           H        THR 105  10.542   1.065  -0.710
  796    HA   THR 105           HA       THR 105  11.615  -0.518  -2.826
  797    HB   THR 105           HB       THR 105   8.979  -0.878  -1.385
  798    HG1  THR 105           HG1      THR 105  10.967  -2.463  -0.484
  799   1HG2  THR 105          1HG2      THR 105  10.790  -2.860  -2.776
  800   2HG2  THR 105          2HG2      THR 105   9.297  -3.248  -1.921
  801   3HG2  THR 105          3HG2      THR 105   9.244  -2.272  -3.388
  802    H    TYR 106           H        TYR 106   8.889   1.657  -2.474
  803    HA   TYR 106           HA       TYR 106   7.400   1.012  -4.726
  804   1HB   TYR 106          1HB       TYR 106   6.500   2.540  -3.118
  805   2HB   TYR 106          2HB       TYR 106   7.832   3.667  -3.350
  806    HD1  TYR 106           HD1      TYR 106   4.909   2.156  -5.089
  807    HD2  TYR 106           HD2      TYR 106   7.669   5.391  -4.925
  808    HE1  TYR 106           HE1      TYR 106   3.608   3.347  -6.802
  809    HE2  TYR 106           HE2      TYR 106   6.375   6.590  -6.637
  810    HH   TYR 106           HH       TYR 106   3.251   5.618  -7.603
  811    H    ASN 107           H        ASN 107  10.195   3.178  -4.445
  812    HA   ASN 107           HA       ASN 107  10.076   4.290  -7.011
  813   1HB   ASN 107          1HB       ASN 107  11.499   5.124  -5.135
  814   2HB   ASN 107          2HB       ASN 107  12.577   3.757  -5.392
  815   1HD2  ASN 107          2HD2      ASN 107  13.914   3.728  -7.211
  816   2HD2  ASN 107          1HD2      ASN 107  14.179   5.140  -8.171
  817    H    VAL 108           H        VAL 108  11.514   1.291  -5.876
  818    HA   VAL 108           HA       VAL 108  12.950   0.706  -8.264
  819    HB   VAL 108           HB       VAL 108  11.990  -1.252  -6.169
  820   1HG1  VAL 108          1HG1      VAL 108  14.276  -1.388  -8.130
  821   2HG1  VAL 108          2HG1      VAL 108  13.915  -2.588  -6.889
  822   3HG1  VAL 108          3HG1      VAL 108  12.777  -2.314  -8.209
  823   1HG2  VAL 108          1HG2      VAL 108  14.537   0.359  -6.253
  824   2HG2  VAL 108          2HG2      VAL 108  13.212   0.557  -5.105
  825   3HG2  VAL 108          3HG2      VAL 108  14.171  -0.923  -5.098
  826    H    LEU 109           H        LEU 109   9.778  -0.203  -7.013
  827    HA   LEU 109           HA       LEU 109   9.207  -1.966  -9.205
  828   1HB   LEU 109          1HB       LEU 109   7.385  -0.800  -7.099
  829   2HB   LEU 109          2HB       LEU 109   6.958  -2.090  -8.208
  830    HG   LEU 109           HG       LEU 109   9.133  -2.254  -6.119
  831   1HD1  LEU 109          1HD1      LEU 109   6.377  -3.469  -6.161
  832   2HD1  LEU 109          2HD1      LEU 109   7.625  -3.772  -4.951
  833   3HD1  LEU 109          3HD1      LEU 109   6.921  -2.162  -5.110
  834   1HD2  LEU 109          1HD2      LEU 109   7.978  -4.357  -7.946
  835   2HD2  LEU 109          2HD2      LEU 109   9.587  -3.644  -8.067
  836   3HD2  LEU 109          3HD2      LEU 109   9.165  -4.634  -6.671
  837    H    ALA 110           H        ALA 110   8.600   1.383  -8.427
  838    HA   ALA 110           HA       ALA 110   6.662   1.914 -10.411
  839   1HB   ALA 110          1HB       ALA 110   7.074   3.415  -8.521
  840   2HB   ALA 110          2HB       ALA 110   8.661   3.808  -9.182
  841   3HB   ALA 110          3HB       ALA 110   7.202   4.262 -10.062
  842    H    SER 111           H        SER 111  10.198   2.124 -10.417
  843    HA   SER 111           HA       SER 111  10.384   3.189 -13.035
  844   1HB   SER 111          1HB       SER 111  12.802   2.288 -12.829
  845   2HB   SER 111          2HB       SER 111  12.284   3.545 -11.709
  846    HG   SER 111           HG       SER 111  12.283   2.141 -10.087
  847    H    GLU 112           H        GLU 112  10.272  -0.082 -11.749
  848    HA   GLU 112           HA       GLU 112  10.819  -1.415 -14.197
  849   1HB   GLU 112          1HB       GLU 112  10.949  -2.530 -11.988
  850   2HB   GLU 112          2HB       GLU 112   9.205  -2.378 -11.821
  851   1HG   GLU 112          1HG       GLU 112   9.002  -3.733 -13.935
  852   2HG   GLU 112          2HG       GLU 112  10.730  -4.050 -13.796
  853    H    GLY 113           H        GLY 113   7.899  -0.188 -12.669
  854   1HA   GLY 113          1HA       GLY 113   5.981   0.494 -13.893
  855   2HA   GLY 113          2HA       GLY 113   6.457  -0.592 -15.193
  856    H    ARG 114           H        ARG 114   6.540  -1.651 -11.901
  857    HA   ARG 114           HA       ARG 114   4.475  -3.627 -12.493
  858   1HB   ARG 114          1HB       ARG 114   6.686  -4.265 -11.454
  859   2HB   ARG 114          2HB       ARG 114   6.193  -3.384 -10.016
  860   1HG   ARG 114          1HG       ARG 114   4.207  -4.887  -9.865
  861   2HG   ARG 114          2HG       ARG 114   4.895  -5.831 -11.187
  862   1HD   ARG 114          1HD       ARG 114   6.095  -5.359  -8.463
  863   2HD   ARG 114          2HD       ARG 114   5.476  -6.880  -9.106
  864    HE   ARG 114           HE       ARG 114   7.612  -5.747 -10.679
  865   1HH1  ARG 114          1HH1      ARG 114   6.829  -7.806  -7.948
  866   2HH1  ARG 114          2HH1      ARG 114   8.359  -8.624  -7.960
  867   1HH2  ARG 114          1HH2      ARG 114   9.637  -6.781 -10.672
  868   2HH2  ARG 114          2HH2      ARG 114   9.968  -8.027  -9.499
  869    H    ARG 115           H        ARG 115   2.496  -3.646 -11.542
  870    HA   ARG 115           HA       ARG 115   1.649  -1.264 -10.210
  871   1HB   ARG 115          1HB       ARG 115   0.266  -3.819 -10.962
  872   2HB   ARG 115          2HB       ARG 115  -0.534  -2.614  -9.959
  873   1HG   ARG 115          1HG       ARG 115  -0.232  -0.945 -11.712
  874   2HG   ARG 115          2HG       ARG 115   0.577  -2.147 -12.718
  875   1HD   ARG 115          1HD       ARG 115  -1.429  -3.456 -12.867
  876   2HD   ARG 115          2HD       ARG 115  -2.246  -2.417 -11.699
  877    HE   ARG 115           HE       ARG 115  -2.532  -0.796 -13.338
  878   1HH1  ARG 115          1HH1      ARG 115  -0.672  -3.515 -14.557
  879   2HH1  ARG 115          2HH1      ARG 115  -0.769  -2.989 -16.214
  880   1HH2  ARG 115          1HH2      ARG 115  -2.660  -0.120 -15.518
  881   2HH2  ARG 115          2HH2      ARG 115  -1.903  -1.074 -16.756
  882    H    VAL 116           H        VAL 116   2.813  -1.119  -8.349
  883    HA   VAL 116           HA       VAL 116   2.146  -3.034  -6.241
  884    HB   VAL 116           HB       VAL 116   4.512  -2.532  -6.367
  885   1HG1  VAL 116          1HG1      VAL 116   3.750   0.362  -6.006
  886   2HG1  VAL 116          2HG1      VAL 116   5.394  -0.278  -6.005
  887   3HG1  VAL 116          3HG1      VAL 116   4.415  -0.368  -7.469
  888   1HG2  VAL 116          1HG2      VAL 116   3.232  -1.174  -3.998
  889   2HG2  VAL 116          2HG2      VAL 116   3.600  -2.892  -4.148
  890   3HG2  VAL 116          3HG2      VAL 116   4.910  -1.713  -4.085
  891    H    ALA 117           H        ALA 117   0.668  -2.562  -4.767
  892    HA   ALA 117           HA       ALA 117  -0.541   0.091  -4.790
  893   1HB   ALA 117          1HB       ALA 117  -2.018  -1.862  -4.844
  894   2HB   ALA 117          2HB       ALA 117  -1.365  -2.399  -3.296
  895   3HB   ALA 117          3HB       ALA 117  -2.280  -0.894  -3.392
  896    H    LEU 118           H        LEU 118   0.809   1.444  -3.725
  897    HA   LEU 118           HA       LEU 118   1.953   0.658  -1.177
  898   1HB   LEU 118          1HB       LEU 118   3.310   1.931  -2.756
  899   2HB   LEU 118          2HB       LEU 118   2.131   3.227  -2.758
  900    HG   LEU 118           HG       LEU 118   2.631   3.675  -0.386
  901   1HD1  LEU 118          1HD1      LEU 118   3.327   1.438   0.276
  902   2HD1  LEU 118          2HD1      LEU 118   4.761   1.572  -0.742
  903   3HD1  LEU 118          3HD1      LEU 118   4.572   2.626   0.659
  904   1HD2  LEU 118          1HD2      LEU 118   5.027   3.660  -2.218
  905   2HD2  LEU 118          2HD2      LEU 118   3.795   4.918  -2.117
  906   3HD2  LEU 118          3HD2      LEU 118   4.868   4.621  -0.750
  907    H    ALA 119           H        ALA 119   0.377   0.536   0.321
  908    HA   ALA 119           HA       ALA 119  -1.512   2.752   0.598
  909   1HB   ALA 119          1HB       ALA 119  -2.424   0.478   0.636
  910   2HB   ALA 119          2HB       ALA 119  -1.417   0.098   2.032
  911   3HB   ALA 119          3HB       ALA 119  -2.694   1.305   2.170
  912    H    MET 120           H        MET 120  -0.569   4.401   1.623
  913    HA   MET 120           HA       MET 120   1.167   3.844   3.915
  914   1HB   MET 120          1HB       MET 120   0.846   6.177   2.077
  915   2HB   MET 120          2HB       MET 120   1.493   6.441   3.689
  916   1HG   MET 120          1HG       MET 120   3.262   4.802   3.221
  917   2HG   MET 120          2HG       MET 120   2.628   4.617   1.585
  918   1HE   MET 120          1HE       MET 120   5.244   5.125   0.965
  919   2HE   MET 120          2HE       MET 120   5.676   5.572   2.613
  920   3HE   MET 120          3HE       MET 120   6.026   6.672   1.280
  921    H    ILE 121           H        ILE 121   0.218   3.804   5.819
  922    HA   ILE 121           HA       ILE 121  -1.949   5.684   6.414
  923    HB   ILE 121           HB       ILE 121  -0.718   3.559   8.193
  924   1HG1  ILE 121          1HG1      ILE 121  -3.314   3.494   6.632
  925   2HG1  ILE 121          2HG1      ILE 121  -1.854   2.608   6.206
  926   1HG2  ILE 121          1HG2      ILE 121  -3.240   5.188   8.506
  927   2HG2  ILE 121          2HG2      ILE 121  -2.712   3.895   9.584
  928   3HG2  ILE 121          3HG2      ILE 121  -1.758   5.371   9.445
  929   1HD1  ILE 121          1HD1      ILE 121  -3.479   2.229   8.711
  930   2HD1  ILE 121          2HD1      ILE 121  -3.478   1.173   7.299
  931   3HD1  ILE 121          3HD1      ILE 121  -2.021   1.335   8.280
  932    H    VAL 122           H        VAL 122  -1.108   7.675   6.721
  933    HA   VAL 122           HA       VAL 122   1.507   7.867   8.042
  934    HB   VAL 122           HB       VAL 122   0.108   9.943   6.355
  935   1HG1  VAL 122          1HG1      VAL 122   2.942   9.784   7.371
  936   2HG1  VAL 122          2HG1      VAL 122   2.309  11.017   6.280
  937   3HG1  VAL 122          3HG1      VAL 122   1.694  10.900   7.929
  938   1HG2  VAL 122          1HG2      VAL 122   0.646   7.978   5.027
  939   2HG2  VAL 122          2HG2      VAL 122   1.700   9.326   4.598
  940   3HG2  VAL 122          3HG2      VAL 122   2.309   8.019   5.614
  941    H    GLY 123           H        GLY 123   1.089   7.986  10.172
  942   1HA   GLY 123          1HA       GLY 123   0.699   9.048  12.162
  943   2HA   GLY 123          2HA       GLY 123   0.647  10.528  11.227
  944    H    GLY 124           H        GLY 124  -1.652   7.939  10.709
  945   1HA   GLY 124          1HA       GLY 124  -3.828   9.738  11.282
  946   2HA   GLY 124          2HA       GLY 124  -3.968   8.071  10.742
  947    H    LEU 125           H        LEU 125  -2.676   9.740  13.616
  948    HA   LEU 125           HA       LEU 125  -4.278   7.913  15.278
  949   1HB   LEU 125          1HB       LEU 125  -1.399   8.706  15.727
  950   2HB   LEU 125          2HB       LEU 125  -2.381   7.827  16.882
  951    HG   LEU 125           HG       LEU 125  -1.654   6.817  14.131
  952   1HD1  LEU 125          1HD1      LEU 125   0.307   6.978  15.569
  953   2HD1  LEU 125          2HD1      LEU 125  -0.538   6.089  16.836
  954   3HD1  LEU 125          3HD1      LEU 125  -0.149   5.294  15.310
  955   1HD2  LEU 125          1HD2      LEU 125  -3.767   5.926  14.970
  956   2HD2  LEU 125          2HD2      LEU 125  -2.515   4.684  14.955
  957   3HD2  LEU 125          3HD2      LEU 125  -2.977   5.452  16.475
  958    H    GLU 126           H        GLU 126  -5.808   9.433  15.812
  959    HA   GLU 126           HA       GLU 126  -4.817  11.553  17.603
  960   1HB   GLU 126          1HB       GLU 126  -5.607  12.620  15.562
  961   2HB   GLU 126          2HB       GLU 126  -7.134  11.754  15.670
  962   1HG   GLU 126          1HG       GLU 126  -7.568  12.909  17.826
  963   2HG   GLU 126          2HG       GLU 126  -6.109  13.861  17.556
  964    H    HIS 127           H        HIS 127  -5.593  11.422  19.591
  965    HA   HIS 127           HA       HIS 127  -7.572   9.413  20.212
  966   1HB   HIS 127          1HB       HIS 127  -5.920  11.265  21.932
  967   2HB   HIS 127          2HB       HIS 127  -7.117  10.157  22.598
  968    HD1  HIS 127           HD1      HIS 127  -3.712  10.238  22.537
  969    HD2  HIS 127           HD2      HIS 127  -6.414   7.452  21.028
  970    HE1  HIS 127           HE1      HIS 127  -2.429   8.090  22.320
  971    HE2  HIS 127           HE2      HIS 127  -4.020   6.490  21.198
  972    H    HIS 128           H        HIS 128  -9.263  10.517  18.985
  973    HA   HIS 128           HA       HIS 128 -11.131  11.772  18.751
  974   1HB   HIS 128          1HB       HIS 128 -11.000  11.217  21.671
  975   2HB   HIS 128          2HB       HIS 128 -12.194  12.384  21.112
  976    HD1  HIS 128           HD1      HIS 128 -11.303   8.725  20.870
  977    HD2  HIS 128           HD2      HIS 128 -14.353  11.320  19.743
  978    HE1  HIS 128           HE1      HIS 128 -13.198   7.261  20.123
  979    HE2  HIS 128           HE2      HIS 128 -14.959   8.849  19.276
  980    H    HIS 129           H        HIS 129 -10.902  13.552  21.683
  981    HA   HIS 129           HA       HIS 129 -10.138  15.902  20.127
  982   1HB   HIS 129          1HB       HIS 129 -10.951  17.244  22.057
  983   2HB   HIS 129          2HB       HIS 129 -12.192  16.225  21.352
  984    HD1  HIS 129           HD1      HIS 129 -13.044  14.213  22.809
  985    HD2  HIS 129           HD2      HIS 129 -10.371  16.769  24.724
  986    HE1  HIS 129           HE1      HIS 129 -13.186  13.643  25.257
  987    HE2  HIS 129           HE2      HIS 129 -11.680  15.306  26.409
  988    H    HIS 130           H        HIS 130  -9.437  14.584  23.358
  989    HA   HIS 130           HA       HIS 130  -6.621  14.717  22.971
  990   1HB   HIS 130          1HB       HIS 130  -7.962  16.830  24.629
  991   2HB   HIS 130          2HB       HIS 130  -6.400  16.204  25.136
  992    HD1  HIS 130           HD1      HIS 130  -4.505  16.361  23.075
  993    HD2  HIS 130           HD2      HIS 130  -7.758  18.951  22.980
  994    HE1  HIS 130           HE1      HIS 130  -3.828  18.241  21.557
  995    HE2  HIS 130           HE2      HIS 130  -5.753  19.866  21.619
  996    H    HIS 131           H        HIS 131  -5.616  13.349  24.341
  997    HA   HIS 131           HA       HIS 131  -6.791  12.694  26.912
  998   1HB   HIS 131          1HB       HIS 131  -6.636  10.736  24.659
  999   2HB   HIS 131          2HB       HIS 131  -6.280  10.166  26.285
 1000    HD1  HIS 131           HD1      HIS 131  -8.325  11.030  28.072
 1001    HD2  HIS 131           HD2      HIS 131  -9.236  10.395  24.060
 1002    HE1  HIS 131           HE1      HIS 131 -10.812  10.682  27.985
 1003    HE2  HIS 131           HE2      HIS 131 -11.300  10.068  25.592
 1004    H    HIS 132           H        HIS 132  -4.283  11.881  24.554
 1005    HA   HIS 132           HA       HIS 132  -2.135  12.626  26.202
 1006   1HB   HIS 132          1HB       HIS 132  -2.870  10.502  27.382
 1007   2HB   HIS 132          2HB       HIS 132  -2.442   9.625  25.918
 1008    HD1  HIS 132           HD1      HIS 132  -1.032  10.990  29.013
 1009    HD2  HIS 132           HD2      HIS 132   0.404   9.733  25.312
 1010    HE1  HIS 132           HE1      HIS 132   1.442  10.656  29.319
 1011    HE2  HIS 132           HE2      HIS 132   2.283   9.816  27.096
  Start of MODEL   18
    1   1H    MET   1          1HT       MET   1   4.122  -0.531 -19.453
    2   2H    MET   1          2HT       MET   1   2.996  -1.147 -18.340
    3   3H    MET   1          3HT       MET   1   4.305  -0.219 -17.799
    4    HA   MET   1           HA       MET   1   2.177   0.998 -17.831
    5   1HB   MET   1          1HB       MET   1   4.329   2.171 -17.929
    6   2HB   MET   1          2HB       MET   1   4.367   1.983 -19.676
    7   1HG   MET   1          1HG       MET   1   2.395   3.400 -19.880
    8   2HG   MET   1          2HG       MET   1   2.333   3.573 -18.126
    9   1HE   MET   1          1HE       MET   1   2.305   6.226 -18.374
   10   2HE   MET   1          2HE       MET   1   2.350   6.048 -20.128
   11   3HE   MET   1          3HE       MET   1   3.491   7.126 -19.321
   12    HA   PRO   2           HA       PRO   2  -0.318   0.087 -21.442
   13   1HB   PRO   2          1HB       PRO   2  -2.110   2.147 -20.343
   14   2HB   PRO   2          2HB       PRO   2  -2.420   0.434 -20.640
   15   1HG   PRO   2          1HG       PRO   2  -2.176   1.418 -18.153
   16   2HG   PRO   2          2HG       PRO   2  -1.612  -0.208 -18.579
   17   1HD   PRO   2          1HD       PRO   2  -0.035   2.315 -18.226
   18   2HD   PRO   2          2HD       PRO   2   0.351   0.662 -17.702
   19    H    LEU   3           H        LEU   3   0.279   0.936 -23.348
   20    HA   LEU   3           HA       LEU   3   1.088   3.714 -23.455
   21   1HB   LEU   3          1HB       LEU   3   1.222   1.535 -25.531
   22   2HB   LEU   3          2HB       LEU   3   1.840   3.160 -25.756
   23    HG   LEU   3           HG       LEU   3   2.831   1.133 -23.751
   24   1HD1  LEU   3          1HD1      LEU   3   4.885   1.207 -25.076
   25   2HD1  LEU   3          2HD1      LEU   3   3.511   0.652 -26.033
   26   3HD1  LEU   3          3HD1      LEU   3   4.107   2.302 -26.219
   27   1HD2  LEU   3          1HD2      LEU   3   3.774   3.950 -24.280
   28   2HD2  LEU   3          2HD2      LEU   3   2.947   3.388 -22.828
   29   3HD2  LEU   3          3HD2      LEU   3   4.558   2.784 -23.215
   30    H    ASN   4           H        ASN   4  -1.194   4.366 -23.070
   31    HA   ASN   4           HA       ASN   4  -2.123   5.266 -25.699
   32   1HB   ASN   4          1HB       ASN   4  -3.683   3.460 -24.866
   33   2HB   ASN   4          2HB       ASN   4  -4.053   4.498 -23.493
   34   1HD2  ASN   4          2HD2      ASN   4  -6.227   4.583 -24.105
   35   2HD2  ASN   4          1HD2      ASN   4  -6.756   5.549 -25.437
   36    H    GLN   5           H        GLN   5  -0.537   6.053 -23.288
   37    HA   GLN   5           HA       GLN   5  -1.328   8.805 -23.226
   38   1HB   GLN   5          1HB       GLN   5  -2.745   7.939 -21.420
   39   2HB   GLN   5          2HB       GLN   5  -1.356   7.156 -20.680
   40   1HG   GLN   5          1HG       GLN   5  -1.869   9.144 -19.463
   41   2HG   GLN   5          2HG       GLN   5  -0.347   9.382 -20.317
   42   1HE2  GLN   5          2HE2      GLN   5  -3.669  10.310 -20.067
   43   2HE2  GLN   5          1HE2      GLN   5  -3.581  11.698 -21.099
   44    H    GLU   6           H        GLU   6   0.614   9.499 -23.883
   45    HA   GLU   6           HA       GLU   6   3.038   8.124 -23.302
   46   1HB   GLU   6          1HB       GLU   6   2.169  10.122 -25.090
   47   2HB   GLU   6          2HB       GLU   6   3.475  10.840 -24.158
   48   1HG   GLU   6          1HG       GLU   6   3.720   8.172 -25.511
   49   2HG   GLU   6          2HG       GLU   6   4.117   9.692 -26.308
   50    H    HIS   7           H        HIS   7   2.155  11.486 -22.531
   51    HA   HIS   7           HA       HIS   7   3.168  11.115 -19.825
   52   1HB   HIS   7          1HB       HIS   7   4.248  13.192 -21.735
   53   2HB   HIS   7          2HB       HIS   7   4.444  13.292 -19.990
   54    HD1  HIS   7           HD1      HIS   7   5.903  11.349 -18.877
   55    HD2  HIS   7           HD2      HIS   7   6.073  11.618 -23.028
   56    HE1  HIS   7           HE1      HIS   7   7.928  10.023 -19.563
   57    HE2  HIS   7           HE2      HIS   7   7.922  10.075 -22.081
   58    HA   PRO   8           HA       PRO   8  -0.508  13.718 -19.366
   59   1HB   PRO   8          1HB       PRO   8  -0.269  12.866 -16.575
   60   2HB   PRO   8          2HB       PRO   8  -1.610  12.635 -17.698
   61   1HG   PRO   8          1HG       PRO   8  -0.054  10.588 -16.866
   62   2HG   PRO   8          2HG       PRO   8  -0.782  10.634 -18.483
   63   1HD   PRO   8          1HD       PRO   8   2.023  11.277 -17.646
   64   2HD   PRO   8          2HD       PRO   8   1.449  10.380 -19.069
   65    H    ASP   9           H        ASP   9  -0.909  15.481 -17.695
   66    HA   ASP   9           HA       ASP   9   1.472  17.095 -17.619
   67   1HB   ASP   9          1HB       ASP   9  -0.783  18.006 -18.168
   68   2HB   ASP   9          2HB       ASP   9  -1.265  17.722 -16.498
   69    H    TYR  10           H        TYR  10   2.931  16.467 -16.148
   70    HA   TYR  10           HA       TYR  10   3.961  16.139 -14.171
   71   1HB   TYR  10          1HB       TYR  10   1.731  17.929 -13.433
   72   2HB   TYR  10          2HB       TYR  10   2.500  17.064 -12.105
   73    HD1  TYR  10           HD1      TYR  10   2.918  19.646 -14.652
   74    HD2  TYR  10           HD2      TYR  10   4.850  17.443 -11.572
   75    HE1  TYR  10           HE1      TYR  10   4.758  21.278 -14.646
   76    HE2  TYR  10           HE2      TYR  10   6.690  19.069 -11.552
   77    HH   TYR  10           HH       TYR  10   6.494  22.082 -13.016
   78    H    THR  11           H        THR  11   4.148  14.084 -13.755
   79    HA   THR  11           HA       THR  11   1.990  12.331 -13.206
   80    HB   THR  11           HB       THR  11   4.941  11.904 -12.688
   81    HG1  THR  11           HG1      THR  11   3.350  11.823 -15.015
   82   1HG2  THR  11          1HG2      THR  11   2.696   9.935 -13.160
   83   2HG2  THR  11          2HG2      THR  11   4.402   9.528 -12.967
   84   3HG2  THR  11          3HG2      THR  11   3.506  10.231 -11.621
   85    H    TYR  12           H        TYR  12   1.029  11.838 -11.325
   86    HA   TYR  12           HA       TYR  12   1.838  13.029  -8.857
   87   1HB   TYR  12          1HB       TYR  12  -0.211  10.942  -9.574
   88   2HB   TYR  12          2HB       TYR  12   0.136  11.340  -7.897
   89    HD1  TYR  12           HD1      TYR  12  -0.904  13.158  -6.873
   90    HD2  TYR  12           HD2      TYR  12  -0.982  12.849 -11.116
   91    HE1  TYR  12           HE1      TYR  12  -2.498  15.025  -6.972
   92    HE2  TYR  12           HE2      TYR  12  -2.577  14.718 -11.225
   93    HH   TYR  12           HH       TYR  12  -3.357  16.643  -8.428
   94    H    ALA  13           H        ALA  13   3.986  12.388  -8.619
   95    HA   ALA  13           HA       ALA  13   4.397   9.528  -8.078
   96   1HB   ALA  13          1HB       ALA  13   6.435  11.573  -8.946
   97   2HB   ALA  13          2HB       ALA  13   6.737   9.860  -8.660
   98   3HB   ALA  13          3HB       ALA  13   5.687  10.362  -9.986
   99    H    LEU  14           H        LEU  14   5.678   8.932  -6.326
  100    HA   LEU  14           HA       LEU  14   5.407  10.507  -3.989
  101   1HB   LEU  14          1HB       LEU  14   5.471   8.023  -4.041
  102   2HB   LEU  14          2HB       LEU  14   7.163   8.099  -4.487
  103    HG   LEU  14           HG       LEU  14   7.653   9.202  -2.320
  104   1HD1  LEU  14          1HD1      LEU  14   5.460  10.194  -1.915
  105   2HD1  LEU  14          2HD1      LEU  14   4.762   8.587  -1.722
  106   3HD1  LEU  14          3HD1      LEU  14   5.956   9.174  -0.565
  107   1HD2  LEU  14          1HD2      LEU  14   7.328   7.181  -0.954
  108   2HD2  LEU  14          2HD2      LEU  14   6.252   6.537  -2.194
  109   3HD2  LEU  14          3HD2      LEU  14   7.955   6.816  -2.562
  110    H    ARG  15           H        ARG  15   6.928  11.706  -2.872
  111    HA   ARG  15           HA       ARG  15   9.248  12.512  -4.473
  112   1HB   ARG  15          1HB       ARG  15   7.376  14.042  -3.253
  113   2HB   ARG  15          2HB       ARG  15   8.584  13.965  -1.981
  114   1HG   ARG  15          1HG       ARG  15   8.845  15.935  -3.416
  115   2HG   ARG  15          2HG       ARG  15  10.258  14.876  -3.461
  116   1HD   ARG  15          1HD       ARG  15   9.814  14.151  -5.601
  117   2HD   ARG  15          2HD       ARG  15   8.094  14.511  -5.478
  118    HE   ARG  15           HE       ARG  15   9.685  16.877  -5.363
  119   1HH1  ARG  15          1HH1      ARG  15   8.483  14.447  -7.581
  120   2HH1  ARG  15          2HH1      ARG  15   8.291  15.558  -8.907
  121   1HH2  ARG  15          1HH2      ARG  15   9.455  18.346  -7.107
  122   2HH2  ARG  15          2HH2      ARG  15   8.864  17.781  -8.640
  123    H    ALA  16           H        ALA  16   8.416  11.895  -1.074
  124    HA   ALA  16           HA       ALA  16  10.642  10.185  -0.637
  125   1HB   ALA  16          1HB       ALA  16  11.890  11.585   0.928
  126   2HB   ALA  16          2HB       ALA  16  11.863  12.312  -0.678
  127   3HB   ALA  16          3HB       ALA  16  10.812  12.940   0.593
  128    H    ALA  17           H        ALA  17  10.849   9.761   1.805
  129    HA   ALA  17           HA       ALA  17   8.192   9.983   3.055
  130   1HB   ALA  17          1HB       ALA  17   8.737   7.979   4.312
  131   2HB   ALA  17          2HB       ALA  17   8.865   7.677   2.579
  132   3HB   ALA  17          3HB       ALA  17  10.325   7.910   3.543
  133    H    ASP  18           H        ASP  18   8.054  11.055   4.942
  134    HA   ASP  18           HA       ASP  18  10.547  12.275   5.870
  135   1HB   ASP  18          1HB       ASP  18   8.526  13.648   5.132
  136   2HB   ASP  18          2HB       ASP  18   7.732  13.091   6.599
  137    H    GLY  19           H        GLY  19   8.389   9.849   6.715
  138   1HA   GLY  19          1HA       GLY  19   8.398   8.473   8.589
  139   2HA   GLY  19          2HA       GLY  19   9.570   9.554   9.338
  140    H    ARG  20           H        ARG  20   6.463   8.456   9.503
  141    HA   ARG  20           HA       ARG  20   4.524   9.110  10.484
  142   1HB   ARG  20          1HB       ARG  20   6.305  11.218  11.726
  143   2HB   ARG  20          2HB       ARG  20   4.631  10.941  12.191
  144   1HG   ARG  20          1HG       ARG  20   5.115   8.812  13.063
  145   2HG   ARG  20          2HG       ARG  20   6.696   8.766  12.286
  146   1HD   ARG  20          1HD       ARG  20   6.850   9.180  14.701
  147   2HD   ARG  20          2HD       ARG  20   7.506  10.509  13.749
  148    HE   ARG  20           HE       ARG  20   5.831  11.880  14.526
  149   1HH1  ARG  20          1HH1      ARG  20   5.140   8.559  15.443
  150   2HH1  ARG  20          2HH1      ARG  20   3.881   9.003  16.566
  151   1HH2  ARG  20          1HH2      ARG  20   4.219  12.446  16.045
  152   2HH2  ARG  20          2HH2      ARG  20   3.403  11.199  16.946
  153    H    HIS  21           H        HIS  21   5.941  10.561   8.087
  154    HA   HIS  21           HA       HIS  21   3.616  12.120   7.371
  155   1HB   HIS  21          1HB       HIS  21   6.364  13.348   7.611
  156   2HB   HIS  21          2HB       HIS  21   5.128  14.021   6.560
  157    HD1  HIS  21           HD1      HIS  21   6.430  14.326   9.894
  158    HD2  HIS  21           HD2      HIS  21   2.675  14.669   8.131
  159    HE1  HIS  21           HE1      HIS  21   5.026  15.633  11.524
  160    HE2  HIS  21           HE2      HIS  21   2.716  15.677  10.506
  161    H    ALA  22           H        ALA  22   3.391  12.303   5.135
  162    HA   ALA  22           HA       ALA  22   5.375  10.790   3.562
  163   1HB   ALA  22          1HB       ALA  22   3.549  10.078   2.103
  164   2HB   ALA  22          2HB       ALA  22   3.261   9.577   3.769
  165   3HB   ALA  22          3HB       ALA  22   2.396  10.963   3.104
  166    H    LYS  23           H        LYS  23   6.157  11.720   1.748
  167    HA   LYS  23           HA       LYS  23   5.221  14.457   1.194
  168   1HB   LYS  23          1HB       LYS  23   7.613  13.940   2.088
  169   2HB   LYS  23          2HB       LYS  23   7.932  13.387   0.453
  170   1HG   LYS  23          1HG       LYS  23   7.363  15.599  -0.410
  171   2HG   LYS  23          2HG       LYS  23   7.043  16.156   1.236
  172   1HD   LYS  23          1HD       LYS  23   9.415  15.446   1.786
  173   2HD   LYS  23          2HD       LYS  23   9.664  15.271   0.049
  174   1HE   LYS  23          1HE       LYS  23  10.458  17.431   0.754
  175   2HE   LYS  23          2HE       LYS  23   9.019  17.638  -0.243
  176   1HZ   LYS  23          1HZ       LYS  23   7.717  18.102   1.654
  177   2HZ   LYS  23          2HZ       LYS  23   8.932  17.599   2.723
  178   3HZ   LYS  23          3HZ       LYS  23   9.123  19.025   1.827
  179    H    VAL  24           H        VAL  24   3.789  14.185  -0.452
  180    HA   VAL  24           HA       VAL  24   4.691  12.624  -2.790
  181    HB   VAL  24           HB       VAL  24   1.851  13.357  -2.043
  182   1HG1  VAL  24          1HG1      VAL  24   2.165  13.126  -4.444
  183   2HG1  VAL  24          2HG1      VAL  24   2.920  11.549  -4.209
  184   3HG1  VAL  24          3HG1      VAL  24   1.218  11.781  -3.810
  185   1HG2  VAL  24          1HG2      VAL  24   3.288  10.713  -1.806
  186   2HG2  VAL  24          2HG2      VAL  24   2.770  11.742  -0.470
  187   3HG2  VAL  24          3HG2      VAL  24   1.570  10.979  -1.511
  188    H    ASN  25           H        ASN  25   5.366  13.818  -4.415
  189    HA   ASN  25           HA       ASN  25   5.754  15.543  -5.827
  190   1HB   ASN  25          1HB       ASN  25   3.316  15.210  -6.332
  191   2HB   ASN  25          2HB       ASN  25   2.944  16.458  -5.151
  192   1HD2  ASN  25          2HD2      ASN  25   2.349  16.404  -7.975
  193   2HD2  ASN  25          1HD2      ASN  25   3.105  17.796  -8.664
  194    H    GLU  26           H        GLU  26   3.588  17.455  -3.801
  195    HA   GLU  26           HA       GLU  26   5.901  18.772  -2.559
  196   1HB   GLU  26          1HB       GLU  26   4.772  20.965  -2.870
  197   2HB   GLU  26          2HB       GLU  26   5.249  20.218  -4.391
  198   1HG   GLU  26          1HG       GLU  26   3.059  19.686  -4.961
  199   2HG   GLU  26          2HG       GLU  26   2.487  19.852  -3.302
  200    H    GLN  27           H        GLN  27   3.125  17.102  -2.104
  201    HA   GLN  27           HA       GLN  27   2.085  18.802   0.042
  202   1HB   GLN  27          1HB       GLN  27   0.772  16.411  -1.259
  203   2HB   GLN  27          2HB       GLN  27   0.017  17.564  -0.167
  204   1HG   GLN  27          1HG       GLN  27   0.352  19.336  -1.835
  205   2HG   GLN  27          2HG       GLN  27   1.050  18.149  -2.933
  206   1HE2  GLN  27          2HE2      GLN  27  -1.261  19.826  -3.320
  207   2HE2  GLN  27          1HE2      GLN  27  -2.604  18.759  -3.595
  208    H    ILE  28           H        ILE  28   2.330  18.259   2.085
  209    HA   ILE  28           HA       ILE  28   3.453  15.670   2.775
  210    HB   ILE  28           HB       ILE  28   2.734  18.002   4.566
  211   1HG1  ILE  28          1HG1      ILE  28   5.418  17.097   3.497
  212   2HG1  ILE  28          2HG1      ILE  28   4.538  18.526   2.969
  213   1HG2  ILE  28          1HG2      ILE  28   4.099  16.860   6.251
  214   2HG2  ILE  28          2HG2      ILE  28   2.715  15.881   5.764
  215   3HG2  ILE  28          3HG2      ILE  28   4.324  15.505   5.146
  216   1HD1  ILE  28          1HD1      ILE  28   5.642  18.052   5.728
  217   2HD1  ILE  28          2HD1      ILE  28   6.329  19.109   4.494
  218   3HD1  ILE  28          3HD1      ILE  28   4.759  19.485   5.201
  219    H    LEU  29           H        LEU  29   2.102  14.030   2.940
  220    HA   LEU  29           HA       LEU  29  -0.677  14.526   3.693
  221   1HB   LEU  29          1HB       LEU  29   0.654  12.062   2.567
  222   2HB   LEU  29          2HB       LEU  29  -1.054  12.196   2.937
  223    HG   LEU  29           HG       LEU  29   0.435  13.803   0.857
  224   1HD1  LEU  29          1HD1      LEU  29  -1.605  11.600   0.586
  225   2HD1  LEU  29          2HD1      LEU  29  -0.924  12.543  -0.740
  226   3HD1  LEU  29          3HD1      LEU  29   0.113  11.479   0.210
  227   1HD2  LEU  29          1HD2      LEU  29  -2.493  13.784   1.583
  228   2HD2  LEU  29          2HD2      LEU  29  -1.359  15.102   1.876
  229   3HD2  LEU  29          3HD2      LEU  29  -1.773  14.646   0.223
  230    H    GLN  30           H        GLN  30  -1.639  13.703   5.437
  231    HA   GLN  30           HA       GLN  30  -0.075  11.982   7.253
  232   1HB   GLN  30          1HB       GLN  30  -1.952  14.200   8.107
  233   2HB   GLN  30          2HB       GLN  30  -0.973  13.188   9.160
  234   1HG   GLN  30          1HG       GLN  30   1.055  14.159   8.178
  235   2HG   GLN  30          2HG       GLN  30   0.051  15.206   7.178
  236   1HE2  GLN  30          2HE2      GLN  30  -1.116  16.875   8.160
  237   2HE2  GLN  30          1HE2      GLN  30  -0.711  17.462   9.733
  238    H    GLN  31           H        GLN  31  -1.997  11.400   5.189
  239    HA   GLN  31           HA       GLN  31  -4.262  10.364   6.755
  240   1HB   GLN  31          1HB       GLN  31  -4.152  11.434   3.934
  241   2HB   GLN  31          2HB       GLN  31  -5.494  10.465   4.523
  242   1HG   GLN  31          1HG       GLN  31  -4.641  12.954   5.945
  243   2HG   GLN  31          2HG       GLN  31  -5.715  13.015   4.548
  244   1HE2  GLN  31          2HE2      GLN  31  -7.006  10.510   5.155
  245   2HE2  GLN  31          1HE2      GLN  31  -8.055  10.804   6.499
  246    H    SER  32           H        SER  32  -5.276   8.427   5.719
  247    HA   SER  32           HA       SER  32  -3.322   6.528   4.785
  248   1HB   SER  32          1HB       SER  32  -6.325   6.180   4.886
  249   2HB   SER  32          2HB       SER  32  -5.089   4.923   4.943
  250    HG   SER  32           HG       SER  32  -5.898   5.323   7.017
  251    H    PHE  33           H        PHE  33  -2.773   6.352   2.673
  252    HA   PHE  33           HA       PHE  33  -4.817   6.960   0.670
  253   1HB   PHE  33          1HB       PHE  33  -3.311   8.363  -0.625
  254   2HB   PHE  33          2HB       PHE  33  -3.525   9.033   0.987
  255    HD1  PHE  33           HD1      PHE  33  -1.191   7.598  -1.389
  256    HD2  PHE  33           HD2      PHE  33  -1.698   8.923   2.622
  257    HE1  PHE  33           HE1      PHE  33   1.251   7.674  -1.110
  258    HE2  PHE  33           HE2      PHE  33   0.742   9.002   2.909
  259    HZ   PHE  33           HZ       PHE  33   2.220   8.377   1.042
  260    H    ILE  34           H        ILE  34  -4.351   6.182  -1.435
  261    HA   ILE  34           HA       ILE  34  -2.460   3.916  -1.472
  262    HB   ILE  34           HB       ILE  34  -5.013   4.178  -3.076
  263   1HG1  ILE  34          1HG1      ILE  34  -4.497   2.409  -0.677
  264   2HG1  ILE  34          2HG1      ILE  34  -5.400   3.920  -0.612
  265   1HG2  ILE  34          1HG2      ILE  34  -4.639   1.806  -3.586
  266   2HG2  ILE  34          2HG2      ILE  34  -3.309   2.817  -4.151
  267   3HG2  ILE  34          3HG2      ILE  34  -3.126   1.859  -2.681
  268   1HD1  ILE  34          1HD1      ILE  34  -6.893   2.018  -0.699
  269   2HD1  ILE  34          2HD1      ILE  34  -7.046   2.991  -2.162
  270   3HD1  ILE  34          3HD1      ILE  34  -6.145   1.476  -2.202
  271    H    LEU  35           H        LEU  35  -0.767   4.377  -2.731
  272    HA   LEU  35           HA       LEU  35  -1.161   6.250  -4.958
  273   1HB   LEU  35          1HB       LEU  35   0.491   6.971  -3.339
  274   2HB   LEU  35          2HB       LEU  35   1.347   5.448  -3.483
  275    HG   LEU  35           HG       LEU  35   1.945   5.992  -5.802
  276   1HD1  LEU  35          1HD1      LEU  35   1.519   8.211  -6.705
  277   2HD1  LEU  35          2HD1      LEU  35   0.006   7.373  -6.362
  278   3HD1  LEU  35          3HD1      LEU  35   0.585   8.629  -5.268
  279   1HD2  LEU  35          1HD2      LEU  35   3.514   7.798  -5.311
  280   2HD2  LEU  35          2HD2      LEU  35   2.630   8.168  -3.831
  281   3HD2  LEU  35          3HD2      LEU  35   3.458   6.619  -4.000
  282    H    MET  36           H        MET  36  -1.235   5.478  -6.903
  283    HA   MET  36           HA       MET  36   0.411   3.140  -7.601
  284   1HB   MET  36          1HB       MET  36  -2.341   3.894  -8.615
  285   2HB   MET  36          2HB       MET  36  -1.313   2.712  -9.412
  286   1HG   MET  36          1HG       MET  36  -1.298   1.393  -7.308
  287   2HG   MET  36          2HG       MET  36  -2.459   2.537  -6.638
  288   1HE   MET  36          1HE       MET  36  -4.089   0.497  -6.096
  289   2HE   MET  36          2HE       MET  36  -2.930  -0.632  -6.798
  290   3HE   MET  36          3HE       MET  36  -4.619  -0.677  -7.302
  291    HA   PRO  37           HA       PRO  37   2.571   5.371 -10.747
  292   1HB   PRO  37          1HB       PRO  37   0.994   3.844 -12.784
  293   2HB   PRO  37          2HB       PRO  37   2.730   4.170 -12.721
  294   1HG   PRO  37          1HG       PRO  37   1.760   1.800 -11.980
  295   2HG   PRO  37          2HG       PRO  37   3.113   2.548 -11.115
  296   1HD   PRO  37          1HD       PRO  37   0.290   2.218 -10.279
  297   2HD   PRO  37          2HD       PRO  37   1.755   2.348  -9.287
  298    H    ASP  38           H        ASP  38   1.742   7.402 -10.471
  299    HA   ASP  38           HA       ASP  38   0.977   9.378 -11.262
  300   1HB   ASP  38          1HB       ASP  38   1.304   8.594 -13.536
  301   2HB   ASP  38          2HB       ASP  38  -0.241   7.754 -13.501
  302    H    GLU  39           H        GLU  39  -1.182   6.743 -10.664
  303    HA   GLU  39           HA       GLU  39  -3.403   8.597 -10.228
  304   1HB   GLU  39          1HB       GLU  39  -3.292   5.586 -10.292
  305   2HB   GLU  39          2HB       GLU  39  -4.718   6.481  -9.785
  306   1HG   GLU  39          1HG       GLU  39  -4.550   7.663 -12.046
  307   2HG   GLU  39          2HG       GLU  39  -3.441   6.365 -12.491
  308    H    LEU  40           H        LEU  40  -3.340   9.572  -8.349
  309    HA   LEU  40           HA       LEU  40  -2.500   8.067  -5.973
  310   1HB   LEU  40          1HB       LEU  40  -1.258  10.104  -6.299
  311   2HB   LEU  40          2HB       LEU  40  -2.734  11.029  -6.494
  312    HG   LEU  40           HG       LEU  40  -3.299  10.568  -4.118
  313   1HD1  LEU  40          1HD1      LEU  40  -2.046   8.490  -3.852
  314   2HD1  LEU  40          2HD1      LEU  40  -0.532   9.381  -4.006
  315   3HD1  LEU  40          3HD1      LEU  40  -1.592   9.678  -2.630
  316   1HD2  LEU  40          1HD2      LEU  40  -1.642  12.092  -3.162
  317   2HD2  LEU  40          2HD2      LEU  40  -0.619  11.869  -4.580
  318   3HD2  LEU  40          3HD2      LEU  40  -2.195  12.645  -4.743
  319    H    VAL  41           H        VAL  41  -4.069   7.242  -4.783
  320    HA   VAL  41           HA       VAL  41  -6.648   8.651  -4.645
  321    HB   VAL  41           HB       VAL  41  -5.985   5.859  -3.677
  322   1HG1  VAL  41          1HG1      VAL  41  -8.419   5.585  -3.517
  323   2HG1  VAL  41          2HG1      VAL  41  -7.839   6.878  -2.467
  324   3HG1  VAL  41          3HG1      VAL  41  -8.636   7.270  -3.991
  325   1HG2  VAL  41          1HG2      VAL  41  -7.413   6.731  -6.189
  326   2HG2  VAL  41          2HG2      VAL  41  -5.821   5.978  -6.104
  327   3HG2  VAL  41          3HG2      VAL  41  -7.253   5.067  -5.625
  328    H    GLU  42           H        GLU  42  -6.307  10.224  -3.161
  329    HA   GLU  42           HA       GLU  42  -4.784   9.621  -0.753
  330   1HB   GLU  42          1HB       GLU  42  -5.439  12.235  -0.484
  331   2HB   GLU  42          2HB       GLU  42  -4.011  11.656  -1.328
  332   1HG   GLU  42          1HG       GLU  42  -5.152  13.348  -2.628
  333   2HG   GLU  42          2HG       GLU  42  -5.199  11.792  -3.452
  334    H    HIS  43           H        HIS  43  -7.922   9.361  -1.640
  335    HA   HIS  43           HA       HIS  43  -8.875   9.991   1.065
  336   1HB   HIS  43          1HB       HIS  43 -10.344   9.839  -1.560
  337   2HB   HIS  43          2HB       HIS  43 -11.189   9.797  -0.017
  338    HD1  HIS  43           HD1      HIS  43 -11.115  12.105  -2.364
  339    HD2  HIS  43           HD2      HIS  43  -9.443  12.208   1.449
  340    HE1  HIS  43           HE1      HIS  43 -10.925  14.544  -1.766
  341    HE2  HIS  43           HE2      HIS  43  -9.979  14.583   0.574
  342    H    TRP  44           H        TRP  44  -8.054   8.071   1.947
  343    HA   TRP  44           HA       TRP  44  -9.742   5.737   1.333
  344   1HB   TRP  44          1HB       TRP  44  -7.284   5.487   0.744
  345   2HB   TRP  44          2HB       TRP  44  -6.939   5.617   2.463
  346    HD1  TRP  44           HD1      TRP  44  -9.916   3.568   1.162
  347    HE1  TRP  44           HE1      TRP  44  -9.495   1.085   1.701
  348    HE3  TRP  44           HE3      TRP  44  -5.121   3.919   2.900
  349    HZ2  TRP  44           HZ2      TRP  44  -7.398  -0.511   2.715
  350    HZ3  TRP  44           HZ3      TRP  44  -3.977   1.869   3.628
  351    HH2  TRP  44           HH2      TRP  44  -5.092  -0.301   3.537
  352    HA   PRO  45           HA       PRO  45 -10.939   7.104   5.431
  353   1HB   PRO  45          1HB       PRO  45 -13.344   5.920   5.489
  354   2HB   PRO  45          2HB       PRO  45 -13.022   7.328   4.467
  355   1HG   PRO  45          1HG       PRO  45 -13.112   4.428   3.725
  356   2HG   PRO  45          2HG       PRO  45 -13.792   5.822   2.867
  357   1HD   PRO  45          1HD       PRO  45 -11.417   4.637   2.200
  358   2HD   PRO  45          2HD       PRO  45 -11.791   6.342   1.878
  359    H    VAL  46           H        VAL  46  -9.104   4.922   5.392
  360    HA   VAL  46           HA       VAL  46 -10.324   3.143   7.401
  361    HB   VAL  46           HB       VAL  46  -7.898   2.622   5.668
  362   1HG1  VAL  46          1HG1      VAL  46  -7.663   1.603   7.875
  363   2HG1  VAL  46          2HG1      VAL  46  -9.251   0.852   7.707
  364   3HG1  VAL  46          3HG1      VAL  46  -7.931   0.371   6.641
  365   1HG2  VAL  46          1HG2      VAL  46  -9.289   0.877   4.648
  366   2HG2  VAL  46          2HG2      VAL  46 -10.652   1.389   5.642
  367   3HG2  VAL  46          3HG2      VAL  46  -9.990   2.481   4.426
  368    HA   PRO  47           HA       PRO  47  -7.506   5.404  10.056
  369   1HB   PRO  47          1HB       PRO  47  -8.958   4.522  12.326
  370   2HB   PRO  47          2HB       PRO  47  -9.105   6.076  11.505
  371   1HG   PRO  47          1HG       PRO  47 -11.062   4.082  11.605
  372   2HG   PRO  47          2HG       PRO  47 -11.035   5.462  10.495
  373   1HD   PRO  47          1HD       PRO  47 -10.234   2.630  10.023
  374   2HD   PRO  47          2HD       PRO  47 -10.973   3.799   8.907
  375    H    SER  48           H        SER  48  -5.668   4.155   9.869
  376    HA   SER  48           HA       SER  48  -4.012   2.768  10.556
  377   1HB   SER  48          1HB       SER  48  -4.693   3.604  12.827
  378   2HB   SER  48          2HB       SER  48  -5.758   2.209  12.971
  379    HG   SER  48           HG       SER  48  -2.957   2.337  13.009
  380    H    LEU  49           H        LEU  49  -4.220   0.263  11.943
  381    HA   LEU  49           HA       LEU  49  -5.179  -1.327   9.720
  382   1HB   LEU  49          1HB       LEU  49  -3.821  -2.168  12.279
  383   2HB   LEU  49          2HB       LEU  49  -4.152  -3.214  10.910
  384    HG   LEU  49           HG       LEU  49  -2.281  -0.843  10.929
  385   1HD1  LEU  49          1HD1      LEU  49  -0.544  -2.526  10.617
  386   2HD1  LEU  49          2HD1      LEU  49  -1.421  -2.782  12.125
  387   3HD1  LEU  49          3HD1      LEU  49  -1.756  -3.803  10.727
  388   1HD2  LEU  49          1HD2      LEU  49  -2.921  -2.787   8.712
  389   2HD2  LEU  49          2HD2      LEU  49  -3.396  -1.089   8.768
  390   3HD2  LEU  49          3HD2      LEU  49  -1.691  -1.525   8.663
  391    H    GLY  50           H        GLY  50  -6.680  -0.027  12.276
  392   1HA   GLY  50          1HA       GLY  50  -8.260  -2.314  13.089
  393   2HA   GLY  50          2HA       GLY  50  -8.482  -0.649  13.614
  394    H    GLN  51           H        GLN  51 -10.092  -2.973  12.213
  395    HA   GLN  51           HA       GLN  51 -11.994  -3.064  10.970
  396   1HB   GLN  51          1HB       GLN  51 -12.486  -0.757  11.807
  397   2HB   GLN  51          2HB       GLN  51 -11.633  -0.109  10.413
  398   1HG   GLN  51          1HG       GLN  51 -13.269  -1.301   8.956
  399   2HG   GLN  51          2HG       GLN  51 -14.168  -1.726  10.412
  400   1HE2  GLN  51          2HE2      GLN  51 -13.547   0.841  11.699
  401   2HE2  GLN  51          1HE2      GLN  51 -14.555   2.015  10.922
  402    H    LEU  52           H        LEU  52  -8.971  -2.516   9.944
  403    HA   LEU  52           HA       LEU  52  -9.409  -2.241   7.128
  404   1HB   LEU  52          1HB       LEU  52  -7.310  -1.499   8.113
  405   2HB   LEU  52          2HB       LEU  52  -6.967  -3.127   8.666
  406    HG   LEU  52           HG       LEU  52  -6.800  -3.886   6.329
  407   1HD1  LEU  52          1HD1      LEU  52  -8.321  -2.278   5.310
  408   2HD1  LEU  52          2HD1      LEU  52  -7.178  -0.976   5.642
  409   3HD1  LEU  52          3HD1      LEU  52  -6.747  -2.262   4.513
  410   1HD2  LEU  52          1HD2      LEU  52  -4.792  -3.171   7.501
  411   2HD2  LEU  52          2HD2      LEU  52  -4.700  -2.757   5.789
  412   3HD2  LEU  52          3HD2      LEU  52  -5.066  -1.509   6.980
  413    H    GLN  53           H        GLN  53 -10.697  -3.781   6.366
  414    HA   GLN  53           HA       GLN  53  -9.577  -6.460   6.138
  415   1HB   GLN  53          1HB       GLN  53 -12.361  -5.842   7.154
  416   2HB   GLN  53          2HB       GLN  53 -11.907  -7.412   6.509
  417   1HG   GLN  53          1HG       GLN  53 -10.155  -7.567   8.253
  418   2HG   GLN  53          2HG       GLN  53 -10.758  -6.057   8.936
  419   1HE2  GLN  53          2HE2      GLN  53 -10.611  -8.738  10.088
  420   2HE2  GLN  53          1HE2      GLN  53 -12.230  -9.149  10.545
  421    HA   PRO  54           HA       PRO  54 -10.833  -6.493   1.880
  422   1HB   PRO  54          1HB       PRO  54 -12.972  -8.475   2.554
  423   2HB   PRO  54          2HB       PRO  54 -11.791  -8.500   1.238
  424   1HG   PRO  54          1HG       PRO  54 -11.418 -10.002   3.389
  425   2HG   PRO  54          2HG       PRO  54 -10.054  -9.156   2.635
  426   1HD   PRO  54          1HD       PRO  54 -11.508  -8.537   5.156
  427   2HD   PRO  54          2HD       PRO  54  -9.801  -8.282   4.744
  428    H    ALA  55           H        ALA  55 -13.368  -6.120   4.259
  429    HA   ALA  55           HA       ALA  55 -15.470  -5.236   2.655
  430   1HB   ALA  55          1HB       ALA  55 -15.698  -5.760   5.037
  431   2HB   ALA  55          2HB       ALA  55 -14.755  -4.325   5.441
  432   3HB   ALA  55          3HB       ALA  55 -16.329  -4.157   4.662
  433    H    HIS  56           H        HIS  56 -13.063  -3.228   4.393
  434    HA   HIS  56           HA       HIS  56 -13.788  -0.993   2.644
  435   1HB   HIS  56          1HB       HIS  56 -12.526  -1.170   5.341
  436   2HB   HIS  56          2HB       HIS  56 -12.159   0.227   4.330
  437    HD1  HIS  56           HD1      HIS  56 -14.863  -1.292   6.389
  438    HD2  HIS  56           HD2      HIS  56 -14.371   1.907   3.775
  439    HE1  HIS  56           HE1      HIS  56 -16.900   0.147   6.685
  440    HE2  HIS  56           HE2      HIS  56 -16.687   1.936   4.924
  441    H    MET  57           H        MET  57 -11.657  -3.445   2.667
  442    HA   MET  57           HA       MET  57  -9.518  -1.984   1.318
  443   1HB   MET  57          1HB       MET  57  -9.023  -3.876   2.895
  444   2HB   MET  57          2HB       MET  57  -9.838  -4.963   1.783
  445   1HG   MET  57          1HG       MET  57  -8.173  -4.406   0.060
  446   2HG   MET  57          2HG       MET  57  -7.341  -3.378   1.226
  447   1HE   MET  57          1HE       MET  57  -5.071  -4.721   0.777
  448   2HE   MET  57          2HE       MET  57  -5.922  -5.731  -0.392
  449   3HE   MET  57          3HE       MET  57  -4.950  -6.478   0.877
  450    H    ASP  58           H        ASP  58 -12.493  -2.820   0.580
  451    HA   ASP  58           HA       ASP  58 -12.507  -4.450  -1.655
  452   1HB   ASP  58          1HB       ASP  58 -14.549  -3.736  -0.500
  453   2HB   ASP  58          2HB       ASP  58 -14.307  -2.089  -1.076
  454    H    ALA  59           H        ALA  59 -12.032  -0.947  -1.467
  455    HA   ALA  59           HA       ALA  59 -12.021  -0.350  -4.181
  456   1HB   ALA  59          1HB       ALA  59 -10.341   0.926  -2.024
  457   2HB   ALA  59          2HB       ALA  59 -10.724   1.628  -3.596
  458   3HB   ALA  59          3HB       ALA  59 -12.007   1.350  -2.419
  459    H    VAL  60           H        VAL  60  -9.408  -1.520  -2.118
  460    HA   VAL  60           HA       VAL  60  -7.366  -1.370  -4.091
  461    HB   VAL  60           HB       VAL  60  -7.440  -3.212  -1.693
  462   1HG1  VAL  60          1HG1      VAL  60  -5.136  -2.043  -3.248
  463   2HG1  VAL  60          2HG1      VAL  60  -5.000  -3.056  -1.811
  464   3HG1  VAL  60          3HG1      VAL  60  -5.682  -3.720  -3.296
  465   1HG2  VAL  60          1HG2      VAL  60  -6.483  -0.355  -1.849
  466   2HG2  VAL  60          2HG2      VAL  60  -7.892  -0.938  -0.964
  467   3HG2  VAL  60          3HG2      VAL  60  -6.274  -1.434  -0.469
  468    H    LEU  61           H        LEU  61  -9.530  -3.923  -2.965
  469    HA   LEU  61           HA       LEU  61  -8.400  -5.980  -4.573
  470   1HB   LEU  61          1HB       LEU  61 -11.129  -5.800  -3.297
  471   2HB   LEU  61          2HB       LEU  61 -10.416  -7.255  -3.968
  472    HG   LEU  61           HG       LEU  61  -9.352  -5.722  -1.592
  473   1HD1  LEU  61          1HD1      LEU  61 -11.442  -6.861  -1.092
  474   2HD1  LEU  61          2HD1      LEU  61 -10.796  -8.363  -1.751
  475   3HD1  LEU  61          3HD1      LEU  61 -10.086  -7.662  -0.297
  476   1HD2  LEU  61          1HD2      LEU  61  -8.462  -8.332  -2.819
  477   2HD2  LEU  61          2HD2      LEU  61  -7.571  -6.809  -2.848
  478   3HD2  LEU  61          3HD2      LEU  61  -7.850  -7.638  -1.317
  479    H    ALA  62           H        ALA  62 -10.839  -3.557  -5.100
  480    HA   ALA  62           HA       ALA  62 -12.045  -4.696  -7.399
  481   1HB   ALA  62          1HB       ALA  62 -11.835  -1.792  -6.607
  482   2HB   ALA  62          2HB       ALA  62 -12.946  -2.468  -7.800
  483   3HB   ALA  62          3HB       ALA  62 -13.103  -2.909  -6.100
  484    H    LEU  63           H        LEU  63  -9.415  -2.358  -6.951
  485    HA   LEU  63           HA       LEU  63  -8.841  -2.105  -9.735
  486   1HB   LEU  63          1HB       LEU  63  -7.034  -1.602  -7.363
  487   2HB   LEU  63          2HB       LEU  63  -6.767  -1.033  -8.999
  488    HG   LEU  63           HG       LEU  63  -9.042  -0.184  -7.203
  489   1HD1  LEU  63          1HD1      LEU  63  -6.568   1.297  -8.079
  490   2HD1  LEU  63          2HD1      LEU  63  -7.896   1.969  -7.133
  491   3HD1  LEU  63          3HD1      LEU  63  -6.893   0.685  -6.458
  492   1HD2  LEU  63          1HD2      LEU  63  -8.234   0.784  -9.944
  493   2HD2  LEU  63          2HD2      LEU  63  -9.672  -0.163  -9.559
  494   3HD2  LEU  63          3HD2      LEU  63  -9.504   1.478  -8.936
  495    H    ASN  64           H        ASN  64  -7.718  -4.115  -7.115
  496    HA   ASN  64           HA       ASN  64  -6.578  -6.056  -6.995
  497   1HB   ASN  64          1HB       ASN  64  -8.470  -6.767  -8.451
  498   2HB   ASN  64          2HB       ASN  64  -7.466  -6.440  -9.860
  499   1HD2  ASN  64          2HD2      ASN  64  -7.527  -8.559 -10.549
  500   2HD2  ASN  64          1HD2      ASN  64  -6.665  -9.822  -9.736
  501    HA   PRO  65           HA       PRO  65  -2.828  -4.571  -9.144
  502   1HB   PRO  65          1HB       PRO  65  -1.334  -4.084  -6.984
  503   2HB   PRO  65          2HB       PRO  65  -2.584  -2.949  -7.507
  504   1HG   PRO  65          1HG       PRO  65  -2.630  -4.923  -5.274
  505   2HG   PRO  65          2HG       PRO  65  -3.330  -3.298  -5.352
  506   1HD   PRO  65          1HD       PRO  65  -4.709  -5.700  -5.742
  507   2HD   PRO  65          2HD       PRO  65  -5.284  -4.086  -6.200
  508    H    ALA  66           H        ALA  66  -0.447  -5.328  -8.645
  509    HA   ALA  66           HA       ALA  66  -0.573  -8.241  -8.402
  510   1HB   ALA  66          1HB       ALA  66   1.669  -6.479  -9.389
  511   2HB   ALA  66          2HB       ALA  66   1.630  -8.241  -9.444
  512   3HB   ALA  66          3HB       ALA  66   0.485  -7.304 -10.404
  513    H    VAL  67           H        VAL  67   1.109  -5.432  -7.060
  514    HA   VAL  67           HA       VAL  67   1.769  -7.072  -4.714
  515    HB   VAL  67           HB       VAL  67   3.814  -7.048  -5.991
  516   1HG1  VAL  67          1HG1      VAL  67   3.387  -5.129  -7.411
  517   2HG1  VAL  67          2HG1      VAL  67   3.579  -4.045  -6.033
  518   3HG1  VAL  67          3HG1      VAL  67   4.956  -4.979  -6.619
  519   1HG2  VAL  67          1HG2      VAL  67   3.993  -5.088  -3.707
  520   2HG2  VAL  67          2HG2      VAL  67   4.057  -6.846  -3.581
  521   3HG2  VAL  67          3HG2      VAL  67   5.344  -5.975  -4.414
  522    H    ILE  68           H        ILE  68   1.754  -5.965  -2.748
  523    HA   ILE  68           HA       ILE  68   0.814  -3.175  -2.892
  524    HB   ILE  68           HB       ILE  68  -0.234  -5.292  -1.003
  525   1HG1  ILE  68          1HG1      ILE  68  -1.622  -3.899  -3.304
  526   2HG1  ILE  68          2HG1      ILE  68  -1.048  -5.563  -3.330
  527   1HG2  ILE  68          1HG2      ILE  68  -1.836  -3.561  -0.314
  528   2HG2  ILE  68          2HG2      ILE  68  -0.170  -3.092   0.024
  529   3HG2  ILE  68          3HG2      ILE  68  -1.017  -2.402  -1.361
  530   1HD1  ILE  68          1HD1      ILE  68  -2.602  -6.127  -1.537
  531   2HD1  ILE  68          2HD1      ILE  68  -3.175  -4.460  -1.510
  532   3HD1  ILE  68          3HD1      ILE  68  -3.440  -5.460  -2.938
  533    H    LEU  69           H        LEU  69   2.098  -1.859  -1.822
  534    HA   LEU  69           HA       LEU  69   3.765  -2.906   0.347
  535   1HB   LEU  69          1HB       LEU  69   3.838  -0.262  -1.116
  536   2HB   LEU  69          2HB       LEU  69   4.908  -0.696   0.203
  537    HG   LEU  69           HG       LEU  69   4.773  -2.106  -2.465
  538   1HD1  LEU  69          1HD1      LEU  69   6.827  -0.212  -1.334
  539   2HD1  LEU  69          2HD1      LEU  69   6.971  -1.099  -2.851
  540   3HD1  LEU  69          3HD1      LEU  69   5.718   0.126  -2.661
  541   1HD2  LEU  69          1HD2      LEU  69   6.654  -2.464  -0.135
  542   2HD2  LEU  69          2HD2      LEU  69   5.410  -3.604  -0.648
  543   3HD2  LEU  69          3HD2      LEU  69   6.784  -3.265  -1.702
  544    H    LEU  70           H        LEU  70   2.743  -2.892   2.233
  545    HA   LEU  70           HA       LEU  70   0.707  -0.868   2.748
  546   1HB   LEU  70          1HB       LEU  70   0.195  -3.249   3.156
  547   2HB   LEU  70          2HB       LEU  70   1.484  -3.314   4.341
  548    HG   LEU  70           HG       LEU  70   0.261  -1.644   5.716
  549   1HD1  LEU  70          1HD1      LEU  70  -2.079  -1.171   5.199
  550   2HD1  LEU  70          2HD1      LEU  70  -1.005  -0.561   3.939
  551   3HD1  LEU  70          3HD1      LEU  70  -1.921  -2.044   3.674
  552   1HD2  LEU  70          1HD2      LEU  70  -1.478  -3.185   6.484
  553   2HD2  LEU  70          2HD2      LEU  70  -1.285  -4.135   5.011
  554   3HD2  LEU  70          3HD2      LEU  70   0.041  -4.026   6.169
  555    H    GLY  71           H        GLY  71   1.270   0.928   3.729
  556   1HA   GLY  71          1HA       GLY  71   3.649   0.953   5.449
  557   2HA   GLY  71          2HA       GLY  71   2.833   2.368   4.793
  558    H    THR  72           H        THR  72   3.137   0.272   7.452
  559    HA   THR  72           HA       THR  72   0.588   0.998   8.629
  560    HB   THR  72           HB       THR  72   1.327  -0.417  10.531
  561    HG1  THR  72           HG1      THR  72   3.490  -0.354  10.599
  562   1HG2  THR  72          1HG2      THR  72   1.669  -1.709   7.822
  563   2HG2  THR  72          2HG2      THR  72   1.312  -2.550   9.331
  564   3HG2  THR  72          3HG2      THR  72   0.136  -1.429   8.646
  565    H    GLY  73           H        GLY  73   1.385   3.341   8.402
  566   1HA   GLY  73          1HA       GLY  73   2.141   5.284   9.359
  567   2HA   GLY  73          2HA       GLY  73   1.851   4.471  10.890
  568    H    GLU  74           H        GLU  74   3.555   4.745  12.132
  569    HA   GLU  74           HA       GLU  74   6.232   4.287  10.983
  570   1HB   GLU  74          1HB       GLU  74   5.574   6.628  11.924
  571   2HB   GLU  74          2HB       GLU  74   5.720   5.861  13.497
  572   1HG   GLU  74          1HG       GLU  74   7.762   6.997  12.975
  573   2HG   GLU  74          2HG       GLU  74   8.047   5.256  12.954
  574    H    ARG  75           H        ARG  75   4.287   2.381  12.009
  575    HA   ARG  75           HA       ARG  75   5.924   1.110  14.064
  576   1HB   ARG  75          1HB       ARG  75   4.303   2.262  15.409
  577   2HB   ARG  75          2HB       ARG  75   2.989   1.771  14.352
  578   1HG   ARG  75          1HG       ARG  75   3.389  -0.582  15.044
  579   2HG   ARG  75          2HG       ARG  75   4.584   0.011  16.201
  580   1HD   ARG  75          1HD       ARG  75   2.932   1.221  17.410
  581   2HD   ARG  75          2HD       ARG  75   1.729   0.965  16.148
  582    HE   ARG  75           HE       ARG  75   2.741  -1.458  17.340
  583   1HH1  ARG  75          1HH1      ARG  75   0.354   1.094  17.607
  584   2HH1  ARG  75          2HH1      ARG  75  -0.816   0.093  18.418
  585   1HH2  ARG  75          1HH2      ARG  75   1.236  -2.770  18.424
  586   2HH2  ARG  75          2HH2      ARG  75  -0.308  -2.116  18.881
  587    H    GLN  76           H        GLN  76   6.444  -0.722  12.994
  588    HA   GLN  76           HA       GLN  76   4.816  -1.853  10.969
  589   1HB   GLN  76          1HB       GLN  76   7.300  -2.099  11.107
  590   2HB   GLN  76          2HB       GLN  76   7.076  -3.193  12.466
  591   1HG   GLN  76          1HG       GLN  76   5.907  -4.765  11.076
  592   2HG   GLN  76          2HG       GLN  76   5.939  -3.644   9.716
  593   1HE2  GLN  76          2HE2      GLN  76   6.974  -6.354   9.909
  594   2HE2  GLN  76          1HE2      GLN  76   8.656  -6.251   9.520
  595    H    GLN  77           H        GLN  77   2.942  -2.775  11.326
  596    HA   GLN  77           HA       GLN  77   2.652  -4.654  13.565
  597   1HB   GLN  77          1HB       GLN  77   1.652  -2.544  14.279
  598   2HB   GLN  77          2HB       GLN  77   0.719  -2.452  12.794
  599   1HG   GLN  77          1HG       GLN  77  -0.500  -4.485  13.469
  600   2HG   GLN  77          2HG       GLN  77   0.395  -4.488  14.988
  601   1HE2  GLN  77          2HE2      GLN  77  -2.490  -4.222  14.425
  602   2HE2  GLN  77          1HE2      GLN  77  -2.974  -2.749  15.191
  603    H    PHE  78           H        PHE  78   1.243  -6.387  13.147
  604    HA   PHE  78           HA       PHE  78   0.878  -7.003  10.373
  605   1HB   PHE  78          1HB       PHE  78  -0.068  -9.141  11.192
  606   2HB   PHE  78          2HB       PHE  78   1.503  -8.788  11.899
  607    HD1  PHE  78           HD1      PHE  78  -2.075  -9.144  12.536
  608    HD2  PHE  78           HD2      PHE  78   1.716  -8.261  14.255
  609    HE1  PHE  78           HE1      PHE  78  -3.023  -9.470  14.781
  610    HE2  PHE  78           HE2      PHE  78   0.774  -8.585  16.505
  611    HZ   PHE  78           HZ       PHE  78  -1.597  -9.190  16.771
  612    HA   PRO  79           HA       PRO  79  -3.271  -5.464  10.054
  613   1HB   PRO  79          1HB       PRO  79  -3.719  -7.072   7.704
  614   2HB   PRO  79          2HB       PRO  79  -3.381  -5.344   7.799
  615   1HG   PRO  79          1HG       PRO  79  -1.658  -7.199   6.737
  616   2HG   PRO  79          2HG       PRO  79  -1.156  -5.635   7.402
  617   1HD   PRO  79          1HD       PRO  79  -1.049  -8.351   8.650
  618   2HD   PRO  79          2HD       PRO  79   0.117  -7.014   8.747
  619    H    SER  80           H        SER  80  -5.498  -6.585   9.183
  620    HA   SER  80           HA       SER  80  -6.147  -8.536  11.148
  621   1HB   SER  80          1HB       SER  80  -7.763  -6.834  10.295
  622   2HB   SER  80          2HB       SER  80  -7.779  -7.672   8.745
  623    HG   SER  80           HG       SER  80  -8.510  -8.827  11.240
  624    H    THR  81           H        THR  81  -6.831 -10.696  10.805
  625    HA   THR  81           HA       THR  81  -5.129 -12.239   9.235
  626    HB   THR  81           HB       THR  81  -7.731 -13.475   9.848
  627    HG1  THR  81           HG1      THR  81  -6.094 -12.510  11.992
  628   1HG2  THR  81          1HG2      THR  81  -4.892 -14.070  10.698
  629   2HG2  THR  81          2HG2      THR  81  -6.284 -15.125  10.945
  630   3HG2  THR  81          3HG2      THR  81  -5.723 -14.773   9.310
  631    H    ASP  82           H        ASP  82  -8.345 -10.998   8.587
  632    HA   ASP  82           HA       ASP  82  -8.882 -12.587   6.305
  633   1HB   ASP  82          1HB       ASP  82 -10.063  -9.986   7.281
  634   2HB   ASP  82          2HB       ASP  82 -10.647 -10.824   5.846
  635    H    VAL  83           H        VAL  83  -7.137  -9.615   6.773
  636    HA   VAL  83           HA       VAL  83  -7.106  -8.786   4.045
  637    HB   VAL  83           HB       VAL  83  -5.137  -8.154   6.257
  638   1HG1  VAL  83          1HG1      VAL  83  -4.525  -6.214   4.891
  639   2HG1  VAL  83          2HG1      VAL  83  -4.184  -7.729   4.055
  640   3HG1  VAL  83          3HG1      VAL  83  -5.602  -6.777   3.613
  641   1HG2  VAL  83          1HG2      VAL  83  -6.388  -6.061   6.477
  642   2HG2  VAL  83          2HG2      VAL  83  -7.545  -6.633   5.275
  643   3HG2  VAL  83          3HG2      VAL  83  -7.395  -7.467   6.821
  644    H    LEU  84           H        LEU  84  -4.922 -10.664   6.088
  645    HA   LEU  84           HA       LEU  84  -2.911 -11.094   4.169
  646   1HB   LEU  84          1HB       LEU  84  -3.736 -12.855   6.481
  647   2HB   LEU  84          2HB       LEU  84  -2.232 -12.989   5.592
  648    HG   LEU  84           HG       LEU  84  -3.061 -10.625   7.279
  649   1HD1  LEU  84          1HD1      LEU  84  -2.537 -12.584   8.625
  650   2HD1  LEU  84          2HD1      LEU  84  -1.007 -12.775   7.768
  651   3HD1  LEU  84          3HD1      LEU  84  -1.278 -11.357   8.781
  652   1HD2  LEU  84          1HD2      LEU  84  -1.667  -9.958   5.396
  653   2HD2  LEU  84          2HD2      LEU  84  -0.770  -9.843   6.910
  654   3HD2  LEU  84          3HD2      LEU  84  -0.484 -11.197   5.816
  655    H    ALA  85           H        ALA  85  -5.783 -12.964   5.049
  656    HA   ALA  85           HA       ALA  85  -5.390 -15.116   3.296
  657   1HB   ALA  85          1HB       ALA  85  -7.013 -15.151   5.124
  658   2HB   ALA  85          2HB       ALA  85  -7.998 -13.961   4.274
  659   3HB   ALA  85          3HB       ALA  85  -7.766 -15.568   3.585
  660    H    ALA  86           H        ALA  86  -7.049 -12.016   2.830
  661    HA   ALA  86           HA       ALA  86  -8.104 -12.529   0.283
  662   1HB   ALA  86          1HB       ALA  86  -7.244  -9.880   1.440
  663   2HB   ALA  86          2HB       ALA  86  -8.336 -10.115   0.075
  664   3HB   ALA  86          3HB       ALA  86  -8.811 -10.651   1.686
  665    H    CYS  87           H        CYS  87  -4.931 -11.426   1.293
  666    HA   CYS  87           HA       CYS  87  -4.094 -10.822  -1.394
  667   1HB   CYS  87          1HB       CYS  87  -2.451 -11.079   1.131
  668   2HB   CYS  87          2HB       CYS  87  -1.911 -10.375  -0.391
  669    HG   CYS  87           HG       CYS  87  -4.289  -9.109   1.721
  670    H    LEU  88           H        LEU  88  -3.469 -13.399   0.971
  671    HA   LEU  88           HA       LEU  88  -1.550 -14.782  -0.551
  672   1HB   LEU  88          1HB       LEU  88  -3.421 -15.761   1.598
  673   2HB   LEU  88          2HB       LEU  88  -2.129 -16.728   0.917
  674    HG   LEU  88           HG       LEU  88  -1.775 -14.145   2.442
  675   1HD1  LEU  88          1HD1      LEU  88  -2.467 -15.995   3.867
  676   2HD1  LEU  88          2HD1      LEU  88  -1.175 -16.999   3.207
  677   3HD1  LEU  88          3HD1      LEU  88  -0.780 -15.569   4.161
  678   1HD2  LEU  88          1HD2      LEU  88  -0.062 -14.427   0.733
  679   2HD2  LEU  88          2HD2      LEU  88   0.615 -14.667   2.343
  680   3HD2  LEU  88          3HD2      LEU  88   0.268 -16.058   1.315
  681    H    THR  89           H        THR  89  -5.066 -14.970  -0.531
  682    HA   THR  89           HA       THR  89  -5.313 -17.408  -1.912
  683    HB   THR  89           HB       THR  89  -7.608 -16.492  -2.565
  684    HG1  THR  89           HG1      THR  89  -7.109 -14.488  -0.643
  685   1HG2  THR  89          1HG2      THR  89  -8.467 -16.705  -0.277
  686   2HG2  THR  89          2HG2      THR  89  -7.258 -17.940  -0.628
  687   3HG2  THR  89          3HG2      THR  89  -6.829 -16.539   0.353
  688    H    ARG  90           H        ARG  90  -4.678 -14.167  -3.044
  689    HA   ARG  90           HA       ARG  90  -4.935 -15.080  -5.820
  690   1HB   ARG  90          1HB       ARG  90  -4.844 -12.366  -4.554
  691   2HB   ARG  90          2HB       ARG  90  -4.466 -12.563  -6.260
  692   1HG   ARG  90          1HG       ARG  90  -6.679 -13.660  -6.556
  693   2HG   ARG  90          2HG       ARG  90  -7.049 -13.244  -4.879
  694   1HD   ARG  90          1HD       ARG  90  -7.074 -10.961  -5.324
  695   2HD   ARG  90          2HD       ARG  90  -6.145 -11.144  -6.812
  696    HE   ARG  90           HE       ARG  90  -9.008 -11.527  -6.472
  697   1HH1  ARG  90          1HH1      ARG  90  -6.190 -11.834  -8.524
  698   2HH1  ARG  90          2HH1      ARG  90  -7.113 -11.993  -9.994
  699   1HH2  ARG  90          1HH2      ARG  90 -10.229 -11.680  -8.405
  700   2HH2  ARG  90          2HH2      ARG  90  -9.407 -11.856  -9.928
  701    H    GLY  91           H        GLY  91  -2.612 -14.609  -3.429
  702   1HA   GLY  91          1HA       GLY  91  -0.322 -14.994  -3.569
  703   2HA   GLY  91          2HA       GLY  91  -0.462 -15.023  -5.322
  704    H    ILE  92           H        ILE  92  -1.760 -12.420  -3.421
  705    HA   ILE  92           HA       ILE  92  -0.121 -10.516  -4.841
  706    HB   ILE  92           HB       ILE  92  -2.159 -10.062  -2.650
  707   1HG1  ILE  92          1HG1      ILE  92  -2.420  -9.772  -5.652
  708   2HG1  ILE  92          2HG1      ILE  92  -3.112 -11.076  -4.693
  709   1HG2  ILE  92          1HG2      ILE  92  -0.850  -8.109  -4.542
  710   2HG2  ILE  92          2HG2      ILE  92  -2.154  -7.727  -3.417
  711   3HG2  ILE  92          3HG2      ILE  92  -0.575  -8.223  -2.804
  712   1HD1  ILE  92          1HD1      ILE  92  -4.785  -9.413  -5.252
  713   2HD1  ILE  92          2HD1      ILE  92  -4.509  -9.460  -3.511
  714   3HD1  ILE  92          3HD1      ILE  92  -3.817  -8.159  -4.478
  715    H    GLY  93           H        GLY  93   1.727  -9.660  -4.140
  716   1HA   GLY  93          1HA       GLY  93   2.866 -10.485  -1.646
  717   2HA   GLY  93          2HA       GLY  93   3.583  -9.372  -2.803
  718    H    LEU  94           H        LEU  94   1.764  -9.696   0.091
  719    HA   LEU  94           HA       LEU  94   1.373  -6.802   0.293
  720   1HB   LEU  94          1HB       LEU  94  -0.544  -8.214   0.853
  721   2HB   LEU  94          2HB       LEU  94   0.410  -9.059   2.057
  722    HG   LEU  94           HG       LEU  94   0.629  -6.896   3.302
  723   1HD1  LEU  94          1HD1      LEU  94  -0.936  -5.099   2.766
  724   2HD1  LEU  94          2HD1      LEU  94   0.214  -5.370   1.457
  725   3HD1  LEU  94          3HD1      LEU  94  -1.439  -5.968   1.316
  726   1HD2  LEU  94          1HD2      LEU  94  -1.636  -6.960   4.216
  727   2HD2  LEU  94          2HD2      LEU  94  -2.170  -7.910   2.828
  728   3HD2  LEU  94          3HD2      LEU  94  -0.996  -8.584   3.960
  729    H    GLU  95           H        GLU  95   3.310  -5.931   0.812
  730    HA   GLU  95           HA       GLU  95   4.828  -7.130   3.016
  731   1HB   GLU  95          1HB       GLU  95   5.618  -4.941   1.081
  732   2HB   GLU  95          2HB       GLU  95   6.660  -5.649   2.307
  733   1HG   GLU  95          1HG       GLU  95   5.508  -7.022  -0.109
  734   2HG   GLU  95          2HG       GLU  95   7.197  -6.597   0.174
  735    H    ALA  96           H        ALA  96   4.235  -6.417   4.959
  736    HA   ALA  96           HA       ALA  96   3.196  -3.713   5.271
  737   1HB   ALA  96          1HB       ALA  96   2.005  -5.566   6.342
  738   2HB   ALA  96          2HB       ALA  96   3.444  -5.941   7.290
  739   3HB   ALA  96          3HB       ALA  96   2.605  -4.408   7.530
  740    H    MET  97           H        MET  97   4.592  -2.144   5.558
  741    HA   MET  97           HA       MET  97   6.799  -2.491   7.459
  742   1HB   MET  97          1HB       MET  97   7.079  -1.322   4.676
  743   2HB   MET  97          2HB       MET  97   8.313  -1.240   5.923
  744   1HG   MET  97          1HG       MET  97   8.533  -3.650   5.909
  745   2HG   MET  97          2HG       MET  97   7.234  -3.782   4.726
  746   1HE   MET  97          1HE       MET  97   8.843  -2.075   1.582
  747   2HE   MET  97          2HE       MET  97   7.856  -1.304   2.823
  748   3HE   MET  97          3HE       MET  97   7.422  -2.903   2.219
  749    H    THR  98           H        THR  98   7.863  -0.116   7.664
  750    HA   THR  98           HA       THR  98   5.726   1.646   8.422
  751    HB   THR  98           HB       THR  98   7.569   3.265   8.949
  752    HG1  THR  98           HG1      THR  98   9.679   2.655   8.659
  753   1HG2  THR  98          1HG2      THR  98   8.476   1.974  10.828
  754   2HG2  THR  98          2HG2      THR  98   6.740   1.719  10.646
  755   3HG2  THR  98          3HG2      THR  98   7.875   0.487  10.093
  756    H    ASN  99           H        ASN  99   5.621   3.911   7.658
  757    HA   ASN  99           HA       ASN  99   5.149   4.073   4.924
  758   1HB   ASN  99          1HB       ASN  99   4.887   6.474   5.242
  759   2HB   ASN  99          2HB       ASN  99   4.171   5.614   6.600
  760   1HD2  ASN  99          2HD2      ASN  99   5.256   5.617   8.599
  761   2HD2  ASN  99          1HD2      ASN  99   6.446   6.818   8.992
  762    H    ALA 100           H        ALA 100   8.050   4.889   6.750
  763    HA   ALA 100           HA       ALA 100   9.331   6.133   4.513
  764   1HB   ALA 100          1HB       ALA 100   9.857   6.874   6.756
  765   2HB   ALA 100          2HB       ALA 100  10.465   5.267   7.164
  766   3HB   ALA 100          3HB       ALA 100  11.304   6.249   5.964
  767    H    ALA 101           H        ALA 101   9.084   2.904   5.713
  768    HA   ALA 101           HA       ALA 101  11.379   1.953   4.238
  769   1HB   ALA 101          1HB       ALA 101  10.706   0.853   6.318
  770   2HB   ALA 101          2HB       ALA 101   9.168   0.403   5.582
  771   3HB   ALA 101          3HB       ALA 101  10.675  -0.266   4.956
  772    H    ALA 102           H        ALA 102   7.850   1.800   3.947
  773    HA   ALA 102           HA       ALA 102   7.759   0.280   1.583
  774   1HB   ALA 102          1HB       ALA 102   5.463   1.068   1.369
  775   2HB   ALA 102          2HB       ALA 102   5.817   0.613   3.036
  776   3HB   ALA 102          3HB       ALA 102   5.767   2.316   2.578
  777    H    ALA 103           H        ALA 103   7.892   3.764   2.138
  778    HA   ALA 103           HA       ALA 103   7.622   4.616  -0.518
  779   1HB   ALA 103          1HB       ALA 103   7.431   6.136   1.360
  780   2HB   ALA 103          2HB       ALA 103   9.131   5.891   1.757
  781   3HB   ALA 103          3HB       ALA 103   8.686   6.694   0.252
  782    H    ARG 104           H        ARG 104  10.411   3.494   1.296
  783    HA   ARG 104           HA       ARG 104  12.398   4.297  -0.558
  784   1HB   ARG 104          1HB       ARG 104  12.457   3.286   1.958
  785   2HB   ARG 104          2HB       ARG 104  12.876   1.848   1.038
  786   1HG   ARG 104          1HG       ARG 104  14.907   2.884   1.654
  787   2HG   ARG 104          2HG       ARG 104  14.680   3.207  -0.067
  788   1HD   ARG 104          1HD       ARG 104  13.811   5.427   0.462
  789   2HD   ARG 104          2HD       ARG 104  14.009   5.102   2.183
  790    HE   ARG 104           HE       ARG 104  16.310   5.159   0.328
  791   1HH1  ARG 104          1HH1      ARG 104  14.745   6.106   3.329
  792   2HH1  ARG 104          2HH1      ARG 104  16.099   7.057   3.874
  793   1HH2  ARG 104          1HH2      ARG 104  18.086   6.421   1.064
  794   2HH2  ARG 104          2HH2      ARG 104  17.977   7.230   2.596
  795    H    THR 105           H        THR 105  10.666   1.260  -0.018
  796    HA   THR 105           HA       THR 105  11.911  -0.201  -2.090
  797    HB   THR 105           HB       THR 105   9.172  -0.673  -0.896
  798    HG1  THR 105           HG1      THR 105  11.656  -1.743   0.014
  799   1HG2  THR 105          1HG2      THR 105  11.177  -2.569  -2.126
  800   2HG2  THR 105          2HG2      THR 105   9.635  -3.026  -1.403
  801   3HG2  THR 105          3HG2      THR 105   9.666  -2.041  -2.866
  802    H    TYR 106           H        TYR 106   9.051   1.849  -1.976
  803    HA   TYR 106           HA       TYR 106   7.857   1.100  -4.389
  804   1HB   TYR 106          1HB       TYR 106   6.767   2.506  -2.668
  805   2HB   TYR 106          2HB       TYR 106   7.841   3.834  -3.091
  806    HD1  TYR 106           HD1      TYR 106   5.150   1.653  -4.422
  807    HD2  TYR 106           HD2      TYR 106   7.319   5.286  -4.875
  808    HE1  TYR 106           HE1      TYR 106   3.548   2.391  -6.136
  809    HE2  TYR 106           HE2      TYR 106   5.720   6.033  -6.588
  810    HH   TYR 106           HH       TYR 106   4.122   5.003  -8.186
  811    H    ASN 107           H        ASN 107  10.488   3.335  -3.726
  812    HA   ASN 107           HA       ASN 107  10.562   4.535  -6.291
  813   1HB   ASN 107          1HB       ASN 107  12.404   4.412  -3.948
  814   2HB   ASN 107          2HB       ASN 107  13.055   4.944  -5.492
  815   1HD2  ASN 107          2HD2      ASN 107  10.845   5.668  -2.904
  816   2HD2  ASN 107          1HD2      ASN 107  10.572   7.318  -3.343
  817    H    VAL 108           H        VAL 108  11.581   1.487  -5.128
  818    HA   VAL 108           HA       VAL 108  13.456   1.055  -7.320
  819    HB   VAL 108           HB       VAL 108  12.570  -0.864  -5.155
  820   1HG1  VAL 108          1HG1      VAL 108  14.557  -2.150  -5.787
  821   2HG1  VAL 108          2HG1      VAL 108  13.427  -2.000  -7.132
  822   3HG1  VAL 108          3HG1      VAL 108  14.882  -1.006  -7.088
  823   1HG2  VAL 108          1HG2      VAL 108  14.728  -0.369  -4.096
  824   2HG2  VAL 108          2HG2      VAL 108  15.040   0.858  -5.323
  825   3HG2  VAL 108          3HG2      VAL 108  13.701   1.062  -4.194
  826    H    LEU 109           H        LEU 109  10.376  -0.230  -6.111
  827    HA   LEU 109           HA       LEU 109  10.014  -2.130  -8.172
  828   1HB   LEU 109          1HB       LEU 109   8.011  -0.805  -6.350
  829   2HB   LEU 109          2HB       LEU 109   7.633  -2.144  -7.415
  830    HG   LEU 109           HG       LEU 109   9.589  -2.221  -5.117
  831   1HD1  LEU 109          1HD1      LEU 109   7.263  -2.118  -4.391
  832   2HD1  LEU 109          2HD1      LEU 109   6.868  -3.475  -5.446
  833   3HD1  LEU 109          3HD1      LEU 109   7.958  -3.710  -4.080
  834   1HD2  LEU 109          1HD2      LEU 109  10.284  -3.678  -6.943
  835   2HD2  LEU 109          2HD2      LEU 109   9.703  -4.621  -5.571
  836   3HD2  LEU 109          3HD2      LEU 109   8.677  -4.403  -6.990
  837    H    ALA 110           H        ALA 110   9.496   1.267  -8.062
  838    HA   ALA 110           HA       ALA 110   7.504   1.577 -10.002
  839   1HB   ALA 110          1HB       ALA 110   9.818   3.420  -9.412
  840   2HB   ALA 110          2HB       ALA 110   8.332   3.851 -10.258
  841   3HB   ALA 110          3HB       ALA 110   8.276   3.396  -8.556
  842    H    SER 111           H        SER 111  10.901   0.843 -10.311
  843    HA   SER 111           HA       SER 111  11.079   1.545 -13.084
  844   1HB   SER 111          1HB       SER 111  12.929  -0.106 -11.348
  845   2HB   SER 111          2HB       SER 111  13.307   0.492 -12.966
  846    HG   SER 111           HG       SER 111  13.022   2.620 -12.147
  847    H    GLU 112           H        GLU 112   9.764  -1.096 -11.431
  848    HA   GLU 112           HA       GLU 112  10.254  -3.034 -13.514
  849   1HB   GLU 112          1HB       GLU 112   9.996  -3.757 -11.173
  850   2HB   GLU 112          2HB       GLU 112   8.354  -3.130 -11.161
  851   1HG   GLU 112          1HG       GLU 112   8.402  -5.552 -11.435
  852   2HG   GLU 112          2HG       GLU 112   7.692  -4.749 -12.834
  853    H    GLY 113           H        GLY 113   7.753  -0.786 -12.569
  854   1HA   GLY 113          1HA       GLY 113   6.096   0.134 -13.893
  855   2HA   GLY 113          2HA       GLY 113   6.596  -0.928 -15.199
  856    H    ARG 114           H        ARG 114   6.063  -2.607 -12.327
  857    HA   ARG 114           HA       ARG 114   3.592  -3.718 -13.341
  858   1HB   ARG 114          1HB       ARG 114   5.411  -4.398 -11.051
  859   2HB   ARG 114          2HB       ARG 114   3.790  -5.075 -11.133
  860   1HG   ARG 114          1HG       ARG 114   4.323  -6.015 -13.343
  861   2HG   ARG 114          2HG       ARG 114   5.967  -5.388 -13.188
  862   1HD   ARG 114          1HD       ARG 114   6.413  -6.799 -11.328
  863   2HD   ARG 114          2HD       ARG 114   4.716  -7.259 -11.188
  864    HE   ARG 114           HE       ARG 114   5.286  -8.127 -13.647
  865   1HH1  ARG 114          1HH1      ARG 114   7.055  -8.460 -10.637
  866   2HH1  ARG 114          2HH1      ARG 114   7.716 -10.012 -11.056
  867   1HH2  ARG 114          1HH2      ARG 114   6.165 -10.173 -14.195
  868   2HH2  ARG 114          2HH2      ARG 114   7.208 -10.988 -13.067
  869    H    ARG 115           H        ARG 115   1.702  -3.960 -11.909
  870    HA   ARG 115           HA       ARG 115   1.068  -1.390 -10.798
  871   1HB   ARG 115          1HB       ARG 115  -0.555  -3.920 -11.045
  872   2HB   ARG 115          2HB       ARG 115  -1.177  -2.425 -10.356
  873   1HG   ARG 115          1HG       ARG 115  -0.636  -1.287 -12.505
  874   2HG   ARG 115          2HG       ARG 115  -0.217  -2.864 -13.174
  875   1HD   ARG 115          1HD       ARG 115  -2.902  -2.111 -12.030
  876   2HD   ARG 115          2HD       ARG 115  -2.508  -2.172 -13.748
  877    HE   ARG 115           HE       ARG 115  -1.928  -4.630 -13.152
  878   1HH1  ARG 115          1HH1      ARG 115  -4.583  -2.734 -11.895
  879   2HH1  ARG 115          2HH1      ARG 115  -5.591  -4.110 -11.582
  880   1HH2  ARG 115          1HH2      ARG 115  -3.257  -6.445 -12.794
  881   2HH2  ARG 115          2HH2      ARG 115  -4.849  -6.220 -12.125
  882    H    VAL 116           H        VAL 116   2.325  -1.103  -9.076
  883    HA   VAL 116           HA       VAL 116   1.929  -2.839  -6.759
  884    HB   VAL 116           HB       VAL 116   4.246  -2.340  -7.188
  885   1HG1  VAL 116          1HG1      VAL 116   3.487   0.578  -7.090
  886   2HG1  VAL 116          2HG1      VAL 116   5.130  -0.053  -7.199
  887   3HG1  VAL 116          3HG1      VAL 116   3.992  -0.324  -8.519
  888   1HG2  VAL 116          1HG2      VAL 116   3.604  -2.435  -4.847
  889   2HG2  VAL 116          2HG2      VAL 116   4.904  -1.268  -5.081
  890   3HG2  VAL 116          3HG2      VAL 116   3.248  -0.707  -4.855
  891    H    ALA 117           H        ALA 117   0.626  -2.258  -5.159
  892    HA   ALA 117           HA       ALA 117  -0.582   0.407  -5.247
  893   1HB   ALA 117          1HB       ALA 117  -1.374  -2.030  -3.650
  894   2HB   ALA 117          2HB       ALA 117  -2.260  -0.506  -3.726
  895   3HB   ALA 117          3HB       ALA 117  -2.104  -1.508  -5.168
  896    H    LEU 118           H        LEU 118   0.620   1.858  -4.175
  897    HA   LEU 118           HA       LEU 118   1.977   1.096  -1.722
  898   1HB   LEU 118          1HB       LEU 118   3.052   2.607  -3.373
  899   2HB   LEU 118          2HB       LEU 118   1.790   3.790  -3.083
  900    HG   LEU 118           HG       LEU 118   2.533   3.926  -0.708
  901   1HD1  LEU 118          1HD1      LEU 118   4.819   2.225  -1.689
  902   2HD1  LEU 118          2HD1      LEU 118   4.723   3.019  -0.116
  903   3HD1  LEU 118          3HD1      LEU 118   3.581   1.740  -0.529
  904   1HD2  LEU 118          1HD2      LEU 118   3.271   5.566  -2.347
  905   2HD2  LEU 118          2HD2      LEU 118   4.544   5.235  -1.173
  906   3HD2  LEU 118          3HD2      LEU 118   4.629   4.532  -2.787
  907    H    ALA 119           H        ALA 119   0.208   0.606  -0.415
  908    HA   ALA 119           HA       ALA 119  -1.674   2.772   0.169
  909   1HB   ALA 119          1HB       ALA 119  -1.735  -0.123   1.019
  910   2HB   ALA 119          2HB       ALA 119  -2.989   1.077   1.336
  911   3HB   ALA 119          3HB       ALA 119  -2.643   0.581  -0.319
  912    H    MET 120           H        MET 120  -0.596   4.143   1.491
  913    HA   MET 120           HA       MET 120   0.621   2.960   3.893
  914   1HB   MET 120          1HB       MET 120   1.320   5.533   2.475
  915   2HB   MET 120          2HB       MET 120   1.983   5.050   4.031
  916   1HG   MET 120          1HG       MET 120   2.812   2.959   2.887
  917   2HG   MET 120          2HG       MET 120   2.375   3.728   1.363
  918   1HE   MET 120          1HE       MET 120   3.490   5.995   0.483
  919   2HE   MET 120          2HE       MET 120   4.721   6.884   1.381
  920   3HE   MET 120          3HE       MET 120   3.074   6.791   2.002
  921    H    ILE 121           H        ILE 121  -0.385   3.275   5.685
  922    HA   ILE 121           HA       ILE 121  -2.346   5.415   5.957
  923    HB   ILE 121           HB       ILE 121  -1.610   3.162   7.845
  924   1HG1  ILE 121          1HG1      ILE 121  -4.031   3.479   6.055
  925   2HG1  ILE 121          2HG1      ILE 121  -2.655   2.440   5.703
  926   1HG2  ILE 121          1HG2      ILE 121  -3.667   3.753   9.041
  927   2HG2  ILE 121          2HG2      ILE 121  -2.511   5.085   9.039
  928   3HG2  ILE 121          3HG2      ILE 121  -3.902   5.122   7.954
  929   1HD1  ILE 121          1HD1      ILE 121  -4.520   2.163   8.047
  930   2HD1  ILE 121          2HD1      ILE 121  -4.522   1.172   6.588
  931   3HD1  ILE 121          3HD1      ILE 121  -3.146   1.117   7.689
  932    H    VAL 122           H        VAL 122  -1.352   7.310   6.364
  933    HA   VAL 122           HA       VAL 122   1.072   7.349   7.969
  934    HB   VAL 122           HB       VAL 122  -0.335   9.646   6.595
  935   1HG1  VAL 122          1HG1      VAL 122   2.449   9.430   7.734
  936   2HG1  VAL 122          2HG1      VAL 122   1.806  10.809   6.843
  937   3HG1  VAL 122          3HG1      VAL 122   1.119  10.372   8.407
  938   1HG2  VAL 122          1HG2      VAL 122   0.379   7.968   4.982
  939   2HG2  VAL 122          2HG2      VAL 122   1.380   9.413   4.859
  940   3HG2  VAL 122          3HG2      VAL 122   2.002   7.976   5.671
  941    H    GLY 123           H        GLY 123   1.216   8.069  10.009
  942   1HA   GLY 123          1HA       GLY 123  -0.000   9.982  11.376
  943   2HA   GLY 123          2HA       GLY 123  -1.258   8.753  11.378
  944    H    GLY 124           H        GLY 124  -1.109   8.687  13.645
  945   1HA   GLY 124          1HA       GLY 124   0.250   6.617  14.796
  946   2HA   GLY 124          2HA       GLY 124   1.327   7.998  14.988
  947    H    LEU 125           H        LEU 125   0.139  10.020  15.751
  948    HA   LEU 125           HA       LEU 125  -1.064  11.183  17.262
  949   1HB   LEU 125          1HB       LEU 125  -3.005   8.888  17.014
  950   2HB   LEU 125          2HB       LEU 125  -3.348  10.419  17.797
  951    HG   LEU 125           HG       LEU 125  -2.715  10.050  14.866
  952   1HD1  LEU 125          1HD1      LEU 125  -4.908   9.181  15.460
  953   2HD1  LEU 125          2HD1      LEU 125  -5.304  10.701  16.264
  954   3HD1  LEU 125          3HD1      LEU 125  -5.055  10.665  14.519
  955   1HD2  LEU 125          1HD2      LEU 125  -3.319  12.410  14.658
  956   2HD2  LEU 125          2HD2      LEU 125  -3.510  12.519  16.408
  957   3HD2  LEU 125          3HD2      LEU 125  -1.922  12.196  15.712
  958    H    GLU 126           H        GLU 126   0.340  11.120  18.948
  959    HA   GLU 126           HA       GLU 126  -0.237   9.102  21.022
  960   1HB   GLU 126          1HB       GLU 126   2.314  10.703  20.782
  961   2HB   GLU 126          2HB       GLU 126   2.006   9.339  21.842
  962   1HG   GLU 126          1HG       GLU 126   3.346   8.452  20.176
  963   2HG   GLU 126          2HG       GLU 126   1.718   7.982  19.687
  964    H    HIS 127           H        HIS 127  -1.461  11.775  20.352
  965    HA   HIS 127           HA       HIS 127  -0.538  13.642  22.282
  966   1HB   HIS 127          1HB       HIS 127  -2.545  14.971  21.713
  967   2HB   HIS 127          2HB       HIS 127  -1.612  14.491  20.306
  968    HD1  HIS 127           HD1      HIS 127  -4.956  14.173  21.878
  969    HD2  HIS 127           HD2      HIS 127  -2.903  12.634  18.605
  970    HE1  HIS 127           HE1      HIS 127  -6.701  13.099  20.426
  971    HE2  HIS 127           HE2      HIS 127  -5.471  12.431  18.336
  972    H    HIS 128           H        HIS 128  -2.324  10.857  22.680
  973    HA   HIS 128           HA       HIS 128  -3.883  11.573  24.940
  974   1HB   HIS 128          1HB       HIS 128  -4.083   9.390  23.734
  975   2HB   HIS 128          2HB       HIS 128  -2.512   8.924  24.377
  976    HD1  HIS 128           HD1      HIS 128  -2.431   8.049  26.775
  977    HD2  HIS 128           HD2      HIS 128  -6.175   9.488  25.662
  978    HE1  HIS 128           HE1      HIS 128  -4.002   7.352  28.607
  979    HE2  HIS 128           HE2      HIS 128  -6.193   8.448  28.033
  980    H    HIS 129           H        HIS 129  -0.528  10.987  24.375
  981    HA   HIS 129           HA       HIS 129   0.071  11.852  27.111
  982   1HB   HIS 129          1HB       HIS 129   0.467   9.407  26.979
  983   2HB   HIS 129          2HB       HIS 129   1.551   9.666  25.618
  984    HD1  HIS 129           HD1      HIS 129   1.304  10.319  29.331
  985    HD2  HIS 129           HD2      HIS 129   4.136  10.329  26.287
  986    HE1  HIS 129           HE1      HIS 129   3.530  10.569  30.476
  987    HE2  HIS 129           HE2      HIS 129   5.195  10.817  28.595
  988    H    HIS 130           H        HIS 130   0.271  13.925  26.129
  989    HA   HIS 130           HA       HIS 130   2.756  14.232  24.587
  990   1HB   HIS 130          1HB       HIS 130   0.722  14.388  23.104
  991   2HB   HIS 130          2HB       HIS 130   0.232  15.803  24.029
  992    HD1  HIS 130           HD1      HIS 130   1.529  18.002  23.626
  993    HD2  HIS 130           HD2      HIS 130   2.887  14.782  21.359
  994    HE1  HIS 130           HE1      HIS 130   3.075  18.982  21.901
  995    HE2  HIS 130           HE2      HIS 130   3.783  17.037  20.464
  996    H    HIS 131           H        HIS 131   4.064  15.266  25.938
  997    HA   HIS 131           HA       HIS 131   2.976  17.397  27.625
  998   1HB   HIS 131          1HB       HIS 131   5.115  17.366  28.804
  999   2HB   HIS 131          2HB       HIS 131   4.441  15.745  28.729
 1000    HD1  HIS 131           HD1      HIS 131   7.419  17.719  27.857
 1001    HD2  HIS 131           HD2      HIS 131   5.820  13.999  26.899
 1002    HE1  HIS 131           HE1      HIS 131   9.293  16.425  26.789
 1003    HE2  HIS 131           HE2      HIS 131   8.346  14.127  26.364
 1004    H    HIS 132           H        HIS 132   4.119  19.460  27.726
 1005    HA   HIS 132           HA       HIS 132   4.783  20.386  25.059
 1006   1HB   HIS 132          1HB       HIS 132   3.317  21.702  26.596
 1007   2HB   HIS 132          2HB       HIS 132   4.688  21.916  27.675
 1008    HD1  HIS 132           HD1      HIS 132   2.942  23.533  24.984
 1009    HD2  HIS 132           HD2      HIS 132   6.888  23.407  26.300
 1010    HE1  HIS 132           HE1      HIS 132   4.058  25.550  23.985
 1011    HE2  HIS 132           HE2      HIS 132   6.363  25.579  24.995
  Start of MODEL   19
    1   1H    MET   1          1HT       MET   1  29.248  20.266 -15.454
    2   2H    MET   1          2HT       MET   1  28.367  21.572 -14.824
    3   3H    MET   1          3HT       MET   1  27.562  20.286 -15.578
    4    HA   MET   1           HA       MET   1  29.197  19.972 -13.139
    5   1HB   MET   1          1HB       MET   1  27.224  20.049 -11.812
    6   2HB   MET   1          2HB       MET   1  27.187  21.482 -12.826
    7   1HG   MET   1          1HG       MET   1  25.675  18.948 -13.414
    8   2HG   MET   1          2HG       MET   1  25.001  20.341 -12.574
    9   1HE   MET   1          1HE       MET   1  23.007  20.420 -14.342
   10   2HE   MET   1          2HE       MET   1  23.695  19.027 -15.177
   11   3HE   MET   1          3HE       MET   1  23.255  20.473 -16.088
   12    HA   PRO   2           HA       PRO   2  28.586  15.629 -13.913
   13   1HB   PRO   2          1HB       PRO   2  28.283  14.695 -11.358
   14   2HB   PRO   2          2HB       PRO   2  29.845  15.107 -12.072
   15   1HG   PRO   2          1HG       PRO   2  28.122  16.706 -10.226
   16   2HG   PRO   2          2HG       PRO   2  29.884  16.515 -10.230
   17   1HD   PRO   2          1HD       PRO   2  28.666  18.713 -11.222
   18   2HD   PRO   2          2HD       PRO   2  30.177  18.076 -11.903
   19    H    LEU   3           H        LEU   3  26.735  14.977 -14.803
   20    HA   LEU   3           HA       LEU   3  24.185  15.756 -13.786
   21   1HB   LEU   3          1HB       LEU   3  24.620  15.465 -16.186
   22   2HB   LEU   3          2HB       LEU   3  24.880  13.750 -15.932
   23    HG   LEU   3           HG       LEU   3  22.522  13.529 -15.195
   24   1HD1  LEU   3          1HD1      LEU   3  22.172  15.806 -14.400
   25   2HD1  LEU   3          2HD1      LEU   3  22.313  16.413 -16.051
   26   3HD1  LEU   3          3HD1      LEU   3  20.964  15.366 -15.609
   27   1HD2  LEU   3          1HD2      LEU   3  21.532  13.770 -17.415
   28   2HD2  LEU   3          2HD2      LEU   3  22.895  14.770 -17.919
   29   3HD2  LEU   3          3HD2      LEU   3  23.149  13.073 -17.509
   30    H    ASN   4           H        ASN   4  23.929  14.936 -11.746
   31    HA   ASN   4           HA       ASN   4  23.368  12.053 -11.660
   32   1HB   ASN   4          1HB       ASN   4  25.456  12.473 -10.428
   33   2HB   ASN   4          2HB       ASN   4  24.636  13.679  -9.441
   34   1HD2  ASN   4          2HD2      ASN   4  23.303  13.029  -7.794
   35   2HD2  ASN   4          1HD2      ASN   4  23.191  11.383  -7.266
   36    H    GLN   5           H        GLN   5  21.235  12.028 -11.699
   37    HA   GLN   5           HA       GLN   5  19.649  12.910  -9.536
   38   1HB   GLN   5          1HB       GLN   5  20.146  15.087 -10.869
   39   2HB   GLN   5          2HB       GLN   5  19.090  14.410 -12.099
   40   1HG   GLN   5          1HG       GLN   5  17.320  14.231 -10.314
   41   2HG   GLN   5          2HG       GLN   5  18.384  15.191  -9.287
   42   1HE2  GLN   5          2HE2      GLN   5  15.733  15.805 -10.309
   43   2HE2  GLN   5          1HE2      GLN   5  15.888  17.284 -11.200
   44    H    GLU   6           H        GLU   6  17.157  12.812 -10.497
   45    HA   GLU   6           HA       GLU   6  16.696  10.298 -11.619
   46   1HB   GLU   6          1HB       GLU   6  14.922  12.747 -11.823
   47   2HB   GLU   6          2HB       GLU   6  14.417  11.093 -12.121
   48   1HG   GLU   6          1HG       GLU   6  13.634  11.479  -9.994
   49   2HG   GLU   6          2HG       GLU   6  15.168  10.667  -9.688
   50    H    HIS   7           H        HIS   7  17.739   9.774 -13.444
   51    HA   HIS   7           HA       HIS   7  18.369  11.606 -15.487
   52   1HB   HIS   7          1HB       HIS   7  19.670   9.540 -14.946
   53   2HB   HIS   7          2HB       HIS   7  18.388   8.591 -15.688
   54    HD1  HIS   7           HD1      HIS   7  18.563   8.207 -18.143
   55    HD2  HIS   7           HD2      HIS   7  21.008  11.311 -16.842
   56    HE1  HIS   7           HE1      HIS   7  19.964   8.848 -20.129
   57    HE2  HIS   7           HE2      HIS   7  21.614  10.524 -19.232
   58    HA   PRO   8           HA       PRO   8  14.919   9.420 -18.134
   59   1HB   PRO   8          1HB       PRO   8  13.097   8.406 -16.035
   60   2HB   PRO   8          2HB       PRO   8  13.606   7.647 -17.546
   61   1HG   PRO   8          1HG       PRO   8  14.525   6.784 -15.191
   62   2HG   PRO   8          2HG       PRO   8  15.564   6.822 -16.628
   63   1HD   PRO   8          1HD       PRO   8  15.462   8.719 -14.312
   64   2HD   PRO   8          2HD       PRO   8  16.871   8.080 -15.184
   65    H    ASP   9           H        ASP   9  13.397  10.205 -14.995
   66    HA   ASP   9           HA       ASP   9  12.626  12.829 -15.795
   67   1HB   ASP   9          1HB       ASP   9  11.035  11.049 -16.986
   68   2HB   ASP   9          2HB       ASP   9  10.239  11.075 -15.415
   69    H    TYR  10           H        TYR  10  11.968  14.016 -14.009
   70    HA   TYR  10           HA       TYR  10  12.181  12.675 -11.453
   71   1HB   TYR  10          1HB       TYR  10  11.804  15.067 -10.575
   72   2HB   TYR  10          2HB       TYR  10  13.306  14.728 -11.424
   73    HD1  TYR  10           HD1      TYR  10  10.028  16.404 -11.671
   74    HD2  TYR  10           HD2      TYR  10  13.817  15.781 -13.503
   75    HE1  TYR  10           HE1      TYR  10   9.586  18.271 -13.210
   76    HE2  TYR  10           HE2      TYR  10  13.385  17.645 -15.044
   77    HH   TYR  10           HH       TYR  10  11.569  18.884 -15.959
   78    H    THR  11           H        THR  11  10.557  12.437  -9.949
   79    HA   THR  11           HA       THR  11   7.852  12.792 -11.052
   80    HB   THR  11           HB       THR  11   8.697  10.613  -9.140
   81    HG1  THR  11           HG1      THR  11   9.172  10.886 -11.812
   82   1HG2  THR  11          1HG2      THR  11   6.290  11.111  -9.226
   83   2HG2  THR  11          2HG2      THR  11   6.311  10.890 -10.976
   84   3HG2  THR  11          3HG2      THR  11   6.645   9.525  -9.910
   85    H    TYR  12           H        TYR  12   6.344  13.760  -9.840
   86    HA   TYR  12           HA       TYR  12   7.096  15.094  -7.421
   87   1HB   TYR  12          1HB       TYR  12   4.790  15.974  -7.452
   88   2HB   TYR  12          2HB       TYR  12   5.586  16.164  -9.011
   89    HD1  TYR  12           HD1      TYR  12   4.714  15.130 -10.968
   90    HD2  TYR  12           HD2      TYR  12   3.040  14.194  -7.168
   91    HE1  TYR  12           HE1      TYR  12   2.838  13.996 -12.077
   92    HE2  TYR  12           HE2      TYR  12   1.160  13.058  -8.271
   93    HH   TYR  12           HH       TYR  12   1.171  12.314 -11.621
   94    H    ALA  13           H        ALA  13   6.011  11.998  -8.017
   95    HA   ALA  13           HA       ALA  13   4.144  11.679  -5.892
   96   1HB   ALA  13          1HB       ALA  13   5.675   9.577  -7.416
   97   2HB   ALA  13          2HB       ALA  13   4.270   9.300  -6.387
   98   3HB   ALA  13          3HB       ALA  13   4.106  10.243  -7.868
   99    H    LEU  14           H        LEU  14   4.736  11.941  -3.879
  100    HA   LEU  14           HA       LEU  14   5.683  11.602  -1.863
  101   1HB   LEU  14          1HB       LEU  14   5.364   9.213  -2.527
  102   2HB   LEU  14          2HB       LEU  14   7.014   9.205  -3.118
  103    HG   LEU  14           HG       LEU  14   7.788   9.744  -0.807
  104   1HD1  LEU  14          1HD1      LEU  14   4.901   9.233  -0.102
  105   2HD1  LEU  14          2HD1      LEU  14   6.227   9.429   1.046
  106   3HD1  LEU  14          3HD1      LEU  14   5.742  10.778   0.018
  107   1HD2  LEU  14          1HD2      LEU  14   6.141   7.235  -1.102
  108   2HD2  LEU  14          2HD2      LEU  14   7.801   7.456  -1.653
  109   3HD2  LEU  14          3HD2      LEU  14   7.434   7.494   0.070
  110    H    ARG  15           H        ARG  15   6.861  13.562  -2.248
  111    HA   ARG  15           HA       ARG  15   9.662  13.298  -2.989
  112   1HB   ARG  15          1HB       ARG  15   8.298  15.230  -3.774
  113   2HB   ARG  15          2HB       ARG  15   8.121  15.747  -2.103
  114   1HG   ARG  15          1HG       ARG  15  10.507  16.104  -1.927
  115   2HG   ARG  15          2HG       ARG  15  10.739  15.501  -3.569
  116   1HD   ARG  15          1HD       ARG  15   9.353  17.343  -4.421
  117   2HD   ARG  15          2HD       ARG  15   9.170  17.952  -2.776
  118    HE   ARG  15           HE       ARG  15  11.853  17.847  -3.079
  119   1HH1  ARG  15          1HH1      ARG  15   9.279  19.299  -4.979
  120   2HH1  ARG  15          2HH1      ARG  15  10.303  20.551  -5.616
  121   1HH2  ARG  15          1HH2      ARG  15  13.186  19.475  -3.936
  122   2HH2  ARG  15          2HH2      ARG  15  12.521  20.651  -5.033
  123    H    ALA  16           H        ALA  16   7.654  13.569  -0.206
  124    HA   ALA  16           HA       ALA  16  10.010  13.291   1.519
  125   1HB   ALA  16          1HB       ALA  16   7.652  15.083   2.119
  126   2HB   ALA  16          2HB       ALA  16   9.028  14.781   3.181
  127   3HB   ALA  16          3HB       ALA  16   9.263  15.633   1.654
  128    H    ALA  17           H        ALA  17   9.725  11.791   3.168
  129    HA   ALA  17           HA       ALA  17   7.092  10.524   3.362
  130   1HB   ALA  17          1HB       ALA  17   8.286   9.349   1.581
  131   2HB   ALA  17          2HB       ALA  17   9.609   9.005   2.697
  132   3HB   ALA  17          3HB       ALA  17   8.013   8.308   2.979
  133    H    ASP  18           H        ASP  18   6.611  10.468   5.413
  134    HA   ASP  18           HA       ASP  18   8.481   9.212   7.289
  135   1HB   ASP  18          1HB       ASP  18   6.908  11.745   7.845
  136   2HB   ASP  18          2HB       ASP  18   7.671  10.771   9.092
  137    H    GLY  19           H        GLY  19   7.152   8.615   9.359
  138   1HA   GLY  19          1HA       GLY  19   4.769   7.251   8.492
  139   2HA   GLY  19          2HA       GLY  19   5.449   7.244  10.113
  140    H    ARG  20           H        ARG  20   5.394  10.342   9.644
  141    HA   ARG  20           HA       ARG  20   2.539  10.766  10.195
  142   1HB   ARG  20          1HB       ARG  20   3.227  12.398  11.980
  143   2HB   ARG  20          2HB       ARG  20   3.557  10.715  12.366
  144   1HG   ARG  20          1HG       ARG  20   5.892  11.016  11.763
  145   2HG   ARG  20          2HG       ARG  20   5.572  12.695  11.328
  146   1HD   ARG  20          1HD       ARG  20   5.067  13.263  13.581
  147   2HD   ARG  20          2HD       ARG  20   5.061  11.569  14.071
  148    HE   ARG  20           HE       ARG  20   7.527  11.670  13.362
  149   1HH1  ARG  20          1HH1      ARG  20   5.757  14.345  14.779
  150   2HH1  ARG  20          2HH1      ARG  20   7.156  15.035  15.543
  151   1HH2  ARG  20          1HH2      ARG  20   9.371  12.593  14.367
  152   2HH2  ARG  20          2HH2      ARG  20   9.198  14.039  15.310
  153    H    HIS  21           H        HIS  21   4.377  11.209   7.897
  154    HA   HIS  21           HA       HIS  21   3.640  13.890   7.233
  155   1HB   HIS  21          1HB       HIS  21   5.551  14.451   8.612
  156   2HB   HIS  21          2HB       HIS  21   6.527  13.238   7.804
  157    HD1  HIS  21           HD1      HIS  21   8.157  14.220   6.286
  158    HD2  HIS  21           HD2      HIS  21   4.676  16.494   6.480
  159    HE1  HIS  21           HE1      HIS  21   8.543  16.186   4.764
  160    HE2  HIS  21           HE2      HIS  21   6.508  17.646   5.048
  161    H    ALA  22           H        ALA  22   3.760  14.230   5.064
  162    HA   ALA  22           HA       ALA  22   5.347  12.697   3.273
  163   1HB   ALA  22          1HB       ALA  22   2.385  12.090   3.298
  164   2HB   ALA  22          2HB       ALA  22   3.553  11.509   2.111
  165   3HB   ALA  22          3HB       ALA  22   3.666  10.982   3.790
  166    H    LYS  23           H        LYS  23   5.394  13.665   1.247
  167    HA   LYS  23           HA       LYS  23   3.389  15.736   0.719
  168   1HB   LYS  23          1HB       LYS  23   5.294  16.940   1.648
  169   2HB   LYS  23          2HB       LYS  23   6.376  16.160   0.502
  170   1HG   LYS  23          1HG       LYS  23   5.194  17.264  -1.349
  171   2HG   LYS  23          2HG       LYS  23   4.144  18.070  -0.182
  172   1HD   LYS  23          1HD       LYS  23   7.144  18.349  -0.174
  173   2HD   LYS  23          2HD       LYS  23   6.076  19.437  -1.061
  174   1HE   LYS  23          1HE       LYS  23   5.851  18.921   1.899
  175   2HE   LYS  23          2HE       LYS  23   6.793  20.241   1.209
  176   1HZ   LYS  23          1HZ       LYS  23   4.777  21.112   0.196
  177   2HZ   LYS  23          2HZ       LYS  23   3.868  19.842   0.848
  178   3HZ   LYS  23          3HZ       LYS  23   4.593  20.979   1.875
  179    H    VAL  24           H        VAL  24   2.460  15.235  -1.112
  180    HA   VAL  24           HA       VAL  24   4.092  14.092  -3.284
  181    HB   VAL  24           HB       VAL  24   1.076  14.080  -2.980
  182   1HG1  VAL  24          1HG1      VAL  24   1.093  12.567  -4.907
  183   2HG1  VAL  24          2HG1      VAL  24   1.771  14.143  -5.315
  184   3HG1  VAL  24          3HG1      VAL  24   2.840  12.767  -5.046
  185   1HG2  VAL  24          1HG2      VAL  24   2.160  12.595  -1.374
  186   2HG2  VAL  24          2HG2      VAL  24   1.312  11.671  -2.614
  187   3HG2  VAL  24          3HG2      VAL  24   3.067  11.832  -2.680
  188    H    ASN  25           H        ASN  25   4.735  15.547  -4.697
  189    HA   ASN  25           HA       ASN  25   4.937  17.443  -5.919
  190   1HB   ASN  25          1HB       ASN  25   2.792  16.697  -6.929
  191   2HB   ASN  25          2HB       ASN  25   1.922  17.619  -5.710
  192   1HD2  ASN  25          2HD2      ASN  25   0.941  19.043  -7.027
  193   2HD2  ASN  25          1HD2      ASN  25   1.779  20.219  -7.983
  194    H    GLU  26           H        GLU  26   2.076  18.613  -4.218
  195    HA   GLU  26           HA       GLU  26   3.805  20.435  -2.667
  196   1HB   GLU  26          1HB       GLU  26   1.080  21.016  -3.848
  197   2HB   GLU  26          2HB       GLU  26   1.990  22.109  -2.816
  198   1HG   GLU  26          1HG       GLU  26   3.670  22.399  -4.472
  199   2HG   GLU  26          2HG       GLU  26   2.990  21.110  -5.467
  200    H    GLN  27           H        GLN  27   1.124  18.261  -2.733
  201    HA   GLN  27           HA       GLN  27  -0.157  19.264  -0.375
  202   1HB   GLN  27          1HB       GLN  27  -0.626  16.756  -1.990
  203   2HB   GLN  27          2HB       GLN  27  -1.664  17.320  -0.685
  204   1HG   GLN  27          1HG       GLN  27  -1.074  18.835  -3.217
  205   2HG   GLN  27          2HG       GLN  27  -2.540  17.909  -2.893
  206   1HE2  GLN  27          2HE2      GLN  27  -2.037  20.802  -3.406
  207   2HE2  GLN  27          1HE2      GLN  27  -2.800  21.622  -2.083
  208    H    ILE  28           H        ILE  28   0.314  18.821   1.634
  209    HA   ILE  28           HA       ILE  28   1.977  16.548   2.332
  210    HB   ILE  28           HB       ILE  28   0.680  18.648   4.084
  211   1HG1  ILE  28          1HG1      ILE  28   3.544  18.289   3.168
  212   2HG1  ILE  28          2HG1      ILE  28   2.432  19.542   2.622
  213   1HG2  ILE  28          1HG2      ILE  28   2.689  16.513   4.804
  214   2HG2  ILE  28          2HG2      ILE  28   2.126  17.799   5.871
  215   3HG2  ILE  28          3HG2      ILE  28   1.000  16.565   5.307
  216   1HD1  ILE  28          1HD1      ILE  28   4.013  20.403   4.249
  217   2HD1  ILE  28          2HD1      ILE  28   2.364  20.467   4.874
  218   3HD1  ILE  28          3HD1      ILE  28   3.469  19.207   5.426
  219    H    LEU  29           H        LEU  29   1.055  14.631   2.438
  220    HA   LEU  29           HA       LEU  29  -1.772  14.400   3.076
  221   1HB   LEU  29          1HB       LEU  29   0.230  12.316   2.196
  222   2HB   LEU  29          2HB       LEU  29  -1.490  12.041   2.409
  223    HG   LEU  29           HG       LEU  29  -0.262  13.926   0.393
  224   1HD1  LEU  29          1HD1      LEU  29  -1.566  11.235   0.030
  225   2HD1  LEU  29          2HD1      LEU  29  -1.041  12.310  -1.267
  226   3HD1  LEU  29          3HD1      LEU  29   0.148  11.601  -0.175
  227   1HD2  LEU  29          1HD2      LEU  29  -3.131  13.096   0.813
  228   2HD2  LEU  29          2HD2      LEU  29  -2.449  14.683   1.173
  229   3HD2  LEU  29          3HD2      LEU  29  -2.528  14.114  -0.495
  230    H    GLN  30           H        GLN  30  -2.500  13.857   4.989
  231    HA   GLN  30           HA       GLN  30  -0.593  12.832   6.999
  232   1HB   GLN  30          1HB       GLN  30  -3.006  14.605   7.450
  233   2HB   GLN  30          2HB       GLN  30  -1.857  14.078   8.672
  234   1HG   GLN  30          1HG       GLN  30  -0.144  15.427   7.791
  235   2HG   GLN  30          2HG       GLN  30  -1.036  15.721   6.299
  236   1HE2  GLN  30          2HE2      GLN  30  -2.764  17.162   6.312
  237   2HE2  GLN  30          1HE2      GLN  30  -2.964  18.329   7.573
  238    H    GLN  31           H        GLN  31  -2.630  11.592   5.085
  239    HA   GLN  31           HA       GLN  31  -4.281  10.192   7.082
  240   1HB   GLN  31          1HB       GLN  31  -5.027  10.834   4.215
  241   2HB   GLN  31          2HB       GLN  31  -6.028   9.971   5.369
  242   1HG   GLN  31          1HG       GLN  31  -6.906  12.135   5.275
  243   2HG   GLN  31          2HG       GLN  31  -5.985  12.075   6.776
  244   1HE2  GLN  31          2HE2      GLN  31  -5.741  14.298   6.852
  245   2HE2  GLN  31          1HE2      GLN  31  -4.687  15.157   5.780
  246    H    SER  32           H        SER  32  -5.181   8.081   5.959
  247    HA   SER  32           HA       SER  32  -2.930   6.564   4.970
  248   1HB   SER  32          1HB       SER  32  -5.816   5.687   5.271
  249   2HB   SER  32          2HB       SER  32  -4.396   4.648   5.138
  250    HG   SER  32           HG       SER  32  -5.454   5.377   7.333
  251    H    PHE  33           H        PHE  33  -2.399   6.993   2.874
  252    HA   PHE  33           HA       PHE  33  -4.639   7.317   0.994
  253   1HB   PHE  33          1HB       PHE  33  -3.225   8.763  -0.355
  254   2HB   PHE  33          2HB       PHE  33  -3.348   9.378   1.286
  255    HD1  PHE  33           HD1      PHE  33  -1.418   9.313   2.783
  256    HD2  PHE  33           HD2      PHE  33  -1.144   7.992  -1.253
  257    HE1  PHE  33           HE1      PHE  33   1.034   9.448   2.908
  258    HE2  PHE  33           HE2      PHE  33   1.308   8.121  -1.133
  259    HZ   PHE  33           HZ       PHE  33   2.401   8.852   0.950
  260    H    ILE  34           H        ILE  34  -4.634   6.324  -0.933
  261    HA   ILE  34           HA       ILE  34  -2.675   4.173  -1.316
  262    HB   ILE  34           HB       ILE  34  -5.254   4.666  -2.825
  263   1HG1  ILE  34          1HG1      ILE  34  -4.757   2.709  -0.570
  264   2HG1  ILE  34          2HG1      ILE  34  -5.604   4.241  -0.383
  265   1HG2  ILE  34          1HG2      ILE  34  -3.473   2.235  -2.652
  266   2HG2  ILE  34          2HG2      ILE  34  -4.998   2.334  -3.533
  267   3HG2  ILE  34          3HG2      ILE  34  -3.623   3.317  -4.036
  268   1HD1  ILE  34          1HD1      ILE  34  -7.324   3.486  -1.932
  269   2HD1  ILE  34          2HD1      ILE  34  -6.471   1.955  -2.137
  270   3HD1  ILE  34          3HD1      ILE  34  -7.154   2.381  -0.568
  271    H    LEU  35           H        LEU  35  -0.951   4.816  -2.462
  272    HA   LEU  35           HA       LEU  35  -1.364   6.724  -4.659
  273   1HB   LEU  35          1HB       LEU  35   0.255   7.430  -2.972
  274   2HB   LEU  35          2HB       LEU  35   1.165   5.949  -3.201
  275    HG   LEU  35           HG       LEU  35   1.643   6.651  -5.542
  276   1HD1  LEU  35          1HD1      LEU  35   0.367   9.246  -4.685
  277   2HD1  LEU  35          2HD1      LEU  35   1.241   8.971  -6.192
  278   3HD1  LEU  35          3HD1      LEU  35  -0.274   8.122  -5.883
  279   1HD2  LEU  35          1HD2      LEU  35   2.481   8.585  -3.386
  280   2HD2  LEU  35          2HD2      LEU  35   3.263   7.055  -3.779
  281   3HD2  LEU  35          3HD2      LEU  35   3.278   8.377  -4.946
  282    H    MET  36           H        MET  36  -1.634   5.778  -6.533
  283    HA   MET  36           HA       MET  36   0.253   3.649  -7.291
  284   1HB   MET  36          1HB       MET  36  -2.622   3.998  -8.190
  285   2HB   MET  36          2HB       MET  36  -1.496   2.842  -8.887
  286   1HG   MET  36          1HG       MET  36  -1.300   1.728  -6.720
  287   2HG   MET  36          2HG       MET  36  -2.436   2.883  -6.028
  288   1HE   MET  36          1HE       MET  36  -1.922  -0.088  -8.506
  289   2HE   MET  36          2HE       MET  36  -2.562   1.139  -9.599
  290   3HE   MET  36          3HE       MET  36  -3.528  -0.284  -9.207
  291    HA   PRO  37           HA       PRO  37   1.772   6.491 -10.274
  292   1HB   PRO  37          1HB       PRO  37   1.954   4.235 -12.186
  293   2HB   PRO  37          2HB       PRO  37   3.222   5.305 -11.579
  294   1HG   PRO  37          1HG       PRO  37   3.048   2.785 -10.733
  295   2HG   PRO  37          2HG       PRO  37   3.491   4.093  -9.620
  296   1HD   PRO  37          1HD       PRO  37   0.863   2.691  -9.949
  297   2HD   PRO  37          2HD       PRO  37   1.690   3.201  -8.461
  298    H    ASP  38           H        ASP  38  -0.638   7.163 -10.319
  299    HA   ASP  38           HA       ASP  38  -1.152   8.229 -12.780
  300   1HB   ASP  38          1HB       ASP  38  -1.686   5.931 -13.572
  301   2HB   ASP  38          2HB       ASP  38  -2.961   5.832 -12.359
  302    H    GLU  39           H        GLU  39  -2.820   6.740 -10.028
  303    HA   GLU  39           HA       GLU  39  -4.362   9.227  -9.702
  304   1HB   GLU  39          1HB       GLU  39  -5.327   6.383  -9.384
  305   2HB   GLU  39          2HB       GLU  39  -6.218   7.779  -8.801
  306   1HG   GLU  39          1HG       GLU  39  -6.385   8.630 -11.082
  307   2HG   GLU  39          2HG       GLU  39  -5.481   7.234 -11.668
  308    H    LEU  40           H        LEU  40  -5.052   9.689  -7.539
  309    HA   LEU  40           HA       LEU  40  -3.498   8.335  -5.442
  310   1HB   LEU  40          1HB       LEU  40  -2.403  10.444  -5.932
  311   2HB   LEU  40          2HB       LEU  40  -3.926  11.302  -5.805
  312    HG   LEU  40           HG       LEU  40  -4.017  10.752  -3.397
  313   1HD1  LEU  40          1HD1      LEU  40  -2.019   9.864  -2.295
  314   2HD1  LEU  40          2HD1      LEU  40  -2.722   8.700  -3.418
  315   3HD1  LEU  40          3HD1      LEU  40  -1.275   9.598  -3.871
  316   1HD2  LEU  40          1HD2      LEU  40  -3.071  12.871  -4.145
  317   2HD2  LEU  40          2HD2      LEU  40  -2.249  12.282  -2.699
  318   3HD2  LEU  40          3HD2      LEU  40  -1.480  12.121  -4.279
  319    H    VAL  41           H        VAL  41  -4.784   7.529  -3.921
  320    HA   VAL  41           HA       VAL  41  -7.415   8.798  -3.507
  321    HB   VAL  41           HB       VAL  41  -6.678   5.928  -2.896
  322   1HG1  VAL  41          1HG1      VAL  41  -9.086   5.613  -2.597
  323   2HG1  VAL  41          2HG1      VAL  41  -8.448   6.811  -1.470
  324   3HG1  VAL  41          3HG1      VAL  41  -9.349   7.332  -2.893
  325   1HG2  VAL  41          1HG2      VAL  41  -8.065   5.329  -4.827
  326   2HG2  VAL  41          2HG2      VAL  41  -8.276   7.040  -5.203
  327   3HG2  VAL  41          3HG2      VAL  41  -6.675   6.306  -5.304
  328    H    GLU  42           H        GLU  42  -6.579  10.290  -1.992
  329    HA   GLU  42           HA       GLU  42  -5.400   9.219   0.451
  330   1HB   GLU  42          1HB       GLU  42  -4.880  11.452   1.035
  331   2HB   GLU  42          2HB       GLU  42  -4.582  11.338  -0.691
  332   1HG   GLU  42          1HG       GLU  42  -6.923  12.640   0.680
  333   2HG   GLU  42          2HG       GLU  42  -5.639  13.426  -0.233
  334    H    HIS  43           H        HIS  43  -8.414   9.663  -0.767
  335    HA   HIS  43           HA       HIS  43  -9.675  10.577   1.689
  336   1HB   HIS  43          1HB       HIS  43 -10.300  11.361  -0.676
  337   2HB   HIS  43          2HB       HIS  43 -11.045   9.782  -0.881
  338    HD1  HIS  43           HD1      HIS  43 -13.446   9.684  -0.304
  339    HD2  HIS  43           HD2      HIS  43 -11.495  12.793   1.661
  340    HE1  HIS  43           HE1      HIS  43 -15.242  10.956   0.912
  341    HE2  HIS  43           HE2      HIS  43 -14.064  12.917   1.971
  342    H    TRP  44           H        TRP  44  -8.380   8.208   1.965
  343    HA   TRP  44           HA       TRP  44 -10.443   6.113   1.876
  344   1HB   TRP  44          1HB       TRP  44  -8.220   5.691   0.782
  345   2HB   TRP  44          2HB       TRP  44  -7.469   5.817   2.366
  346    HD1  TRP  44           HD1      TRP  44 -10.679   3.830   1.472
  347    HE1  TRP  44           HE1      TRP  44 -10.272   1.357   2.080
  348    HE3  TRP  44           HE3      TRP  44  -5.780   4.145   2.908
  349    HZ2  TRP  44           HZ2      TRP  44  -8.151  -0.240   3.031
  350    HZ3  TRP  44           HZ3      TRP  44  -4.635   2.095   3.649
  351    HH2  TRP  44           HH2      TRP  44  -5.798  -0.050   3.709
  352    HA   PRO  45           HA       PRO  45 -10.629   7.214   6.204
  353   1HB   PRO  45          1HB       PRO  45 -13.113   6.352   6.671
  354   2HB   PRO  45          2HB       PRO  45 -12.803   7.771   5.664
  355   1HG   PRO  45          1HG       PRO  45 -13.523   4.992   4.857
  356   2HG   PRO  45          2HG       PRO  45 -14.018   6.535   4.141
  357   1HD   PRO  45          1HD       PRO  45 -11.981   4.868   3.196
  358   2HD   PRO  45          2HD       PRO  45 -12.222   6.568   2.752
  359    H    VAL  46           H        VAL  46  -8.926   5.325   6.278
  360    HA   VAL  46           HA       VAL  46 -10.092   3.307   8.079
  361    HB   VAL  46           HB       VAL  46  -7.801   2.896   6.143
  362   1HG1  VAL  46          1HG1      VAL  46  -8.900   1.012   8.232
  363   2HG1  VAL  46          2HG1      VAL  46  -7.681   0.612   7.021
  364   3HG1  VAL  46          3HG1      VAL  46  -7.322   1.800   8.274
  365   1HG2  VAL  46          1HG2      VAL  46 -10.514   1.590   6.343
  366   2HG2  VAL  46          2HG2      VAL  46 -10.004   2.746   5.112
  367   3HG2  VAL  46          3HG2      VAL  46  -9.247   1.154   5.197
  368    HA   PRO  47           HA       PRO  47  -7.277   5.428  10.854
  369   1HB   PRO  47          1HB       PRO  47  -8.366   3.601  12.866
  370   2HB   PRO  47          2HB       PRO  47  -8.470   5.361  12.784
  371   1HG   PRO  47          1HG       PRO  47 -10.613   3.764  12.377
  372   2HG   PRO  47          2HG       PRO  47 -10.412   5.322  11.552
  373   1HD   PRO  47          1HD       PRO  47  -9.908   2.553  10.524
  374   2HD   PRO  47          2HD       PRO  47 -10.665   3.939   9.708
  375    H    SER  48           H        SER  48  -5.499   4.403   9.791
  376    HA   SER  48           HA       SER  48  -3.707   3.060   9.574
  377   1HB   SER  48          1HB       SER  48  -2.539   2.499  11.702
  378   2HB   SER  48          2HB       SER  48  -3.055   4.182  11.606
  379    HG   SER  48           HG       SER  48  -5.053   3.098  12.734
  380    H    LEU  49           H        LEU  49  -4.134   1.105  12.340
  381    HA   LEU  49           HA       LEU  49  -5.007  -1.126  10.622
  382   1HB   LEU  49          1HB       LEU  49  -2.488  -0.778  11.745
  383   2HB   LEU  49          2HB       LEU  49  -3.281  -1.889  12.843
  384    HG   LEU  49           HG       LEU  49  -1.977  -3.074  11.147
  385   1HD1  LEU  49          1HD1      LEU  49  -3.689  -4.619  10.379
  386   2HD1  LEU  49          2HD1      LEU  49  -3.969  -4.152  12.057
  387   3HD1  LEU  49          3HD1      LEU  49  -4.943  -3.441  10.769
  388   1HD2  LEU  49          1HD2      LEU  49  -2.665  -3.034   8.798
  389   2HD2  LEU  49          2HD2      LEU  49  -3.842  -1.773   9.168
  390   3HD2  LEU  49          3HD2      LEU  49  -2.118  -1.450   9.347
  391    H    GLY  50           H        GLY  50  -6.506   0.626  12.454
  392   1HA   GLY  50          1HA       GLY  50  -7.104  -0.794  14.842
  393   2HA   GLY  50          2HA       GLY  50  -8.115   0.434  14.092
  394    H    GLN  51           H        GLN  51  -8.160  -1.128  11.558
  395    HA   GLN  51           HA       GLN  51  -9.919  -3.345  12.373
  396   1HB   GLN  51          1HB       GLN  51 -10.451  -1.373  10.143
  397   2HB   GLN  51          2HB       GLN  51 -11.432  -2.779  10.515
  398   1HG   GLN  51          1HG       GLN  51 -12.102  -1.819  12.609
  399   2HG   GLN  51          2HG       GLN  51 -11.002  -0.457  12.377
  400   1HE2  GLN  51          2HE2      GLN  51 -13.921  -0.514  12.712
  401   2HE2  GLN  51          1HE2      GLN  51 -14.565   0.295  11.321
  402    H    LEU  52           H        LEU  52  -8.788  -1.879   9.362
  403    HA   LEU  52           HA       LEU  52  -8.149  -2.751   7.387
  404   1HB   LEU  52          1HB       LEU  52  -6.108  -3.149   8.843
  405   2HB   LEU  52          2HB       LEU  52  -6.651  -4.811   8.999
  406    HG   LEU  52           HG       LEU  52  -6.481  -5.104   6.566
  407   1HD1  LEU  52          1HD1      LEU  52  -5.461  -3.386   5.181
  408   2HD1  LEU  52          2HD1      LEU  52  -6.949  -2.789   5.917
  409   3HD1  LEU  52          3HD1      LEU  52  -5.383  -2.295   6.564
  410   1HD2  LEU  52          1HD2      LEU  52  -4.046  -5.043   6.399
  411   2HD2  LEU  52          2HD2      LEU  52  -3.969  -3.997   7.817
  412   3HD2  LEU  52          3HD2      LEU  52  -4.560  -5.651   7.973
  413    H    GLN  53           H        GLN  53 -10.590  -3.554   8.248
  414    HA   GLN  53           HA       GLN  53 -10.936  -6.375   7.780
  415   1HB   GLN  53          1HB       GLN  53 -12.428  -5.150   9.305
  416   2HB   GLN  53          2HB       GLN  53 -12.947  -4.119   7.980
  417   1HG   GLN  53          1HG       GLN  53 -13.917  -6.070   6.857
  418   2HG   GLN  53          2HG       GLN  53 -13.421  -7.082   8.214
  419   1HE2  GLN  53          2HE2      GLN  53 -14.517  -6.934  10.157
  420   2HE2  GLN  53          1HE2      GLN  53 -16.032  -6.116  10.306
  421    HA   PRO  54           HA       PRO  54 -10.924  -6.423   3.356
  422   1HB   PRO  54          1HB       PRO  54 -13.371  -8.101   3.723
  423   2HB   PRO  54          2HB       PRO  54 -11.946  -8.392   2.718
  424   1HG   PRO  54          1HG       PRO  54 -12.241  -9.662   5.030
  425   2HG   PRO  54          2HG       PRO  54 -10.651  -9.067   4.519
  426   1HD   PRO  54          1HD       PRO  54 -12.499  -7.994   6.588
  427   2HD   PRO  54          2HD       PRO  54 -10.726  -7.979   6.539
  428    H    ALA  55           H        ALA  55 -13.919  -5.706   5.076
  429    HA   ALA  55           HA       ALA  55 -15.415  -4.774   2.881
  430   1HB   ALA  55          1HB       ALA  55 -16.853  -3.707   4.531
  431   2HB   ALA  55          2HB       ALA  55 -16.415  -5.338   5.042
  432   3HB   ALA  55          3HB       ALA  55 -15.621  -3.942   5.771
  433    H    HIS  56           H        HIS  56 -12.945  -3.255   4.835
  434    HA   HIS  56           HA       HIS  56 -13.504  -0.652   3.604
  435   1HB   HIS  56          1HB       HIS  56 -12.099  -1.515   6.079
  436   2HB   HIS  56          2HB       HIS  56 -11.509  -0.055   5.290
  437    HD1  HIS  56           HD1      HIS  56 -12.898   0.006   8.103
  438    HD2  HIS  56           HD2      HIS  56 -14.810   0.719   4.475
  439    HE1  HIS  56           HE1      HIS  56 -14.925   1.380   8.661
  440    HE2  HIS  56           HE2      HIS  56 -16.023   1.880   6.446
  441    H    MET  57           H        MET  57 -11.239  -3.264   3.554
  442    HA   MET  57           HA       MET  57  -9.268  -1.706   2.073
  443   1HB   MET  57          1HB       MET  57  -8.586  -3.371   3.819
  444   2HB   MET  57          2HB       MET  57  -9.219  -4.644   2.788
  445   1HG   MET  57          1HG       MET  57  -7.599  -4.090   1.068
  446   2HG   MET  57          2HG       MET  57  -6.989  -2.760   2.052
  447   1HE   MET  57          1HE       MET  57  -5.153  -5.083   0.797
  448   2HE   MET  57          2HE       MET  57  -4.070  -5.386   2.156
  449   3HE   MET  57          3HE       MET  57  -4.527  -3.733   1.742
  450    H    ASP  58           H        ASP  58 -12.087  -3.162   1.376
  451    HA   ASP  58           HA       ASP  58 -11.676  -4.772  -0.850
  452   1HB   ASP  58          1HB       ASP  58 -13.840  -4.643   0.213
  453   2HB   ASP  58          2HB       ASP  58 -13.984  -2.935  -0.186
  454    H    ALA  59           H        ALA  59 -11.788  -1.276  -0.593
  455    HA   ALA  59           HA       ALA  59 -11.980  -0.602  -3.296
  456   1HB   ALA  59          1HB       ALA  59 -10.472   0.850  -1.123
  457   2HB   ALA  59          2HB       ALA  59 -10.981   1.535  -2.668
  458   3HB   ALA  59          3HB       ALA  59 -12.189   1.029  -1.487
  459    H    VAL  60           H        VAL  60  -9.161  -1.404  -1.320
  460    HA   VAL  60           HA       VAL  60  -7.212  -0.850  -3.311
  461    HB   VAL  60           HB       VAL  60  -6.944  -2.777  -0.996
  462   1HG1  VAL  60          1HG1      VAL  60  -5.149  -2.938  -2.620
  463   2HG1  VAL  60          2HG1      VAL  60  -4.885  -1.197  -2.532
  464   3HG1  VAL  60          3HG1      VAL  60  -4.560  -2.210  -1.125
  465   1HG2  VAL  60          1HG2      VAL  60  -6.470   0.203  -1.031
  466   2HG2  VAL  60          2HG2      VAL  60  -7.750  -0.643  -0.162
  467   3HG2  VAL  60          3HG2      VAL  60  -6.065  -0.885   0.296
  468    H    LEU  61           H        LEU  61  -8.984  -3.734  -2.338
  469    HA   LEU  61           HA       LEU  61  -7.537  -5.540  -3.996
  470   1HB   LEU  61          1HB       LEU  61 -10.297  -5.802  -2.799
  471   2HB   LEU  61          2HB       LEU  61  -9.363  -7.110  -3.500
  472    HG   LEU  61           HG       LEU  61  -8.591  -5.540  -1.038
  473   1HD1  LEU  61          1HD1      LEU  61  -9.076  -7.612   0.165
  474   2HD1  LEU  61          2HD1      LEU  61 -10.511  -6.982  -0.644
  475   3HD1  LEU  61          3HD1      LEU  61  -9.640  -8.351  -1.335
  476   1HD2  LEU  61          1HD2      LEU  61  -6.830  -7.210  -0.783
  477   2HD2  LEU  61          2HD2      LEU  61  -7.312  -7.961  -2.305
  478   3HD2  LEU  61          3HD2      LEU  61  -6.650  -6.326  -2.299
  479    H    ALA  62           H        ALA  62 -10.414  -3.576  -4.414
  480    HA   ALA  62           HA       ALA  62 -11.292  -4.718  -6.849
  481   1HB   ALA  62          1HB       ALA  62 -12.654  -2.718  -7.089
  482   2HB   ALA  62          2HB       ALA  62 -12.731  -3.328  -5.437
  483   3HB   ALA  62          3HB       ALA  62 -11.735  -1.922  -5.810
  484    H    LEU  63           H        LEU  63  -8.993  -2.166  -6.076
  485    HA   LEU  63           HA       LEU  63  -8.561  -1.251  -8.714
  486   1HB   LEU  63          1HB       LEU  63  -6.653  -1.318  -6.371
  487   2HB   LEU  63          2HB       LEU  63  -6.403  -0.406  -7.848
  488    HG   LEU  63           HG       LEU  63  -8.642   0.051  -5.873
  489   1HD1  LEU  63          1HD1      LEU  63  -6.161   1.669  -6.440
  490   2HD1  LEU  63          2HD1      LEU  63  -7.465   2.116  -5.338
  491   3HD1  LEU  63          3HD1      LEU  63  -6.462   0.707  -4.992
  492   1HD2  LEU  63          1HD2      LEU  63  -9.092   2.061  -7.195
  493   2HD2  LEU  63          2HD2      LEU  63  -7.848   1.581  -8.348
  494   3HD2  LEU  63          3HD2      LEU  63  -9.298   0.596  -8.154
  495    H    ASN  64           H        ASN  64  -7.229  -3.862  -6.816
  496    HA   ASN  64           HA       ASN  64  -6.078  -5.734  -7.316
  497   1HB   ASN  64          1HB       ASN  64  -7.975  -6.145  -8.796
  498   2HB   ASN  64          2HB       ASN  64  -7.189  -5.243 -10.086
  499   1HD2  ASN  64          2HD2      ASN  64  -5.681  -6.226 -11.332
  500   2HD2  ASN  64          1HD2      ASN  64  -5.236  -7.893 -11.179
  501    HA   PRO  65           HA       PRO  65  -2.351  -3.902  -9.137
  502   1HB   PRO  65          1HB       PRO  65  -0.921  -3.715  -6.837
  503   2HB   PRO  65          2HB       PRO  65  -2.029  -2.452  -7.383
  504   1HG   PRO  65          1HG       PRO  65  -2.290  -4.286  -5.128
  505   2HG   PRO  65          2HG       PRO  65  -3.213  -2.821  -5.488
  506   1HD   PRO  65          1HD       PRO  65  -3.929  -5.604  -5.963
  507   2HD   PRO  65          2HD       PRO  65  -4.942  -4.152  -6.091
  508    H    ALA  66           H        ALA  66  -0.094  -4.794  -9.057
  509    HA   ALA  66           HA       ALA  66  -0.197  -7.679  -9.002
  510   1HB   ALA  66          1HB       ALA  66   2.113  -5.838  -9.628
  511   2HB   ALA  66          2HB       ALA  66   2.064  -7.579  -9.911
  512   3HB   ALA  66          3HB       ALA  66   0.984  -6.510 -10.806
  513    H    VAL  67           H        VAL  67   1.361  -5.086  -7.213
  514    HA   VAL  67           HA       VAL  67   1.779  -6.926  -4.981
  515    HB   VAL  67           HB       VAL  67   3.931  -6.937  -6.106
  516   1HG1  VAL  67          1HG1      VAL  67   5.246  -4.893  -6.413
  517   2HG1  VAL  67          2HG1      VAL  67   3.755  -4.870  -7.355
  518   3HG1  VAL  67          3HG1      VAL  67   3.871  -3.935  -5.864
  519   1HG2  VAL  67          1HG2      VAL  67   3.973  -6.990  -3.677
  520   2HG2  VAL  67          2HG2      VAL  67   5.374  -6.121  -4.302
  521   3HG2  VAL  67          3HG2      VAL  67   4.013  -5.228  -3.622
  522    H    ILE  68           H        ILE  68   1.740  -5.893  -2.933
  523    HA   ILE  68           HA       ILE  68   0.842  -3.084  -3.044
  524    HB   ILE  68           HB       ILE  68  -0.204  -5.173  -1.127
  525   1HG1  ILE  68          1HG1      ILE  68  -1.558  -3.975  -3.555
  526   2HG1  ILE  68          2HG1      ILE  68  -0.926  -5.614  -3.458
  527   1HG2  ILE  68          1HG2      ILE  68  -0.246  -2.909  -0.241
  528   2HG2  ILE  68          2HG2      ILE  68  -1.083  -2.341  -1.686
  529   3HG2  ILE  68          3HG2      ILE  68  -1.883  -3.465  -0.587
  530   1HD1  ILE  68          1HD1      ILE  68  -3.153  -4.484  -1.778
  531   2HD1  ILE  68          2HD1      ILE  68  -3.336  -5.564  -3.160
  532   3HD1  ILE  68          3HD1      ILE  68  -2.530  -6.131  -1.699
  533    H    LEU  69           H        LEU  69   1.973  -1.734  -1.829
  534    HA   LEU  69           HA       LEU  69   3.682  -2.831   0.294
  535   1HB   LEU  69          1HB       LEU  69   3.740  -0.145  -1.090
  536   2HB   LEU  69          2HB       LEU  69   4.819  -0.622   0.207
  537    HG   LEU  69           HG       LEU  69   4.673  -1.917  -2.516
  538   1HD1  LEU  69          1HD1      LEU  69   6.734  -0.094  -1.288
  539   2HD1  LEU  69          2HD1      LEU  69   6.888  -0.920  -2.839
  540   3HD1  LEU  69          3HD1      LEU  69   5.641   0.306  -2.613
  541   1HD2  LEU  69          1HD2      LEU  69   6.525  -2.410  -0.188
  542   2HD2  LEU  69          2HD2      LEU  69   5.289  -3.514  -0.791
  543   3HD2  LEU  69          3HD2      LEU  69   6.684  -3.119  -1.795
  544    H    LEU  70           H        LEU  70   2.838  -2.744   2.263
  545    HA   LEU  70           HA       LEU  70   0.871  -0.636   2.848
  546   1HB   LEU  70          1HB       LEU  70   0.050  -2.942   3.069
  547   2HB   LEU  70          2HB       LEU  70   1.329  -3.291   4.215
  548    HG   LEU  70           HG       LEU  70   0.354  -1.620   5.768
  549   1HD1  LEU  70          1HD1      LEU  70  -1.892  -1.518   3.760
  550   2HD1  LEU  70          2HD1      LEU  70  -1.890  -0.768   5.357
  551   3HD1  LEU  70          3HD1      LEU  70  -0.764  -0.210   4.119
  552   1HD2  LEU  70          1HD2      LEU  70  -1.541  -3.786   4.864
  553   2HD2  LEU  70          2HD2      LEU  70  -0.189  -3.989   5.980
  554   3HD2  LEU  70          3HD2      LEU  70  -1.562  -2.979   6.433
  555    H    GLY  71           H        GLY  71   1.821   1.038   3.797
  556   1HA   GLY  71          1HA       GLY  71   3.902   0.485   5.821
  557   2HA   GLY  71          2HA       GLY  71   3.790   1.973   4.889
  558    H    THR  72           H        THR  72   3.315   0.745   7.867
  559    HA   THR  72           HA       THR  72   1.089   2.582   8.441
  560    HB   THR  72           HB       THR  72   0.943   1.249  10.623
  561    HG1  THR  72           HG1      THR  72   2.747   0.024  10.686
  562   1HG2  THR  72          1HG2      THR  72  -0.381  -0.535   9.577
  563   2HG2  THR  72          2HG2      THR  72  -0.699   1.031   8.829
  564   3HG2  THR  72          3HG2      THR  72   0.334  -0.142   8.013
  565    H    GLY  73           H        GLY  73   2.649   4.352   8.407
  566   1HA   GLY  73          1HA       GLY  73   4.057   5.860   9.415
  567   2HA   GLY  73          2HA       GLY  73   3.499   5.179  10.936
  568    H    GLU  74           H        GLU  74   5.442   5.186  12.010
  569    HA   GLU  74           HA       GLU  74   7.564   3.490  10.913
  570   1HB   GLU  74          1HB       GLU  74   7.497   5.409  13.240
  571   2HB   GLU  74          2HB       GLU  74   8.812   4.269  13.010
  572   1HG   GLU  74          1HG       GLU  74   9.677   6.139  12.036
  573   2HG   GLU  74          2HG       GLU  74   8.954   5.346  10.641
  574    H    ARG  75           H        ARG  75   4.886   2.648  12.047
  575    HA   ARG  75           HA       ARG  75   5.904   0.852  14.154
  576   1HB   ARG  75          1HB       ARG  75   3.103   1.960  13.854
  577   2HB   ARG  75          2HB       ARG  75   3.624   0.821  15.090
  578   1HG   ARG  75          1HG       ARG  75   5.172   2.499  15.977
  579   2HG   ARG  75          2HG       ARG  75   4.626   3.642  14.748
  580   1HD   ARG  75          1HD       ARG  75   3.509   4.089  16.848
  581   2HD   ARG  75          2HD       ARG  75   2.346   3.502  15.661
  582    HE   ARG  75           HE       ARG  75   3.346   1.347  17.210
  583   1HH1  ARG  75          1HH1      ARG  75   1.224   4.123  17.442
  584   2HH1  ARG  75          2HH1      ARG  75   0.199   3.411  18.646
  585   1HH2  ARG  75          1HH2      ARG  75   1.997   0.397  18.800
  586   2HH2  ARG  75          2HH2      ARG  75   0.625   1.283  19.403
  587    H    GLN  76           H        GLN  76   6.328  -0.965  13.004
  588    HA   GLN  76           HA       GLN  76   4.824  -1.738  10.718
  589   1HB   GLN  76          1HB       GLN  76   7.250  -2.267  11.147
  590   2HB   GLN  76          2HB       GLN  76   6.713  -3.462  12.319
  591   1HG   GLN  76          1HG       GLN  76   5.447  -4.586  10.498
  592   2HG   GLN  76          2HG       GLN  76   6.173  -3.452   9.360
  593   1HE2  GLN  76          2HE2      GLN  76   7.757  -4.866  12.155
  594   2HE2  GLN  76          1HE2      GLN  76   8.925  -5.778  11.259
  595    H    GLN  77           H        GLN  77   2.865  -2.550  10.768
  596    HA   GLN  77           HA       GLN  77   1.994  -4.203  13.029
  597   1HB   GLN  77          1HB       GLN  77   0.448  -2.890  10.787
  598   2HB   GLN  77          2HB       GLN  77  -0.275  -3.911  12.021
  599   1HG   GLN  77          1HG       GLN  77   1.214  -1.354  12.573
  600   2HG   GLN  77          2HG       GLN  77  -0.539  -1.493  12.448
  601   1HE2  GLN  77          2HE2      GLN  77  -1.679  -2.558  14.069
  602   2HE2  GLN  77          1HE2      GLN  77  -0.988  -2.874  15.621
  603    H    PHE  78           H        PHE  78   0.072  -5.730  11.886
  604    HA   PHE  78           HA       PHE  78   1.397  -7.216   9.730
  605   1HB   PHE  78          1HB       PHE  78   0.798  -9.344  10.776
  606   2HB   PHE  78          2HB       PHE  78   1.823  -8.401  11.849
  607    HD1  PHE  78           HD1      PHE  78   0.825  -7.286  13.837
  608    HD2  PHE  78           HD2      PHE  78  -1.393  -9.979  11.398
  609    HE1  PHE  78           HE1      PHE  78  -0.830  -7.551  15.639
  610    HE2  PHE  78           HE2      PHE  78  -3.053 -10.245  13.195
  611    HZ   PHE  78           HZ       PHE  78  -2.772  -9.031  15.318
  612    HA   PRO  79           HA       PRO  79  -2.549  -7.056   7.739
  613   1HB   PRO  79          1HB       PRO  79  -2.001  -9.727   6.628
  614   2HB   PRO  79          2HB       PRO  79  -2.210  -8.186   5.792
  615   1HG   PRO  79          1HG       PRO  79   0.192  -9.375   5.979
  616   2HG   PRO  79          2HG       PRO  79   0.015  -7.610   6.014
  617   1HD   PRO  79          1HD       PRO  79   0.454  -9.520   8.281
  618   2HD   PRO  79          2HD       PRO  79   1.170  -7.918   8.002
  619    H    SER  80           H        SER  80  -4.538  -7.532   8.386
  620    HA   SER  80           HA       SER  80  -5.111  -9.307  10.463
  621   1HB   SER  80          1HB       SER  80  -7.047  -8.168   8.433
  622   2HB   SER  80          2HB       SER  80  -7.436  -8.741  10.056
  623    HG   SER  80           HG       SER  80  -7.224  -6.465  10.000
  624    H    THR  81           H        THR  81  -6.190 -11.280  10.519
  625    HA   THR  81           HA       THR  81  -5.351 -13.222   8.744
  626    HB   THR  81           HB       THR  81  -7.833 -13.444  10.447
  627    HG1  THR  81           HG1      THR  81  -6.505 -13.750  12.188
  628   1HG2  THR  81          1HG2      THR  81  -7.368 -15.355   8.975
  629   2HG2  THR  81          2HG2      THR  81  -5.739 -15.471   9.640
  630   3HG2  THR  81          3HG2      THR  81  -7.135 -15.783  10.670
  631    H    ASP  82           H        ASP  82  -8.385 -11.420   8.777
  632    HA   ASP  82           HA       ASP  82  -9.815 -12.910   6.895
  633   1HB   ASP  82          1HB       ASP  82  -9.931  -9.933   7.419
  634   2HB   ASP  82          2HB       ASP  82 -11.152 -10.866   6.562
  635    H    VAL  83           H        VAL  83  -7.390 -10.416   6.490
  636    HA   VAL  83           HA       VAL  83  -7.928  -9.997   3.698
  637    HB   VAL  83           HB       VAL  83  -5.512  -9.135   5.299
  638   1HG1  VAL  83          1HG1      VAL  83  -5.273  -7.406   3.598
  639   2HG1  VAL  83          2HG1      VAL  83  -5.195  -9.015   2.881
  640   3HG1  VAL  83          3HG1      VAL  83  -6.666  -8.053   2.732
  641   1HG2  VAL  83          1HG2      VAL  83  -6.677  -6.997   5.589
  642   2HG2  VAL  83          2HG2      VAL  83  -8.107  -7.678   4.813
  643   3HG2  VAL  83          3HG2      VAL  83  -7.547  -8.327   6.353
  644    H    LEU  84           H        LEU  84  -5.924 -12.083   5.585
  645    HA   LEU  84           HA       LEU  84  -3.850 -12.627   3.795
  646   1HB   LEU  84          1HB       LEU  84  -5.120 -14.481   5.808
  647   2HB   LEU  84          2HB       LEU  84  -3.561 -14.728   5.043
  648    HG   LEU  84           HG       LEU  84  -4.254 -12.442   6.893
  649   1HD1  LEU  84          1HD1      LEU  84  -2.592 -14.916   7.343
  650   2HD1  LEU  84          2HD1      LEU  84  -2.752 -13.567   8.467
  651   3HD1  LEU  84          3HD1      LEU  84  -4.157 -14.559   8.074
  652   1HD2  LEU  84          1HD2      LEU  84  -1.624 -13.250   5.653
  653   2HD2  LEU  84          2HD2      LEU  84  -2.576 -11.827   5.229
  654   3HD2  LEU  84          3HD2      LEU  84  -1.858 -11.962   6.835
  655    H    ALA  85           H        ALA  85  -7.100 -13.942   4.005
  656    HA   ALA  85           HA       ALA  85  -6.773 -16.151   2.307
  657   1HB   ALA  85          1HB       ALA  85  -8.721 -15.858   3.749
  658   2HB   ALA  85          2HB       ALA  85  -9.249 -14.491   2.767
  659   3HB   ALA  85          3HB       ALA  85  -9.203 -16.111   2.071
  660    H    ALA  86           H        ALA  86  -7.637 -12.793   1.605
  661    HA   ALA  86           HA       ALA  86  -8.153 -13.256  -1.167
  662   1HB   ALA  86          1HB       ALA  86  -9.207 -11.417   0.053
  663   2HB   ALA  86          2HB       ALA  86  -7.629 -10.662   0.281
  664   3HB   ALA  86          3HB       ALA  86  -8.301 -10.829  -1.341
  665    H    CYS  87           H        CYS  87  -5.385 -12.140   0.699
  666    HA   CYS  87           HA       CYS  87  -3.824 -11.337  -1.534
  667   1HB   CYS  87          1HB       CYS  87  -2.899 -12.176   1.222
  668   2HB   CYS  87          2HB       CYS  87  -1.958 -11.267   0.043
  669    HG   CYS  87           HG       CYS  87  -4.738 -10.183   1.714
  670    H    LEU  88           H        LEU  88  -4.089 -14.329   0.312
  671    HA   LEU  88           HA       LEU  88  -1.883 -15.638  -0.888
  672   1HB   LEU  88          1HB       LEU  88  -3.021 -16.193   1.308
  673   2HB   LEU  88          2HB       LEU  88  -4.297 -16.938   0.371
  674    HG   LEU  88           HG       LEU  88  -1.447 -17.852   0.069
  675   1HD1  LEU  88          1HD1      LEU  88  -1.953 -17.919   2.456
  676   2HD1  LEU  88          2HD1      LEU  88  -3.439 -18.809   2.122
  677   3HD1  LEU  88          3HD1      LEU  88  -1.873 -19.544   1.777
  678   1HD2  LEU  88          1HD2      LEU  88  -3.066 -18.642  -1.579
  679   2HD2  LEU  88          2HD2      LEU  88  -2.534 -19.963  -0.541
  680   3HD2  LEU  88          3HD2      LEU  88  -4.114 -19.223  -0.285
  681    H    THR  89           H        THR  89  -5.374 -15.713  -1.553
  682    HA   THR  89           HA       THR  89  -5.283 -17.786  -3.452
  683    HB   THR  89           HB       THR  89  -7.512 -16.767  -4.223
  684    HG1  THR  89           HG1      THR  89  -7.515 -15.337  -1.816
  685   1HG2  THR  89          1HG2      THR  89  -7.357 -18.655  -2.678
  686   2HG2  THR  89          2HG2      THR  89  -7.139 -17.543  -1.326
  687   3HG2  THR  89          3HG2      THR  89  -8.666 -17.569  -2.210
  688    H    ARG  90           H        ARG  90  -5.369 -14.249  -3.923
  689    HA   ARG  90           HA       ARG  90  -5.156 -14.482  -6.767
  690   1HB   ARG  90          1HB       ARG  90  -4.773 -12.103  -4.943
  691   2HB   ARG  90          2HB       ARG  90  -4.757 -12.014  -6.698
  692   1HG   ARG  90          1HG       ARG  90  -7.076 -12.903  -6.712
  693   2HG   ARG  90          2HG       ARG  90  -7.071 -12.821  -4.948
  694   1HD   ARG  90          1HD       ARG  90  -6.645 -10.406  -5.075
  695   2HD   ARG  90          2HD       ARG  90  -6.684 -10.499  -6.834
  696    HE   ARG  90           HE       ARG  90  -9.076 -11.558  -5.749
  697   1HH1  ARG  90          1HH1      ARG  90  -7.448  -8.514  -6.359
  698   2HH1  ARG  90          2HH1      ARG  90  -8.915  -7.587  -6.392
  699   1HH2  ARG  90          1HH2      ARG  90 -10.992 -10.364  -5.815
  700   2HH2  ARG  90          2HH2      ARG  90 -10.949  -8.644  -6.079
  701    H    GLY  91           H        GLY  91  -2.905 -14.440  -4.162
  702   1HA   GLY  91          1HA       GLY  91  -0.633 -14.882  -4.224
  703   2HA   GLY  91          2HA       GLY  91  -0.717 -14.894  -5.981
  704    H    ILE  92           H        ILE  92  -1.430 -12.435  -3.514
  705    HA   ILE  92           HA       ILE  92   0.271 -10.577  -5.046
  706    HB   ILE  92           HB       ILE  92  -1.978  -9.901  -3.137
  707   1HG1  ILE  92          1HG1      ILE  92  -1.879  -9.742  -6.160
  708   2HG1  ILE  92          2HG1      ILE  92  -2.780 -10.937  -5.233
  709   1HG2  ILE  92          1HG2      ILE  92  -0.242  -8.196  -3.191
  710   2HG2  ILE  92          2HG2      ILE  92  -0.334  -8.138  -4.951
  711   3HG2  ILE  92          3HG2      ILE  92  -1.709  -7.614  -3.979
  712   1HD1  ILE  92          1HD1      ILE  92  -4.152  -9.146  -4.283
  713   2HD1  ILE  92          2HD1      ILE  92  -3.260  -7.967  -5.244
  714   3HD1  ILE  92          3HD1      ILE  92  -4.244  -9.193  -6.043
  715    H    GLY  93           H        GLY  93   2.070  -9.836  -4.109
  716   1HA   GLY  93          1HA       GLY  93   2.752 -10.613  -1.432
  717   2HA   GLY  93          2HA       GLY  93   3.716  -9.612  -2.512
  718    H    LEU  94           H        LEU  94   1.690  -9.659   0.193
  719    HA   LEU  94           HA       LEU  94   1.273  -6.766   0.124
  720   1HB   LEU  94          1HB       LEU  94  -0.634  -8.159   0.771
  721   2HB   LEU  94          2HB       LEU  94   0.302  -8.862   2.073
  722    HG   LEU  94           HG       LEU  94   0.395  -6.673   3.193
  723   1HD1  LEU  94          1HD1      LEU  94  -1.379  -5.754   0.936
  724   2HD1  LEU  94          2HD1      LEU  94  -0.978  -4.824   2.381
  725   3HD1  LEU  94          3HD1      LEU  94   0.285  -5.243   1.222
  726   1HD2  LEU  94          1HD2      LEU  94  -2.385  -7.563   2.439
  727   2HD2  LEU  94          2HD2      LEU  94  -1.399  -8.217   3.748
  728   3HD2  LEU  94          3HD2      LEU  94  -1.969  -6.550   3.822
  729    H    GLU  95           H        GLU  95   3.179  -5.816   0.591
  730    HA   GLU  95           HA       GLU  95   4.902  -6.963   2.634
  731   1HB   GLU  95          1HB       GLU  95   5.293  -4.598   0.797
  732   2HB   GLU  95          2HB       GLU  95   6.502  -5.205   1.917
  733   1HG   GLU  95          1HG       GLU  95   5.331  -6.713  -0.410
  734   2HG   GLU  95          2HG       GLU  95   6.928  -5.967  -0.348
  735    H    ALA  96           H        ALA  96   4.130  -6.529   4.623
  736    HA   ALA  96           HA       ALA  96   3.197  -3.901   5.358
  737   1HB   ALA  96          1HB       ALA  96   2.229  -5.907   6.391
  738   2HB   ALA  96          2HB       ALA  96   3.797  -6.295   7.099
  739   3HB   ALA  96          3HB       ALA  96   2.942  -4.834   7.594
  740    H    MET  97           H        MET  97   4.587  -2.299   5.624
  741    HA   MET  97           HA       MET  97   7.113  -2.785   7.031
  742   1HB   MET  97          1HB       MET  97   6.872  -1.378   4.361
  743   2HB   MET  97          2HB       MET  97   8.316  -1.387   5.358
  744   1HG   MET  97          1HG       MET  97   8.502  -3.796   5.095
  745   2HG   MET  97          2HG       MET  97   7.031  -3.808   4.121
  746   1HE   MET  97          1HE       MET  97   8.306  -5.093   2.176
  747   2HE   MET  97          2HE       MET  97   9.771  -5.098   3.158
  748   3HE   MET  97          3HE       MET  97   9.833  -4.546   1.484
  749    H    THR  98           H        THR  98   8.230  -0.355   6.923
  750    HA   THR  98           HA       THR  98   6.303   1.421   8.183
  751    HB   THR  98           HB       THR  98   8.275   2.859   8.634
  752    HG1  THR  98           HG1      THR  98  10.380   1.720   8.150
  753   1HG2  THR  98          1HG2      THR  98   7.666   1.126  10.253
  754   2HG2  THR  98          2HG2      THR  98   8.684  -0.035   9.402
  755   3HG2  THR  98          3HG2      THR  98   9.414   1.357  10.202
  756    H    ASN  99           H        ASN  99   6.249   3.720   7.466
  757    HA   ASN  99           HA       ASN  99   5.673   4.018   4.755
  758   1HB   ASN  99          1HB       ASN  99   6.364   6.044   6.881
  759   2HB   ASN  99          2HB       ASN  99   5.910   6.516   5.246
  760   1HD2  ASN  99          2HD2      ASN  99   4.131   7.619   6.254
  761   2HD2  ASN  99          1HD2      ASN  99   2.709   6.729   6.699
  762    H    ALA 100           H        ALA 100   8.674   4.531   6.499
  763    HA   ALA 100           HA       ALA 100  10.081   5.732   4.336
  764   1HB   ALA 100          1HB       ALA 100  10.748   6.023   6.680
  765   2HB   ALA 100          2HB       ALA 100  11.184   4.316   6.757
  766   3HB   ALA 100          3HB       ALA 100  12.067   5.404   5.686
  767    H    ALA 101           H        ALA 101   9.916   2.421   5.622
  768    HA   ALA 101           HA       ALA 101  11.812   1.325   3.829
  769   1HB   ALA 101          1HB       ALA 101  10.942  -0.850   4.540
  770   2HB   ALA 101          2HB       ALA 101  11.216   0.218   5.917
  771   3HB   ALA 101          3HB       ALA 101   9.579  -0.048   5.320
  772    H    ALA 102           H        ALA 102   8.305   1.691   3.706
  773    HA   ALA 102           HA       ALA 102   7.857   0.186   1.369
  774   1HB   ALA 102          1HB       ALA 102   6.064   0.875   2.896
  775   2HB   ALA 102          2HB       ALA 102   6.287   2.550   2.391
  776   3HB   ALA 102          3HB       ALA 102   5.727   1.347   1.230
  777    H    ALA 103           H        ALA 103   8.730   3.568   1.888
  778    HA   ALA 103           HA       ALA 103   8.515   4.421  -0.793
  779   1HB   ALA 103          1HB       ALA 103   9.923   6.296  -0.115
  780   2HB   ALA 103          2HB       ALA 103   8.679   5.975   1.093
  781   3HB   ALA 103          3HB       ALA 103  10.341   5.454   1.378
  782    H    ARG 104           H        ARG 104  11.066   2.831   1.005
  783    HA   ARG 104           HA       ARG 104  13.084   3.087  -0.985
  784   1HB   ARG 104          1HB       ARG 104  13.536   2.662   1.419
  785   2HB   ARG 104          2HB       ARG 104  12.826   1.066   1.256
  786   1HG   ARG 104          1HG       ARG 104  15.147   1.851  -0.453
  787   2HG   ARG 104          2HG       ARG 104  15.400   1.350   1.217
  788   1HD   ARG 104          1HD       ARG 104  14.132  -0.245  -1.003
  789   2HD   ARG 104          2HD       ARG 104  15.669  -0.563  -0.200
  790    HE   ARG 104           HE       ARG 104  13.611  -0.558   1.719
  791   1HH1  ARG 104          1HH1      ARG 104  14.859  -2.503  -0.914
  792   2HH1  ARG 104          2HH1      ARG 104  14.166  -3.981  -0.312
  793   1HH2  ARG 104          1HH2      ARG 104  12.720  -2.489   2.516
  794   2HH2  ARG 104          2HH2      ARG 104  12.929  -3.972   1.636
  795    H    THR 105           H        THR 105  10.880   0.450  -0.068
  796    HA   THR 105           HA       THR 105  11.729  -1.365  -2.051
  797    HB   THR 105           HB       THR 105   8.983  -1.248  -0.792
  798    HG1  THR 105           HG1      THR 105   9.879  -1.914   1.021
  799   1HG2  THR 105          1HG2      THR 105   9.212  -2.851  -2.629
  800   2HG2  THR 105          2HG2      THR 105  10.632  -3.549  -1.850
  801   3HG2  THR 105          3HG2      THR 105   9.049  -3.686  -1.082
  802    H    TYR 106           H        TYR 106   9.401   1.248  -2.067
  803    HA   TYR 106           HA       TYR 106   7.914   0.619  -4.334
  804   1HB   TYR 106          1HB       TYR 106   7.380   2.463  -2.769
  805   2HB   TYR 106          2HB       TYR 106   8.754   3.371  -3.391
  806    HD1  TYR 106           HD1      TYR 106   5.429   2.011  -4.256
  807    HD2  TYR 106           HD2      TYR 106   8.586   4.621  -5.410
  808    HE1  TYR 106           HE1      TYR 106   3.983   2.983  -5.990
  809    HE2  TYR 106           HE2      TYR 106   7.149   5.599  -7.149
  810    HH   TYR 106           HH       TYR 106   5.174   4.985  -8.462
  811    H    ASN 107           H        ASN 107  11.008   2.315  -4.055
  812    HA   ASN 107           HA       ASN 107  11.283   3.090  -6.734
  813   1HB   ASN 107          1HB       ASN 107  12.718   3.952  -4.929
  814   2HB   ASN 107          2HB       ASN 107  13.453   2.363  -4.750
  815   1HD2  ASN 107          2HD2      ASN 107  14.966   1.670  -6.251
  816   2HD2  ASN 107          1HD2      ASN 107  15.650   2.723  -7.436
  817    H    VAL 108           H        VAL 108  12.127   0.096  -5.085
  818    HA   VAL 108           HA       VAL 108  13.546  -1.062  -7.257
  819    HB   VAL 108           HB       VAL 108  12.193  -2.463  -4.946
  820   1HG1  VAL 108          1HG1      VAL 108  13.843  -4.232  -5.353
  821   2HG1  VAL 108          2HG1      VAL 108  12.786  -3.986  -6.743
  822   3HG1  VAL 108          3HG1      VAL 108  14.429  -3.349  -6.763
  823   1HG2  VAL 108          1HG2      VAL 108  14.997  -1.383  -5.184
  824   2HG2  VAL 108          2HG2      VAL 108  13.723  -0.769  -4.130
  825   3HG2  VAL 108          3HG2      VAL 108  14.394  -2.377  -3.858
  826    H    LEU 109           H        LEU 109  10.235  -1.456  -6.033
  827    HA   LEU 109           HA       LEU 109   9.512  -3.454  -7.906
  828   1HB   LEU 109          1HB       LEU 109   7.741  -1.586  -6.332
  829   2HB   LEU 109          2HB       LEU 109   7.212  -3.040  -7.158
  830    HG   LEU 109           HG       LEU 109   9.099  -2.920  -4.804
  831   1HD1  LEU 109          1HD1      LEU 109   7.296  -4.060  -3.613
  832   2HD1  LEU 109          2HD1      LEU 109   6.785  -2.478  -4.203
  833   3HD1  LEU 109          3HD1      LEU 109   6.274  -3.941  -5.046
  834   1HD2  LEU 109          1HD2      LEU 109   8.029  -5.302  -6.312
  835   2HD2  LEU 109          2HD2      LEU 109   9.696  -4.729  -6.326
  836   3HD2  LEU 109          3HD2      LEU 109   8.993  -5.360  -4.837
  837    H    ALA 110           H        ALA 110   9.182   0.059  -7.894
  838    HA   ALA 110           HA       ALA 110   7.589   0.254 -10.221
  839   1HB   ALA 110          1HB       ALA 110   9.535   2.272  -9.103
  840   2HB   ALA 110          2HB       ALA 110   8.257   2.595 -10.275
  841   3HB   ALA 110          3HB       ALA 110   7.843   2.101  -8.633
  842    H    SER 111           H        SER 111  11.089   0.251  -9.707
  843    HA   SER 111           HA       SER 111  11.771   0.683 -12.432
  844   1HB   SER 111          1HB       SER 111  13.414  -0.588 -10.229
  845   2HB   SER 111          2HB       SER 111  14.036   0.036 -11.757
  846    HG   SER 111           HG       SER 111  13.062   1.420  -9.518
  847    H    GLU 112           H        GLU 112  10.936  -2.113 -10.553
  848    HA   GLU 112           HA       GLU 112  11.885  -4.050 -12.432
  849   1HB   GLU 112          1HB       GLU 112  11.504  -4.497  -9.996
  850   2HB   GLU 112          2HB       GLU 112   9.774  -4.375 -10.287
  851   1HG   GLU 112          1HG       GLU 112  10.519  -6.694 -10.186
  852   2HG   GLU 112          2HG       GLU 112   9.862  -6.289 -11.771
  853    H    GLY 113           H        GLY 113   9.214  -1.957 -12.293
  854   1HA   GLY 113          1HA       GLY 113   7.734  -1.548 -14.045
  855   2HA   GLY 113          2HA       GLY 113   8.204  -3.077 -14.772
  856    H    ARG 114           H        ARG 114   7.489  -3.464 -11.508
  857    HA   ARG 114           HA       ARG 114   5.032  -4.830 -12.192
  858   1HB   ARG 114          1HB       ARG 114   6.785  -4.743  -9.780
  859   2HB   ARG 114          2HB       ARG 114   5.102  -5.213  -9.573
  860   1HG   ARG 114          1HG       ARG 114   5.460  -6.940 -11.351
  861   2HG   ARG 114          2HG       ARG 114   7.179  -6.547 -11.290
  862   1HD   ARG 114          1HD       ARG 114   7.381  -7.311  -9.072
  863   2HD   ARG 114          2HD       ARG 114   5.632  -7.333  -8.836
  864    HE   ARG 114           HE       ARG 114   6.313  -9.090 -10.931
  865   1HH1  ARG 114          1HH1      ARG 114   6.594  -8.819  -7.443
  866   2HH1  ARG 114          2HH1      ARG 114   6.582 -10.537  -7.189
  867   1HH2  ARG 114          1HH2      ARG 114   6.266 -11.352 -10.585
  868   2HH2  ARG 114          2HH2      ARG 114   6.377 -11.977  -8.963
  869    H    ARG 115           H        ARG 115   3.033  -4.177 -11.803
  870    HA   ARG 115           HA       ARG 115   2.546  -1.467 -11.102
  871   1HB   ARG 115          1HB       ARG 115   1.130  -2.808 -12.659
  872   2HB   ARG 115          2HB       ARG 115   0.554  -3.737 -11.283
  873   1HG   ARG 115          1HG       ARG 115  -1.006  -1.967 -12.038
  874   2HG   ARG 115          2HG       ARG 115  -0.519  -1.817 -10.349
  875   1HD   ARG 115          1HD       ARG 115  -0.564   0.330 -11.676
  876   2HD   ARG 115          2HD       ARG 115   0.942  -0.021 -10.830
  877    HE   ARG 115           HE       ARG 115   1.430  -1.030 -13.270
  878   1HH1  ARG 115          1HH1      ARG 115   0.043   2.054 -12.325
  879   2HH1  ARG 115          2HH1      ARG 115   0.791   2.919 -13.638
  880   1HH2  ARG 115          1HH2      ARG 115   2.407   0.118 -14.973
  881   2HH2  ARG 115          2HH2      ARG 115   2.132   1.832 -15.130
  882    H    VAL 116           H        VAL 116   3.157  -0.933  -9.112
  883    HA   VAL 116           HA       VAL 116   2.325  -2.596  -6.856
  884    HB   VAL 116           HB       VAL 116   4.693  -2.116  -6.933
  885   1HG1  VAL 116          1HG1      VAL 116   5.558   0.180  -6.737
  886   2HG1  VAL 116          2HG1      VAL 116   4.683  -0.087  -8.245
  887   3HG1  VAL 116          3HG1      VAL 116   3.917   0.797  -6.925
  888   1HG2  VAL 116          1HG2      VAL 116   5.011  -1.086  -4.729
  889   2HG2  VAL 116          2HG2      VAL 116   3.340  -0.526  -4.757
  890   3HG2  VAL 116          3HG2      VAL 116   3.690  -2.255  -4.726
  891    H    ALA 117           H        ALA 117   0.991  -1.888  -5.293
  892    HA   ALA 117           HA       ALA 117  -0.129   0.817  -5.562
  893   1HB   ALA 117          1HB       ALA 117  -1.203  -1.578  -4.068
  894   2HB   ALA 117          2HB       ALA 117  -1.987  -0.002  -4.188
  895   3HB   ALA 117          3HB       ALA 117  -1.771  -0.993  -5.631
  896    H    LEU 118           H        LEU 118   0.826   2.263  -4.285
  897    HA   LEU 118           HA       LEU 118   2.193   1.385  -1.878
  898   1HB   LEU 118          1HB       LEU 118   3.285   2.977  -3.401
  899   2HB   LEU 118          2HB       LEU 118   1.984   4.122  -3.139
  900    HG   LEU 118           HG       LEU 118   2.626   4.274  -0.752
  901   1HD1  LEU 118          1HD1      LEU 118   4.764   3.344  -0.025
  902   2HD1  LEU 118          2HD1      LEU 118   3.641   2.072  -0.503
  903   3HD1  LEU 118          3HD1      LEU 118   4.950   2.544  -1.586
  904   1HD2  LEU 118          1HD2      LEU 118   4.697   5.542  -1.115
  905   2HD2  LEU 118          2HD2      LEU 118   4.830   4.844  -2.729
  906   3HD2  LEU 118          3HD2      LEU 118   3.477   5.904  -2.337
  907    H    ALA 119           H        ALA 119   0.622   0.878  -0.419
  908    HA   ALA 119           HA       ALA 119  -1.394   2.874   0.251
  909   1HB   ALA 119          1HB       ALA 119  -0.915   0.123   1.404
  910   2HB   ALA 119          2HB       ALA 119  -2.275   1.180   1.784
  911   3HB   ALA 119          3HB       ALA 119  -2.093   0.531   0.154
  912    H    MET 120           H        MET 120  -0.175   4.516   1.120
  913    HA   MET 120           HA       MET 120   1.580   3.841   3.366
  914   1HB   MET 120          1HB       MET 120   2.614   5.161   1.594
  915   2HB   MET 120          2HB       MET 120   1.363   6.387   1.753
  916   1HG   MET 120          1HG       MET 120   2.129   6.986   3.933
  917   2HG   MET 120          2HG       MET 120   3.256   5.632   3.962
  918   1HE   MET 120          1HE       MET 120   5.908   6.685   1.306
  919   2HE   MET 120          2HE       MET 120   4.484   5.677   1.047
  920   3HE   MET 120          3HE       MET 120   5.444   5.487   2.515
  921    H    ILE 121           H        ILE 121   0.647   3.880   5.247
  922    HA   ILE 121           HA       ILE 121  -1.599   5.654   5.770
  923    HB   ILE 121           HB       ILE 121  -0.325   3.476   7.433
  924   1HG1  ILE 121          1HG1      ILE 121  -2.994   3.623   6.011
  925   2HG1  ILE 121          2HG1      ILE 121  -1.596   2.704   5.466
  926   1HG2  ILE 121          1HG2      ILE 121  -2.109   3.768   9.027
  927   2HG2  ILE 121          2HG2      ILE 121  -1.246   5.291   8.835
  928   3HG2  ILE 121          3HG2      ILE 121  -2.814   5.062   8.057
  929   1HD1  ILE 121          1HD1      ILE 121  -1.738   1.315   7.472
  930   2HD1  ILE 121          2HD1      ILE 121  -3.154   2.227   7.994
  931   3HD1  ILE 121          3HD1      ILE 121  -3.223   1.260   6.521
  932    H    VAL 122           H        VAL 122  -1.113   7.649   6.327
  933    HA   VAL 122           HA       VAL 122   1.299   8.191   7.887
  934    HB   VAL 122           HB       VAL 122  -0.653  10.118   6.609
  935   1HG1  VAL 122          1HG1      VAL 122   0.462  11.110   8.522
  936   2HG1  VAL 122          2HG1      VAL 122   2.031  10.606   7.894
  937   3HG1  VAL 122          3HG1      VAL 122   1.078  11.809   7.025
  938   1HG2  VAL 122          1HG2      VAL 122   0.552   8.832   4.938
  939   2HG2  VAL 122          2HG2      VAL 122   1.128  10.499   4.960
  940   3HG2  VAL 122          3HG2      VAL 122   2.086   9.224   5.715
  941    H    GLY 123           H        GLY 123   1.220   8.553  10.001
  942   1HA   GLY 123          1HA       GLY 123  -1.336   8.442  11.354
  943   2HA   GLY 123          2HA       GLY 123   0.245   8.464  12.106
  944    H    GLY 124           H        GLY 124  -1.927  10.528  10.264
  945   1HA   GLY 124          1HA       GLY 124  -0.834  12.954  11.340
  946   2HA   GLY 124          2HA       GLY 124  -2.296  12.807  10.375
  947    H    LEU 125           H        LEU 125  -1.406  14.029  13.124
  948    HA   LEU 125           HA       LEU 125  -3.217  12.761  14.958
  949   1HB   LEU 125          1HB       LEU 125  -1.650  15.329  15.199
  950   2HB   LEU 125          2HB       LEU 125  -2.570  14.589  16.496
  951    HG   LEU 125           HG       LEU 125  -0.151  13.394  15.137
  952   1HD1  LEU 125          1HD1      LEU 125   0.923  13.715  17.315
  953   2HD1  LEU 125          2HD1      LEU 125   0.413  15.246  16.603
  954   3HD1  LEU 125          3HD1      LEU 125  -0.530  14.523  17.907
  955   1HD2  LEU 125          1HD2      LEU 125  -1.737  11.667  15.805
  956   2HD2  LEU 125          2HD2      LEU 125  -0.310  11.644  16.842
  957   3HD2  LEU 125          3HD2      LEU 125  -1.816  12.351  17.428
  958    H    GLU 126           H        GLU 126  -5.259  12.919  14.266
  959    HA   GLU 126           HA       GLU 126  -6.433  15.319  13.270
  960   1HB   GLU 126          1HB       GLU 126  -7.284  13.155  12.572
  961   2HB   GLU 126          2HB       GLU 126  -7.655  12.726  14.235
  962   1HG   GLU 126          1HG       GLU 126  -9.671  13.315  13.069
  963   2HG   GLU 126          2HG       GLU 126  -9.328  14.518  14.310
  964    H    HIS 127           H        HIS 127  -7.846  16.705  14.254
  965    HA   HIS 127           HA       HIS 127  -8.646  18.046  15.882
  966   1HB   HIS 127          1HB       HIS 127  -8.721  15.520  17.547
  967   2HB   HIS 127          2HB       HIS 127  -9.513  17.037  17.959
  968    HD1  HIS 127           HD1      HIS 127 -11.213  17.854  15.832
  969    HD2  HIS 127           HD2      HIS 127 -10.427  13.804  16.380
  970    HE1  HIS 127           HE1      HIS 127 -13.048  16.631  14.619
  971    HE2  HIS 127           HE2      HIS 127 -12.414  14.196  14.767
  972    H    HIS 128           H        HIS 128  -6.469  18.938  15.745
  973    HA   HIS 128           HA       HIS 128  -4.806  18.447  18.088
  974   1HB   HIS 128          1HB       HIS 128  -3.329  20.247  16.896
  975   2HB   HIS 128          2HB       HIS 128  -3.370  18.599  16.288
  976    HD1  HIS 128           HD1      HIS 128  -4.465  22.096  15.438
  977    HD2  HIS 128           HD2      HIS 128  -4.469  18.289  13.753
  978    HE1  HIS 128           HE1      HIS 128  -5.044  22.422  13.014
  979    HE2  HIS 128           HE2      HIS 128  -4.829  20.134  11.979
  980    H    HIS 129           H        HIS 129  -3.936  20.356  19.268
  981    HA   HIS 129           HA       HIS 129  -6.264  21.775  20.231
  982   1HB   HIS 129          1HB       HIS 129  -3.424  21.974  21.247
  983   2HB   HIS 129          2HB       HIS 129  -4.888  22.452  22.095
  984    HD1  HIS 129           HD1      HIS 129  -6.325  20.547  23.156
  985    HD2  HIS 129           HD2      HIS 129  -2.804  19.270  21.339
  986    HE1  HIS 129           HE1      HIS 129  -5.953  18.192  23.960
  987    HE2  HIS 129           HE2      HIS 129  -3.718  17.521  23.006
  988    H    HIS 130           H        HIS 130  -6.696  23.901  20.058
  989    HA   HIS 130           HA       HIS 130  -5.079  25.492  18.254
  990   1HB   HIS 130          1HB       HIS 130  -7.619  26.120  19.774
  991   2HB   HIS 130          2HB       HIS 130  -6.816  27.260  18.696
  992    HD1  HIS 130           HD1      HIS 130  -9.642  25.336  18.586
  993    HD2  HIS 130           HD2      HIS 130  -6.334  25.537  16.069
  994    HE1  HIS 130           HE1      HIS 130 -10.410  24.405  16.370
  995    HE2  HIS 130           HE2      HIS 130  -8.354  24.428  14.897
  996    H    HIS 131           H        HIS 131  -5.314  24.924  21.586
  997    HA   HIS 131           HA       HIS 131  -3.358  27.075  22.049
  998   1HB   HIS 131          1HB       HIS 131  -5.449  27.204  23.451
  999   2HB   HIS 131          2HB       HIS 131  -5.017  25.646  24.144
 1000    HD1  HIS 131           HD1      HIS 131  -3.004  25.595  25.800
 1001    HD2  HIS 131           HD2      HIS 131  -4.000  29.387  24.403
 1002    HE1  HIS 131           HE1      HIS 131  -1.795  27.212  27.298
 1003    HE2  HIS 131           HE2      HIS 131  -2.420  29.501  26.451
 1004    H    HIS 132           H        HIS 132  -1.474  26.064  21.586
 1005    HA   HIS 132           HA       HIS 132  -1.070  23.279  22.075
 1006   1HB   HIS 132          1HB       HIS 132   0.009  24.681  20.233
 1007   2HB   HIS 132          2HB       HIS 132   1.093  25.297  21.476
 1008    HD1  HIS 132           HD1      HIS 132   2.898  23.675  22.390
 1009    HD2  HIS 132           HD2      HIS 132   0.469  22.042  19.434
 1010    HE1  HIS 132           HE1      HIS 132   4.034  21.548  21.674
 1011    HE2  HIS 132           HE2      HIS 132   2.658  20.696  19.742
  Start of MODEL   20
    1   1H    MET   1          1HT       MET   1  -6.074  16.803 -33.178
    2   2H    MET   1          2HT       MET   1  -4.581  16.655 -32.384
    3   3H    MET   1          3HT       MET   1  -4.694  17.561 -33.815
    4    HA   MET   1           HA       MET   1  -6.198  19.117 -32.686
    5   1HB   MET   1          1HB       MET   1  -5.371  17.509 -30.256
    6   2HB   MET   1          2HB       MET   1  -6.238  19.036 -30.206
    7   1HG   MET   1          1HG       MET   1  -8.123  18.017 -31.359
    8   2HG   MET   1          2HG       MET   1  -7.251  16.487 -31.444
    9   1HE   MET   1          1HE       MET   1  -6.620  15.022 -29.324
   10   2HE   MET   1          2HE       MET   1  -6.989  15.491 -27.664
   11   3HE   MET   1          3HE       MET   1  -5.809  16.409 -28.599
   12    HA   PRO   2           HA       PRO   2  -2.330  21.284 -32.193
   13   1HB   PRO   2          1HB       PRO   2  -3.796  23.550 -31.102
   14   2HB   PRO   2          2HB       PRO   2  -2.990  23.402 -32.666
   15   1HG   PRO   2          1HG       PRO   2  -5.689  23.537 -32.402
   16   2HG   PRO   2          2HG       PRO   2  -4.888  22.663 -33.722
   17   1HD   PRO   2          1HD       PRO   2  -6.088  21.593 -31.190
   18   2HD   PRO   2          2HD       PRO   2  -6.178  20.944 -32.844
   19    H    LEU   3           H        LEU   3  -1.743  19.852 -30.424
   20    HA   LEU   3           HA       LEU   3  -2.500  20.606 -27.738
   21   1HB   LEU   3          1HB       LEU   3  -2.282  18.238 -28.440
   22   2HB   LEU   3          2HB       LEU   3  -0.566  18.493 -28.692
   23    HG   LEU   3           HG       LEU   3  -0.320  19.008 -26.278
   24   1HD1  LEU   3          1HD1      LEU   3  -3.205  18.148 -26.127
   25   2HD1  LEU   3          2HD1      LEU   3  -2.145  18.467 -24.754
   26   3HD1  LEU   3          3HD1      LEU   3  -2.594  19.779 -25.845
   27   1HD2  LEU   3          1HD2      LEU   3  -1.567  16.341 -26.934
   28   2HD2  LEU   3          2HD2      LEU   3   0.135  16.770 -27.100
   29   3HD2  LEU   3          3HD2      LEU   3  -0.604  16.697 -25.499
   30    H    ASN   4           H        ASN   4  -1.571  22.438 -27.047
   31    HA   ASN   4           HA       ASN   4   1.211  23.006 -27.597
   32   1HB   ASN   4          1HB       ASN   4   0.844  25.079 -26.347
   33   2HB   ASN   4          2HB       ASN   4  -0.413  24.851 -27.555
   34   1HD2  ASN   4          2HD2      ASN   4  -0.381  26.440 -25.105
   35   2HD2  ASN   4          1HD2      ASN   4  -1.743  25.905 -24.176
   36    H    GLN   5           H        GLN   5  -0.769  21.874 -24.949
   37    HA   GLN   5           HA       GLN   5   1.436  21.756 -23.092
   38   1HB   GLN   5          1HB       GLN   5  -0.850  22.090 -22.270
   39   2HB   GLN   5          2HB       GLN   5  -1.342  20.554 -22.969
   40   1HG   GLN   5          1HG       GLN   5   0.150  19.374 -21.446
   41   2HG   GLN   5          2HG       GLN   5   0.665  20.911 -20.753
   42   1HE2  GLN   5          2HE2      GLN   5  -0.051  20.240 -18.705
   43   2HE2  GLN   5          1HE2      GLN   5  -1.731  20.208 -18.294
   44    H    GLU   6           H        GLU   6   2.952  20.570 -24.254
   45    HA   GLU   6           HA       GLU   6   2.519  18.210 -25.647
   46   1HB   GLU   6          1HB       GLU   6   5.032  19.133 -24.244
   47   2HB   GLU   6          2HB       GLU   6   4.960  17.872 -25.470
   48   1HG   GLU   6          1HG       GLU   6   4.174  19.484 -27.110
   49   2HG   GLU   6          2HG       GLU   6   4.178  20.751 -25.888
   50    H    HIS   7           H        HIS   7   3.658  18.592 -22.286
   51    HA   HIS   7           HA       HIS   7   2.718  15.840 -21.829
   52   1HB   HIS   7          1HB       HIS   7   4.296  15.572 -20.064
   53   2HB   HIS   7          2HB       HIS   7   5.185  16.249 -21.420
   54    HD1  HIS   7           HD1      HIS   7   6.230  18.572 -21.110
   55    HD2  HIS   7           HD2      HIS   7   4.022  17.272 -17.830
   56    HE1  HIS   7           HE1      HIS   7   6.810  20.140 -19.229
   57    HE2  HIS   7           HE2      HIS   7   5.618  19.215 -17.210
   58    HA   PRO   8           HA       PRO   8  -0.535  17.663 -19.531
   59   1HB   PRO   8          1HB       PRO   8  -0.695  15.193 -17.951
   60   2HB   PRO   8          2HB       PRO   8  -1.871  15.886 -19.069
   61   1HG   PRO   8          1HG       PRO   8  -0.472  13.660 -19.660
   62   2HG   PRO   8          2HG       PRO   8  -0.948  14.835 -20.900
   63   1HD   PRO   8          1HD       PRO   8   1.706  14.448 -19.572
   64   2HD   PRO   8          2HD       PRO   8   1.338  14.807 -21.273
   65    H    ASP   9           H        ASP   9   0.728  15.454 -17.084
   66    HA   ASP   9           HA       ASP   9   1.492  17.774 -15.455
   67   1HB   ASP   9          1HB       ASP   9  -0.186  15.437 -14.511
   68   2HB   ASP   9          2HB       ASP   9   0.455  16.705 -13.474
   69    H    TYR  10           H        TYR  10   3.614  17.527 -15.185
   70    HA   TYR  10           HA       TYR  10   4.550  14.864 -14.359
   71   1HB   TYR  10          1HB       TYR  10   5.385  15.749 -16.625
   72   2HB   TYR  10          2HB       TYR  10   6.324  16.907 -15.688
   73    HD1  TYR  10           HD1      TYR  10   8.370  16.259 -14.658
   74    HD2  TYR  10           HD2      TYR  10   5.795  13.298 -16.302
   75    HE1  TYR  10           HE1      TYR  10  10.140  14.571 -14.385
   76    HE2  TYR  10           HE2      TYR  10   7.558  11.607 -16.037
   77    HH   TYR  10           HH       TYR  10  10.376  12.152 -14.190
   78    H    THR  11           H        THR  11   4.161  15.349 -12.217
   79    HA   THR  11           HA       THR  11   6.268  16.877 -10.952
   80    HB   THR  11           HB       THR  11   4.664  18.626 -11.063
   81    HG1  THR  11           HG1      THR  11   5.306  18.812  -9.029
   82   1HG2  THR  11          1HG2      THR  11   2.702  17.300 -11.686
   83   2HG2  THR  11          2HG2      THR  11   2.587  16.689 -10.037
   84   3HG2  THR  11          3HG2      THR  11   2.332  18.403 -10.362
   85    H    TYR  12           H        TYR  12   7.119  15.530  -9.546
   86    HA   TYR  12           HA       TYR  12   5.383  13.860  -7.886
   87   1HB   TYR  12          1HB       TYR  12   7.678  12.755  -9.527
   88   2HB   TYR  12          2HB       TYR  12   6.781  11.860  -8.308
   89    HD1  TYR  12           HD1      TYR  12   4.353  11.348  -8.714
   90    HD2  TYR  12           HD2      TYR  12   6.876  12.954 -11.742
   91    HE1  TYR  12           HE1      TYR  12   2.747  10.623 -10.430
   92    HE2  TYR  12           HE2      TYR  12   5.278  12.235 -13.465
   93    HH   TYR  12           HH       TYR  12   2.124  11.193 -12.731
   94    H    ALA  13           H        ALA  13   5.964  14.620  -5.922
   95    HA   ALA  13           HA       ALA  13   8.770  15.122  -5.352
   96   1HB   ALA  13          1HB       ALA  13   8.030  15.869  -3.159
   97   2HB   ALA  13          2HB       ALA  13   7.095  16.652  -4.434
   98   3HB   ALA  13          3HB       ALA  13   6.390  15.324  -3.512
   99    H    LEU  14           H        LEU  14   6.854  13.757  -2.823
  100    HA   LEU  14           HA       LEU  14   6.825  11.792  -1.704
  101   1HB   LEU  14          1HB       LEU  14   6.270  10.828  -3.903
  102   2HB   LEU  14          2HB       LEU  14   7.977  10.620  -4.236
  103    HG   LEU  14           HG       LEU  14   8.120   9.052  -2.305
  104   1HD1  LEU  14          1HD1      LEU  14   5.118   9.343  -2.282
  105   2HD1  LEU  14          2HD1      LEU  14   6.047   8.158  -1.365
  106   3HD1  LEU  14          3HD1      LEU  14   6.227   9.878  -1.019
  107   1HD2  LEU  14          1HD2      LEU  14   6.999   7.194  -3.430
  108   2HD2  LEU  14          2HD2      LEU  14   6.099   8.337  -4.427
  109   3HD2  LEU  14          3HD2      LEU  14   7.852   8.222  -4.582
  110    H    ARG  15           H        ARG  15   9.686  13.106  -2.900
  111    HA   ARG  15           HA       ARG  15  11.527  11.205  -1.795
  112   1HB   ARG  15          1HB       ARG  15  11.805  13.897  -3.101
  113   2HB   ARG  15          2HB       ARG  15  13.188  13.079  -2.388
  114   1HG   ARG  15          1HG       ARG  15  13.122  11.349  -3.941
  115   2HG   ARG  15          2HG       ARG  15  11.455  11.698  -4.397
  116   1HD   ARG  15          1HD       ARG  15  13.631  13.700  -4.878
  117   2HD   ARG  15          2HD       ARG  15  13.364  12.369  -6.005
  118    HE   ARG  15           HE       ARG  15  10.963  13.278  -6.032
  119   1HH1  ARG  15          1HH1      ARG  15  13.798  15.282  -5.606
  120   2HH1  ARG  15          2HH1      ARG  15  13.113  16.648  -6.425
  121   1HH2  ARG  15          1HH2      ARG  15  10.053  15.073  -7.127
  122   2HH2  ARG  15          2HH2      ARG  15  10.983  16.539  -7.282
  123    H    ALA  16           H        ALA  16   9.637  13.558  -0.409
  124    HA   ALA  16           HA       ALA  16  11.434  13.660   1.918
  125   1HB   ALA  16          1HB       ALA  16  10.639  15.925   2.409
  126   2HB   ALA  16          2HB       ALA  16  11.441  15.856   0.839
  127   3HB   ALA  16          3HB       ALA  16   9.681  15.911   0.929
  128    H    ALA  17           H        ALA  17  10.455  12.224   3.251
  129    HA   ALA  17           HA       ALA  17   7.723  12.765   4.052
  130   1HB   ALA  17          1HB       ALA  17   7.445  11.281   2.122
  131   2HB   ALA  17          2HB       ALA  17   8.471  10.076   2.903
  132   3HB   ALA  17          3HB       ALA  17   6.918  10.513   3.620
  133    H    ASP  18           H        ASP  18   7.151  11.892   5.998
  134    HA   ASP  18           HA       ASP  18   9.274  10.587   7.571
  135   1HB   ASP  18          1HB       ASP  18   6.721  11.912   8.548
  136   2HB   ASP  18          2HB       ASP  18   8.003  11.264   9.557
  137    H    GLY  19           H        GLY  19   7.780   9.323   9.475
  138   1HA   GLY  19          1HA       GLY  19   6.076   7.467   7.992
  139   2HA   GLY  19          2HA       GLY  19   6.552   7.327   9.685
  140    H    ARG  20           H        ARG  20   5.926  10.168  10.112
  141    HA   ARG  20           HA       ARG  20   3.064   9.853  10.564
  142   1HB   ARG  20          1HB       ARG  20   3.436  11.970  11.954
  143   2HB   ARG  20          2HB       ARG  20   4.181  10.483  12.524
  144   1HG   ARG  20          1HG       ARG  20   6.283  11.242  11.337
  145   2HG   ARG  20          2HG       ARG  20   5.493  12.810  11.159
  146   1HD   ARG  20          1HD       ARG  20   5.447  13.181  13.461
  147   2HD   ARG  20          2HD       ARG  20   5.712  11.477  13.833
  148    HE   ARG  20           HE       ARG  20   7.789  13.219  12.650
  149   1HH1  ARG  20          1HH1      ARG  20   6.764  10.741  14.894
  150   2HH1  ARG  20          2HH1      ARG  20   8.368  10.406  15.469
  151   1HH2  ARG  20          1HH2      ARG  20   9.907  12.775  13.401
  152   2HH2  ARG  20          2HH2      ARG  20  10.149  11.558  14.611
  153    H    HIS  21           H        HIS  21   5.093  11.359   8.318
  154    HA   HIS  21           HA       HIS  21   2.826  12.965   7.352
  155   1HB   HIS  21          1HB       HIS  21   5.673  13.960   7.198
  156   2HB   HIS  21          2HB       HIS  21   4.215  14.827   6.750
  157    HD1  HIS  21           HD1      HIS  21   6.659  14.782   9.260
  158    HD2  HIS  21           HD2      HIS  21   2.516  15.178   9.282
  159    HE1  HIS  21           HE1      HIS  21   6.091  15.875  11.458
  160    HE2  HIS  21           HE2      HIS  21   3.614  16.324  11.329
  161    H    ALA  22           H        ALA  22   2.445  12.648   5.225
  162    HA   ALA  22           HA       ALA  22   4.671  11.609   3.592
  163   1HB   ALA  22          1HB       ALA  22   1.713  11.135   3.211
  164   2HB   ALA  22          2HB       ALA  22   2.995  10.544   2.154
  165   3HB   ALA  22          3HB       ALA  22   2.881   9.959   3.815
  166    H    LYS  23           H        LYS  23   5.422  13.119   2.246
  167    HA   LYS  23           HA       LYS  23   3.667  15.371   1.602
  168   1HB   LYS  23          1HB       LYS  23   6.667  15.085   1.518
  169   2HB   LYS  23          2HB       LYS  23   5.814  16.504   0.926
  170   1HG   LYS  23          1HG       LYS  23   4.883  16.870   3.160
  171   2HG   LYS  23          2HG       LYS  23   5.743  15.447   3.747
  172   1HD   LYS  23          1HD       LYS  23   7.879  16.528   3.149
  173   2HD   LYS  23          2HD       LYS  23   6.987  17.966   2.643
  174   1HE   LYS  23          1HE       LYS  23   6.097  18.204   4.911
  175   2HE   LYS  23          2HE       LYS  23   6.988  16.770   5.411
  176   1HZ   LYS  23          1HZ       LYS  23   8.217  18.665   6.073
  177   2HZ   LYS  23          2HZ       LYS  23   9.049  17.972   4.771
  178   3HZ   LYS  23          3HZ       LYS  23   8.118  19.370   4.530
  179    H    VAL  24           H        VAL  24   2.485  14.539  -0.060
  180    HA   VAL  24           HA       VAL  24   3.891  13.572  -2.424
  181    HB   VAL  24           HB       VAL  24   0.911  13.889  -1.988
  182   1HG1  VAL  24          1HG1      VAL  24   1.529  13.859  -4.337
  183   2HG1  VAL  24          2HG1      VAL  24   2.467  12.386  -4.092
  184   3HG1  VAL  24          3HG1      VAL  24   0.714  12.359  -3.899
  185   1HG2  VAL  24          1HG2      VAL  24   1.856  12.302  -0.395
  186   2HG2  VAL  24          2HG2      VAL  24   0.882  11.469  -1.607
  187   3HG2  VAL  24          3HG2      VAL  24   2.643  11.433  -1.712
  188    H    ASN  25           H        ASN  25   4.886  15.338  -3.227
  189    HA   ASN  25           HA       ASN  25   5.175  17.140  -4.555
  190   1HB   ASN  25          1HB       ASN  25   2.168  16.996  -4.850
  191   2HB   ASN  25          2HB       ASN  25   3.190  18.123  -5.738
  192   1HD2  ASN  25          2HD2      ASN  25   2.405  17.141  -7.656
  193   2HD2  ASN  25          1HD2      ASN  25   3.074  15.647  -8.217
  194    H    GLU  26           H        GLU  26   2.056  18.262  -3.379
  195    HA   GLU  26           HA       GLU  26   3.462  20.062  -1.521
  196   1HB   GLU  26          1HB       GLU  26   2.672  21.312  -3.477
  197   2HB   GLU  26          2HB       GLU  26   1.044  20.703  -3.218
  198   1HG   GLU  26          1HG       GLU  26   1.050  21.846  -1.003
  199   2HG   GLU  26          2HG       GLU  26   2.593  22.576  -1.448
  200    H    GLN  27           H        GLN  27   1.055  17.715  -1.996
  201    HA   GLN  27           HA       GLN  27  -0.636  18.596   0.178
  202   1HB   GLN  27          1HB       GLN  27  -0.766  16.134  -1.573
  203   2HB   GLN  27          2HB       GLN  27  -1.964  16.566  -0.361
  204   1HG   GLN  27          1HG       GLN  27  -2.465  18.617  -1.573
  205   2HG   GLN  27          2HG       GLN  27  -1.249  18.209  -2.779
  206   1HE2  GLN  27          2HE2      GLN  27  -3.374  15.834  -1.333
  207   2HE2  GLN  27          1HE2      GLN  27  -4.321  15.532  -2.752
  208    H    ILE  28           H        ILE  28   0.452  18.423   2.057
  209    HA   ILE  28           HA       ILE  28   1.874  16.071   2.833
  210    HB   ILE  28           HB       ILE  28   0.728  18.242   4.609
  211   1HG1  ILE  28          1HG1      ILE  28   3.503  17.944   3.431
  212   2HG1  ILE  28          2HG1      ILE  28   2.305  19.133   2.933
  213   1HG2  ILE  28          1HG2      ILE  28   2.370  17.464   6.250
  214   2HG2  ILE  28          2HG2      ILE  28   1.244  16.180   5.814
  215   3HG2  ILE  28          3HG2      ILE  28   2.875  16.187   5.143
  216   1HD1  ILE  28          1HD1      ILE  28   3.600  18.957   5.645
  217   2HD1  ILE  28          2HD1      ILE  28   3.978  20.127   4.380
  218   3HD1  ILE  28          3HD1      ILE  28   2.393  20.146   5.155
  219    H    LEU  29           H        LEU  29   0.717  14.262   2.753
  220    HA   LEU  29           HA       LEU  29  -2.010  14.224   3.763
  221   1HB   LEU  29          1HB       LEU  29  -0.377  12.067   2.421
  222   2HB   LEU  29          2HB       LEU  29  -2.078  11.949   2.831
  223    HG   LEU  29           HG       LEU  29  -0.899  13.911   0.859
  224   1HD1  LEU  29          1HD1      LEU  29  -0.795  11.638   0.018
  225   2HD1  LEU  29          2HD1      LEU  29  -2.496  11.395   0.411
  226   3HD1  LEU  29          3HD1      LEU  29  -2.036  12.556  -0.835
  227   1HD2  LEU  29          1HD2      LEU  29  -2.889  14.782   1.960
  228   2HD2  LEU  29          2HD2      LEU  29  -3.228  14.380   0.277
  229   3HD2  LEU  29          3HD2      LEU  29  -3.768  13.305   1.567
  230    H    GLN  30           H        GLN  30  -2.456  13.677   5.753
  231    HA   GLN  30           HA       GLN  30  -0.685  11.789   7.137
  232   1HB   GLN  30          1HB       GLN  30  -1.185  13.071   9.255
  233   2HB   GLN  30          2HB       GLN  30  -0.135  13.882   8.104
  234   1HG   GLN  30          1HG       GLN  30  -2.215  15.088   7.289
  235   2HG   GLN  30          2HG       GLN  30  -3.005  14.464   8.737
  236   1HE2  GLN  30          2HE2      GLN  30  -3.304  16.498   9.605
  237   2HE2  GLN  30          1HE2      GLN  30  -2.001  17.442  10.242
  238    H    GLN  31           H        GLN  31  -2.910  11.145   5.678
  239    HA   GLN  31           HA       GLN  31  -4.655  10.075   7.789
  240   1HB   GLN  31          1HB       GLN  31  -5.425  10.881   4.971
  241   2HB   GLN  31          2HB       GLN  31  -6.476  10.000   6.070
  242   1HG   GLN  31          1HG       GLN  31  -6.638  11.845   7.543
  243   2HG   GLN  31          2HG       GLN  31  -5.331  12.699   6.726
  244   1HE2  GLN  31          2HE2      GLN  31  -6.629  14.501   6.410
  245   2HE2  GLN  31          1HE2      GLN  31  -7.893  14.538   5.234
  246    H    SER  32           H        SER  32  -5.024   9.181   4.476
  247    HA   SER  32           HA       SER  32  -3.052   7.141   4.335
  248   1HB   SER  32          1HB       SER  32  -5.932   6.293   4.780
  249   2HB   SER  32          2HB       SER  32  -4.697   5.232   4.106
  250    HG   SER  32           HG       SER  32  -4.183   6.533   6.533
  251    H    PHE  33           H        PHE  33  -2.790   6.499   2.188
  252    HA   PHE  33           HA       PHE  33  -4.866   7.227   0.287
  253   1HB   PHE  33          1HB       PHE  33  -3.372   8.548  -1.124
  254   2HB   PHE  33          2HB       PHE  33  -3.541   9.276   0.465
  255    HD1  PHE  33           HD1      PHE  33  -1.669   9.119   2.093
  256    HD2  PHE  33           HD2      PHE  33  -1.278   7.847  -1.951
  257    HE1  PHE  33           HE1      PHE  33   0.778   9.233   2.298
  258    HE2  PHE  33           HE2      PHE  33   1.171   7.952  -1.751
  259    HZ   PHE  33           HZ       PHE  33   2.203   8.647   0.375
  260    H    ILE  34           H        ILE  34  -4.480   6.418  -1.863
  261    HA   ILE  34           HA       ILE  34  -2.773   4.011  -1.842
  262    HB   ILE  34           HB       ILE  34  -5.268   4.469  -3.493
  263   1HG1  ILE  34          1HG1      ILE  34  -4.923   2.712  -1.051
  264   2HG1  ILE  34          2HG1      ILE  34  -5.730   4.278  -1.045
  265   1HG2  ILE  34          1HG2      ILE  34  -3.603   1.992  -3.050
  266   2HG2  ILE  34          2HG2      ILE  34  -5.093   2.077  -3.988
  267   3HG2  ILE  34          3HG2      ILE  34  -3.662   2.956  -4.524
  268   1HD1  ILE  34          1HD1      ILE  34  -7.335   2.460  -1.117
  269   2HD1  ILE  34          2HD1      ILE  34  -7.406   3.416  -2.597
  270   3HD1  ILE  34          3HD1      ILE  34  -6.597   1.850  -2.598
  271    H    LEU  35           H        LEU  35  -0.988   4.400  -2.988
  272    HA   LEU  35           HA       LEU  35  -1.185   6.143  -5.351
  273   1HB   LEU  35          1HB       LEU  35   0.408   6.892  -3.668
  274   2HB   LEU  35          2HB       LEU  35   1.209   5.332  -3.696
  275    HG   LEU  35           HG       LEU  35   1.914   5.744  -6.024
  276   1HD1  LEU  35          1HD1      LEU  35   1.655   7.960  -7.006
  277   2HD1  LEU  35          2HD1      LEU  35   0.087   7.212  -6.706
  278   3HD1  LEU  35          3HD1      LEU  35   0.687   8.469  -5.623
  279   1HD2  LEU  35          1HD2      LEU  35   3.391   6.336  -4.176
  280   2HD2  LEU  35          2HD2      LEU  35   3.578   7.458  -5.524
  281   3HD2  LEU  35          3HD2      LEU  35   2.660   7.938  -4.096
  282    H    MET  36           H        MET  36  -1.201   5.196  -7.262
  283    HA   MET  36           HA       MET  36   0.406   2.763  -7.639
  284   1HB   MET  36          1HB       MET  36  -2.400   3.241  -8.670
  285   2HB   MET  36          2HB       MET  36  -1.361   1.930  -9.209
  286   1HG   MET  36          1HG       MET  36  -1.288   1.081  -6.893
  287   2HG   MET  36          2HG       MET  36  -2.412   2.355  -6.421
  288   1HE   MET  36          1HE       MET  36  -2.376   0.264  -9.766
  289   2HE   MET  36          2HE       MET  36  -3.461  -1.063  -9.344
  290   3HE   MET  36          3HE       MET  36  -1.902  -0.909  -8.536
  291    HA   PRO  37           HA       PRO  37   1.936   4.852 -11.253
  292   1HB   PRO  37          1HB       PRO  37   1.860   2.359 -12.798
  293   2HB   PRO  37          2HB       PRO  37   3.254   3.297 -12.256
  294   1HG   PRO  37          1HG       PRO  37   2.651   0.898 -11.193
  295   2HG   PRO  37          2HG       PRO  37   3.372   2.202 -10.231
  296   1HD   PRO  37          1HD       PRO  37   0.511   1.318 -10.381
  297   2HD   PRO  37          2HD       PRO  37   1.478   1.761  -8.956
  298    H    ASP  38           H        ASP  38  -1.089   4.250 -10.967
  299    HA   ASP  38           HA       ASP  38  -1.784   4.733 -13.788
  300   1HB   ASP  38          1HB       ASP  38  -2.621   2.546 -12.829
  301   2HB   ASP  38          2HB       ASP  38  -3.590   3.488 -11.702
  302    H    GLU  39           H        GLU  39  -3.340   5.085 -10.599
  303    HA   GLU  39           HA       GLU  39  -3.384   7.981 -10.958
  304   1HB   GLU  39          1HB       GLU  39  -5.809   6.274 -10.422
  305   2HB   GLU  39          2HB       GLU  39  -5.759   7.986 -10.032
  306   1HG   GLU  39          1HG       GLU  39  -5.244   8.438 -12.429
  307   2HG   GLU  39          2HG       GLU  39  -5.526   6.726 -12.750
  308    H    LEU  40           H        LEU  40  -4.640   8.813  -8.782
  309    HA   LEU  40           HA       LEU  40  -3.312   7.484  -6.524
  310   1HB   LEU  40          1HB       LEU  40  -1.908   9.339  -7.114
  311   2HB   LEU  40          2HB       LEU  40  -3.284  10.419  -7.224
  312    HG   LEU  40           HG       LEU  40  -3.621  10.195  -4.776
  313   1HD1  LEU  40          1HD1      LEU  40  -1.848   9.214  -3.413
  314   2HD1  LEU  40          2HD1      LEU  40  -2.605   8.007  -4.451
  315   3HD1  LEU  40          3HD1      LEU  40  -1.023   8.667  -4.872
  316   1HD2  LEU  40          1HD2      LEU  40  -1.693  11.557  -4.129
  317   2HD2  LEU  40          2HD2      LEU  40  -0.883  11.119  -5.634
  318   3HD2  LEU  40          3HD2      LEU  40  -2.368  12.069  -5.675
  319    H    VAL  41           H        VAL  41  -4.779   6.913  -5.085
  320    HA   VAL  41           HA       VAL  41  -7.285   8.389  -4.825
  321    HB   VAL  41           HB       VAL  41  -6.333   5.949  -3.303
  322   1HG1  VAL  41          1HG1      VAL  41  -9.074   7.191  -3.531
  323   2HG1  VAL  41          2HG1      VAL  41  -8.697   5.681  -2.701
  324   3HG1  VAL  41          3HG1      VAL  41  -8.038   7.204  -2.102
  325   1HG2  VAL  41          1HG2      VAL  41  -7.836   4.676  -4.771
  326   2HG2  VAL  41          2HG2      VAL  41  -8.159   6.140  -5.699
  327   3HG2  VAL  41          3HG2      VAL  41  -6.535   5.451  -5.673
  328    H    GLU  42           H        GLU  42  -7.231  10.161  -3.607
  329    HA   GLU  42           HA       GLU  42  -4.996  10.796  -1.985
  330   1HB   GLU  42          1HB       GLU  42  -7.671  12.174  -2.220
  331   2HB   GLU  42          2HB       GLU  42  -6.242  12.856  -1.460
  332   1HG   GLU  42          1HG       GLU  42  -5.069  12.829  -3.579
  333   2HG   GLU  42          2HG       GLU  42  -6.462  12.074  -4.357
  334    H    HIS  43           H        HIS  43  -8.306   9.780  -1.186
  335    HA   HIS  43           HA       HIS  43  -7.484   9.763   1.646
  336   1HB   HIS  43          1HB       HIS  43 -10.243  10.419   0.594
  337   2HB   HIS  43          2HB       HIS  43  -9.755  10.393   2.286
  338    HD1  HIS  43           HD1      HIS  43  -8.293  12.385   3.130
  339    HD2  HIS  43           HD2      HIS  43  -9.532  12.700  -0.828
  340    HE1  HIS  43           HE1      HIS  43  -7.815  14.761   2.454
  341    HE2  HIS  43           HE2      HIS  43  -8.395  14.869   0.002
  342    H    TRP  44           H        TRP  44  -7.118   7.681   2.011
  343    HA   TRP  44           HA       TRP  44  -9.238   5.746   1.371
  344   1HB   TRP  44          1HB       TRP  44  -6.841   5.284   0.695
  345   2HB   TRP  44          2HB       TRP  44  -6.445   5.201   2.406
  346    HD1  TRP  44           HD1      TRP  44  -9.583   3.579   0.832
  347    HE1  TRP  44           HE1      TRP  44  -9.414   1.027   1.161
  348    HE3  TRP  44           HE3      TRP  44  -4.890   3.333   2.847
  349    HZ2  TRP  44           HZ2      TRP  44  -7.533  -0.834   2.140
  350    HZ3  TRP  44           HZ3      TRP  44  -3.979   1.131   3.449
  351    HH2  TRP  44           HH2      TRP  44  -5.273  -0.910   3.104
  352    HA   PRO  45           HA       PRO  45 -10.389   6.585   5.597
  353   1HB   PRO  45          1HB       PRO  45 -12.528   4.638   5.209
  354   2HB   PRO  45          2HB       PRO  45 -12.634   6.385   5.441
  355   1HG   PRO  45          1HG       PRO  45 -13.210   5.193   3.082
  356   2HG   PRO  45          2HG       PRO  45 -12.524   6.825   3.188
  357   1HD   PRO  45          1HD       PRO  45 -11.153   4.227   2.584
  358   2HD   PRO  45          2HD       PRO  45 -10.941   5.816   1.818
  359    H    VAL  46           H        VAL  46  -8.312   5.204   5.998
  360    HA   VAL  46           HA       VAL  46  -9.205   3.014   7.746
  361    HB   VAL  46           HB       VAL  46  -6.671   2.960   6.085
  362   1HG1  VAL  46          1HG1      VAL  46  -6.362   0.710   7.004
  363   2HG1  VAL  46          2HG1      VAL  46  -6.351   1.938   8.270
  364   3HG1  VAL  46          3HG1      VAL  46  -7.781   0.935   8.025
  365   1HG2  VAL  46          1HG2      VAL  46  -7.690   1.008   4.984
  366   2HG2  VAL  46          2HG2      VAL  46  -9.175   1.291   5.892
  367   3HG2  VAL  46          3HG2      VAL  46  -8.618   2.485   4.720
  368    HA   PRO  47           HA       PRO  47  -6.914   5.933  10.389
  369   1HB   PRO  47          1HB       PRO  47  -8.095   5.102  12.698
  370   2HB   PRO  47          2HB       PRO  47  -8.817   6.299  11.618
  371   1HG   PRO  47          1HG       PRO  47  -9.415   3.386  11.891
  372   2HG   PRO  47          2HG       PRO  47 -10.530   4.741  11.647
  373   1HD   PRO  47          1HD       PRO  47  -9.748   3.078   9.641
  374   2HD   PRO  47          2HD       PRO  47 -10.187   4.778   9.377
  375    H    SER  48           H        SER  48  -4.965   4.892  10.049
  376    HA   SER  48           HA       SER  48  -3.161   3.597  10.399
  377   1HB   SER  48          1HB       SER  48  -2.609   2.954  12.678
  378   2HB   SER  48          2HB       SER  48  -3.300   4.572  12.666
  379    HG   SER  48           HG       SER  48  -5.365   3.198  13.058
  380    H    LEU  49           H        LEU  49  -2.506   1.260  11.447
  381    HA   LEU  49           HA       LEU  49  -4.188  -0.562   9.957
  382   1HB   LEU  49          1HB       LEU  49  -1.704  -0.636   9.851
  383   2HB   LEU  49          2HB       LEU  49  -1.677  -1.132  11.532
  384    HG   LEU  49           HG       LEU  49  -2.763  -3.223  10.997
  385   1HD1  LEU  49          1HD1      LEU  49  -2.862  -2.223   8.155
  386   2HD1  LEU  49          2HD1      LEU  49  -3.346  -3.825   8.712
  387   3HD1  LEU  49          3HD1      LEU  49  -4.246  -2.400   9.235
  388   1HD2  LEU  49          1HD2      LEU  49  -1.065  -4.231   9.569
  389   2HD2  LEU  49          2HD2      LEU  49  -0.545  -2.628   9.046
  390   3HD2  LEU  49          3HD2      LEU  49  -0.341  -3.117  10.728
  391    H    GLY  50           H        GLY  50  -5.590   0.480  12.027
  392   1HA   GLY  50          1HA       GLY  50  -5.825  -1.815  13.874
  393   2HA   GLY  50          2HA       GLY  50  -6.247  -0.165  14.313
  394    H    GLN  51           H        GLN  51  -7.338   0.012  11.420
  395    HA   GLN  51           HA       GLN  51  -9.859  -1.430  11.899
  396   1HB   GLN  51          1HB       GLN  51  -9.940   1.044  12.491
  397   2HB   GLN  51          2HB       GLN  51  -9.699   1.374  10.782
  398   1HG   GLN  51          1HG       GLN  51 -12.034   1.541  11.319
  399   2HG   GLN  51          2HG       GLN  51 -11.771   0.148  10.273
  400   1HE2  GLN  51          2HE2      GLN  51 -13.650  -0.878  10.929
  401   2HE2  GLN  51          1HE2      GLN  51 -13.824  -1.578  12.500
  402    H    LEU  52           H        LEU  52  -7.509  -1.983  10.171
  403    HA   LEU  52           HA       LEU  52  -8.490  -1.543   7.492
  404   1HB   LEU  52          1HB       LEU  52  -6.073  -1.589   7.875
  405   2HB   LEU  52          2HB       LEU  52  -6.186  -3.242   8.452
  406    HG   LEU  52           HG       LEU  52  -6.915  -3.988   6.234
  407   1HD1  LEU  52          1HD1      LEU  52  -6.856  -2.460   4.329
  408   2HD1  LEU  52          2HD1      LEU  52  -8.062  -1.964   5.515
  409   3HD1  LEU  52          3HD1      LEU  52  -6.521  -1.112   5.416
  410   1HD2  LEU  52          1HD2      LEU  52  -4.544  -4.022   6.714
  411   2HD2  LEU  52          2HD2      LEU  52  -4.813  -3.593   5.025
  412   3HD2  LEU  52          3HD2      LEU  52  -4.390  -2.343   6.195
  413    H    GLN  53           H        GLN  53 -10.319  -2.550   7.115
  414    HA   GLN  53           HA       GLN  53 -10.565  -5.405   7.744
  415   1HB   GLN  53          1HB       GLN  53 -12.702  -3.430   6.906
  416   2HB   GLN  53          2HB       GLN  53 -12.961  -5.078   7.463
  417   1HG   GLN  53          1HG       GLN  53 -12.478  -4.551   9.663
  418   2HG   GLN  53          2HG       GLN  53 -11.589  -3.092   9.221
  419   1HE2  GLN  53          2HE2      GLN  53 -14.733  -4.506   9.681
  420   2HE2  GLN  53          1HE2      GLN  53 -15.616  -3.009   9.698
  421    HA   PRO  54           HA       PRO  54 -10.248  -6.603   3.462
  422   1HB   PRO  54          1HB       PRO  54 -12.753  -8.143   3.948
  423   2HB   PRO  54          2HB       PRO  54 -11.210  -8.686   3.279
  424   1HG   PRO  54          1HG       PRO  54 -11.885  -9.313   5.770
  425   2HG   PRO  54          2HG       PRO  54 -10.215  -8.865   5.372
  426   1HD   PRO  54          1HD       PRO  54 -12.343  -7.255   6.721
  427   2HD   PRO  54          2HD       PRO  54 -10.598  -7.320   7.047
  428    H    ALA  55           H        ALA  55 -13.337  -5.519   4.755
  429    HA   ALA  55           HA       ALA  55 -14.617  -4.956   2.311
  430   1HB   ALA  55          1HB       ALA  55 -15.797  -5.076   4.454
  431   2HB   ALA  55          2HB       ALA  55 -14.997  -3.593   4.975
  432   3HB   ALA  55          3HB       ALA  55 -16.119  -3.560   3.614
  433    H    HIS  56           H        HIS  56 -12.402  -3.058   4.309
  434    HA   HIS  56           HA       HIS  56 -12.610  -0.704   2.664
  435   1HB   HIS  56          1HB       HIS  56 -10.720  -1.504   4.874
  436   2HB   HIS  56          2HB       HIS  56 -10.494  -0.026   3.951
  437    HD1  HIS  56           HD1      HIS  56 -11.097  -0.144   7.049
  438    HD2  HIS  56           HD2      HIS  56 -13.884   0.616   4.057
  439    HE1  HIS  56           HE1      HIS  56 -12.945   1.138   8.159
  440    HE2  HIS  56           HE2      HIS  56 -14.717   1.383   6.390
  441    H    MET  57           H        MET  57 -10.807  -3.626   2.602
  442    HA   MET  57           HA       MET  57  -8.653  -2.611   0.969
  443   1HB   MET  57          1HB       MET  57  -8.263  -4.444   2.554
  444   2HB   MET  57          2HB       MET  57  -9.424  -5.446   1.697
  445   1HG   MET  57          1HG       MET  57  -7.172  -6.093   1.129
  446   2HG   MET  57          2HG       MET  57  -7.986  -5.421  -0.280
  447   1HE   MET  57          1HE       MET  57  -6.364  -3.547   2.806
  448   2HE   MET  57          2HE       MET  57  -4.752  -3.214   2.169
  449   3HE   MET  57          3HE       MET  57  -5.256  -4.878   2.470
  450    H    ASP  58           H        ASP  58 -11.805  -3.799   0.464
  451    HA   ASP  58           HA       ASP  58 -11.695  -5.117  -1.959
  452   1HB   ASP  58          1HB       ASP  58 -13.756  -4.978  -0.698
  453   2HB   ASP  58          2HB       ASP  58 -13.825  -3.233  -0.929
  454    H    ALA  59           H        ALA  59 -11.665  -1.649  -1.348
  455    HA   ALA  59           HA       ALA  59 -12.005  -0.747  -3.975
  456   1HB   ALA  59          1HB       ALA  59 -12.144   0.717  -2.013
  457   2HB   ALA  59          2HB       ALA  59 -10.408   0.539  -1.761
  458   3HB   ALA  59          3HB       ALA  59 -11.011   1.343  -3.212
  459    H    VAL  60           H        VAL  60  -9.055  -1.555  -2.174
  460    HA   VAL  60           HA       VAL  60  -7.237  -0.832  -4.221
  461    HB   VAL  60           HB       VAL  60  -6.803  -2.895  -2.052
  462   1HG1  VAL  60          1HG1      VAL  60  -4.440  -2.288  -2.281
  463   2HG1  VAL  60          2HG1      VAL  60  -5.101  -2.923  -3.789
  464   3HG1  VAL  60          3HG1      VAL  60  -4.856  -1.187  -3.595
  465   1HG2  VAL  60          1HG2      VAL  60  -7.593  -0.814  -1.065
  466   2HG2  VAL  60          2HG2      VAL  60  -5.886  -1.066  -0.702
  467   3HG2  VAL  60          3HG2      VAL  60  -6.362   0.087  -1.948
  468    H    LEU  61           H        LEU  61  -8.847  -3.845  -3.352
  469    HA   LEU  61           HA       LEU  61  -7.580  -5.516  -5.229
  470   1HB   LEU  61          1HB       LEU  61 -10.370  -5.705  -4.085
  471   2HB   LEU  61          2HB       LEU  61  -9.535  -6.992  -4.935
  472    HG   LEU  61           HG       LEU  61  -8.670  -5.788  -2.304
  473   1HD1  LEU  61          1HD1      LEU  61 -10.692  -7.118  -2.078
  474   2HD1  LEU  61          2HD1      LEU  61  -9.927  -8.451  -2.944
  475   3HD1  LEU  61          3HD1      LEU  61  -9.313  -7.957  -1.367
  476   1HD2  LEU  61          1HD2      LEU  61  -6.779  -6.557  -3.642
  477   2HD2  LEU  61          2HD2      LEU  61  -7.044  -7.610  -2.252
  478   3HD2  LEU  61          3HD2      LEU  61  -7.561  -8.123  -3.858
  479    H    ALA  62           H        ALA  62 -10.359  -3.370  -5.456
  480    HA   ALA  62           HA       ALA  62 -11.267  -4.219  -8.000
  481   1HB   ALA  62          1HB       ALA  62 -12.548  -2.145  -8.031
  482   2HB   ALA  62          2HB       ALA  62 -12.673  -2.939  -6.461
  483   3HB   ALA  62          3HB       ALA  62 -11.619  -1.538  -6.661
  484    H    LEU  63           H        LEU  63  -8.804  -1.960  -6.963
  485    HA   LEU  63           HA       LEU  63  -8.359  -0.763  -9.505
  486   1HB   LEU  63          1HB       LEU  63  -6.931  -0.853  -6.909
  487   2HB   LEU  63          2HB       LEU  63  -5.966  -0.473  -8.319
  488    HG   LEU  63           HG       LEU  63  -6.706   1.558  -7.198
  489   1HD1  LEU  63          1HD1      LEU  63  -8.074   1.124  -9.844
  490   2HD1  LEU  63          2HD1      LEU  63  -7.722   2.690  -9.112
  491   3HD1  LEU  63          3HD1      LEU  63  -6.401   1.627  -9.600
  492   1HD2  LEU  63          1HD2      LEU  63  -9.505   0.608  -7.788
  493   2HD2  LEU  63          2HD2      LEU  63  -8.761   0.714  -6.192
  494   3HD2  LEU  63          3HD2      LEU  63  -9.063   2.181  -7.123
  495    H    ASN  64           H        ASN  64  -7.643  -3.832  -8.262
  496    HA   ASN  64           HA       ASN  64  -6.548  -5.646  -9.065
  497   1HB   ASN  64          1HB       ASN  64  -6.805  -4.028 -11.580
  498   2HB   ASN  64          2HB       ASN  64  -5.888  -5.526 -11.584
  499   1HD2  ASN  64          2HD2      ASN  64  -8.737  -5.030  -9.609
  500   2HD2  ASN  64          1HD2      ASN  64  -9.753  -6.131 -10.473
  501    HA   PRO  65           HA       PRO  65  -2.344  -3.928  -8.740
  502   1HB   PRO  65          1HB       PRO  65  -1.912  -4.845  -6.170
  503   2HB   PRO  65          2HB       PRO  65  -2.472  -3.225  -6.584
  504   1HG   PRO  65          1HG       PRO  65  -3.913  -5.304  -5.237
  505   2HG   PRO  65          2HG       PRO  65  -4.469  -3.674  -5.641
  506   1HD   PRO  65          1HD       PRO  65  -4.984  -6.232  -7.015
  507   2HD   PRO  65          2HD       PRO  65  -5.903  -4.713  -7.071
  508    H    ALA  66           H        ALA  66  -0.371  -5.074  -8.753
  509    HA   ALA  66           HA       ALA  66  -0.628  -7.988  -8.944
  510   1HB   ALA  66          1HB       ALA  66   1.664  -6.187  -9.742
  511   2HB   ALA  66          2HB       ALA  66   1.567  -7.926 -10.023
  512   3HB   ALA  66          3HB       ALA  66   0.437  -6.838 -10.831
  513    H    VAL  67           H        VAL  67   0.806  -5.434  -7.099
  514    HA   VAL  67           HA       VAL  67   1.385  -7.278  -4.945
  515    HB   VAL  67           HB       VAL  67   3.508  -7.322  -6.160
  516   1HG1  VAL  67          1HG1      VAL  67   3.348  -5.210  -7.346
  517   2HG1  VAL  67          2HG1      VAL  67   3.528  -4.326  -5.830
  518   3HG1  VAL  67          3HG1      VAL  67   4.862  -5.301  -6.445
  519   1HG2  VAL  67          1HG2      VAL  67   5.010  -6.585  -4.369
  520   2HG2  VAL  67          2HG2      VAL  67   3.685  -5.684  -3.633
  521   3HG2  VAL  67          3HG2      VAL  67   3.605  -7.443  -3.736
  522    H    ILE  68           H        ILE  68   1.239  -6.263  -2.933
  523    HA   ILE  68           HA       ILE  68   0.557  -3.392  -3.061
  524    HB   ILE  68           HB       ILE  68  -0.635  -5.431  -1.170
  525   1HG1  ILE  68          1HG1      ILE  68  -1.903  -4.031  -3.537
  526   2HG1  ILE  68          2HG1      ILE  68  -1.399  -5.717  -3.516
  527   1HG2  ILE  68          1HG2      ILE  68  -1.309  -2.525  -1.626
  528   2HG2  ILE  68          2HG2      ILE  68  -2.157  -3.623  -0.536
  529   3HG2  ILE  68          3HG2      ILE  68  -0.477  -3.185  -0.218
  530   1HD1  ILE  68          1HD1      ILE  68  -3.518  -4.490  -1.768
  531   2HD1  ILE  68          2HD1      ILE  68  -3.793  -5.499  -3.187
  532   3HD1  ILE  68          3HD1      ILE  68  -3.020  -6.182  -1.757
  533    H    LEU  69           H        LEU  69   1.730  -2.093  -1.840
  534    HA   LEU  69           HA       LEU  69   3.348  -3.244   0.332
  535   1HB   LEU  69          1HB       LEU  69   3.588  -0.601  -1.114
  536   2HB   LEU  69          2HB       LEU  69   4.597  -1.090   0.233
  537    HG   LEU  69           HG       LEU  69   4.494  -2.413  -2.478
  538   1HD1  LEU  69          1HD1      LEU  69   6.790  -1.570  -2.676
  539   2HD1  LEU  69          2HD1      LEU  69   5.617  -0.262  -2.515
  540   3HD1  LEU  69          3HD1      LEU  69   6.606  -0.734  -1.134
  541   1HD2  LEU  69          1HD2      LEU  69   4.906  -4.030  -0.684
  542   2HD2  LEU  69          2HD2      LEU  69   6.342  -3.780  -1.677
  543   3HD2  LEU  69          3HD2      LEU  69   6.227  -3.026  -0.087
  544    H    LEU  70           H        LEU  70   2.915  -2.704   2.398
  545    HA   LEU  70           HA       LEU  70   0.810  -0.684   2.822
  546   1HB   LEU  70          1HB       LEU  70   0.106  -2.995   3.321
  547   2HB   LEU  70          2HB       LEU  70   1.423  -3.141   4.468
  548    HG   LEU  70           HG       LEU  70   0.396  -1.329   5.822
  549   1HD1  LEU  70          1HD1      LEU  70  -1.906  -0.667   5.365
  550   2HD1  LEU  70          2HD1      LEU  70  -0.832  -0.200   4.046
  551   3HD1  LEU  70          3HD1      LEU  70  -1.885  -1.606   3.872
  552   1HD2  LEU  70          1HD2      LEU  70  -1.431  -2.687   6.705
  553   2HD2  LEU  70          2HD2      LEU  70  -1.391  -3.690   5.256
  554   3HD2  LEU  70          3HD2      LEU  70  -0.012  -3.674   6.354
  555    H    GLY  71           H        GLY  71   1.648   1.112   3.633
  556   1HA   GLY  71          1HA       GLY  71   3.940   0.925   5.468
  557   2HA   GLY  71          2HA       GLY  71   3.385   2.388   4.659
  558    H    THR  72           H        THR  72   3.557   0.958   7.594
  559    HA   THR  72           HA       THR  72   0.890   1.726   8.491
  560    HB   THR  72           HB       THR  72   1.586   0.624  10.632
  561    HG1  THR  72           HG1      THR  72   3.831   0.796  10.490
  562   1HG2  THR  72          1HG2      THR  72   1.853  -1.026   8.119
  563   2HG2  THR  72          2HG2      THR  72   1.491  -1.652   9.728
  564   3HG2  THR  72          3HG2      THR  72   0.341  -0.590   8.915
  565    H    GLY  73           H        GLY  73   2.622   3.882   7.796
  566   1HA   GLY  73          1HA       GLY  73   3.097   5.957   8.631
  567   2HA   GLY  73          2HA       GLY  73   2.367   5.451  10.142
  568    H    GLU  74           H        GLU  74   3.766   6.215  11.564
  569    HA   GLU  74           HA       GLU  74   6.623   6.099  11.152
  570   1HB   GLU  74          1HB       GLU  74   5.289   8.039  12.164
  571   2HB   GLU  74          2HB       GLU  74   5.161   7.056  13.613
  572   1HG   GLU  74          1HG       GLU  74   6.946   8.607  13.896
  573   2HG   GLU  74          2HG       GLU  74   7.633   6.992  13.728
  574    H    ARG  75           H        ARG  75   4.279   4.108  12.500
  575    HA   ARG  75           HA       ARG  75   6.262   2.724  14.178
  576   1HB   ARG  75          1HB       ARG  75   4.378   1.847  15.497
  577   2HB   ARG  75          2HB       ARG  75   4.426   3.604  15.536
  578   1HG   ARG  75          1HG       ARG  75   2.623   3.727  13.932
  579   2HG   ARG  75          2HG       ARG  75   2.621   1.971  13.762
  580   1HD   ARG  75          1HD       ARG  75   0.814   2.704  15.220
  581   2HD   ARG  75          2HD       ARG  75   1.988   1.741  16.113
  582    HE   ARG  75           HE       ARG  75   2.768   4.354  16.468
  583   1HH1  ARG  75          1HH1      ARG  75  -0.084   2.434  17.183
  584   2HH1  ARG  75          2HH1      ARG  75  -0.548   3.421  18.537
  585   1HH2  ARG  75          1HH2      ARG  75   2.166   5.621  18.256
  586   2HH2  ARG  75          2HH2      ARG  75   0.728   5.223  19.158
  587    H    GLN  76           H        GLN  76   5.978   0.341  14.247
  588    HA   GLN  76           HA       GLN  76   5.107  -0.626  11.620
  589   1HB   GLN  76          1HB       GLN  76   7.406  -1.173  12.281
  590   2HB   GLN  76          2HB       GLN  76   6.805  -1.982  13.723
  591   1HG   GLN  76          1HG       GLN  76   5.734  -3.669  12.403
  592   2HG   GLN  76          2HG       GLN  76   6.129  -2.813  10.913
  593   1HE2  GLN  76          2HE2      GLN  76   8.229  -2.853  10.146
  594   2HE2  GLN  76          1HE2      GLN  76   9.398  -4.003  10.704
  595    H    GLN  77           H        GLN  77   3.195  -1.529  11.454
  596    HA   GLN  77           HA       GLN  77   2.054  -2.885  13.811
  597   1HB   GLN  77          1HB       GLN  77   0.581  -1.455  11.584
  598   2HB   GLN  77          2HB       GLN  77  -0.173  -2.311  12.922
  599   1HG   GLN  77          1HG       GLN  77   0.825  -0.726  14.494
  600   2HG   GLN  77          2HG       GLN  77   1.562   0.138  13.144
  601   1HE2  GLN  77          2HE2      GLN  77  -1.406  -0.606  14.802
  602   2HE2  GLN  77          1HE2      GLN  77  -2.362   0.628  14.053
  603    H    PHE  78           H        PHE  78   0.752  -4.768  13.377
  604    HA   PHE  78           HA       PHE  78   1.483  -6.074  10.839
  605   1HB   PHE  78          1HB       PHE  78   2.401  -7.130  12.909
  606   2HB   PHE  78          2HB       PHE  78   0.750  -7.405  13.455
  607    HD1  PHE  78           HD1      PHE  78  -0.364  -9.354  12.862
  608    HD2  PHE  78           HD2      PHE  78   3.078  -8.159  10.664
  609    HE1  PHE  78           HE1      PHE  78  -0.412 -11.487  11.634
  610    HE2  PHE  78           HE2      PHE  78   3.036 -10.287   9.432
  611    HZ   PHE  78           HZ       PHE  78   1.289 -11.953   9.915
  612    HA   PRO  79           HA       PRO  79  -2.873  -5.866   9.963
  613   1HB   PRO  79          1HB       PRO  79  -2.435  -7.673   7.735
  614   2HB   PRO  79          2HB       PRO  79  -2.804  -5.948   7.705
  615   1HG   PRO  79          1HG       PRO  79  -0.396  -6.986   6.957
  616   2HG   PRO  79          2HG       PRO  79  -0.600  -5.349   7.604
  617   1HD   PRO  79          1HD       PRO  79   0.370  -7.822   8.976
  618   2HD   PRO  79          2HD       PRO  79   0.933  -6.145   9.132
  619    H    SER  80           H        SER  80  -4.721  -7.299   9.628
  620    HA   SER  80           HA       SER  80  -4.581  -9.588  11.336
  621   1HB   SER  80          1HB       SER  80  -7.029  -9.795  10.710
  622   2HB   SER  80          2HB       SER  80  -6.569  -8.258  11.445
  623    HG   SER  80           HG       SER  80  -7.661  -7.601   9.712
  624    H    THR  81           H        THR  81  -5.124 -11.751  10.747
  625    HA   THR  81           HA       THR  81  -3.804 -12.673   8.460
  626    HB   THR  81           HB       THR  81  -4.915 -14.862   9.120
  627    HG1  THR  81           HG1      THR  81  -6.250 -14.877  10.821
  628   1HG2  THR  81          1HG2      THR  81  -3.389 -13.340  11.230
  629   2HG2  THR  81          2HG2      THR  81  -3.560 -15.094  11.150
  630   3HG2  THR  81          3HG2      THR  81  -2.678 -14.236   9.887
  631    H    ASP  82           H        ASP  82  -7.135 -11.883   9.108
  632    HA   ASP  82           HA       ASP  82  -8.413 -13.169   6.986
  633   1HB   ASP  82          1HB       ASP  82  -9.076 -10.475   8.205
  634   2HB   ASP  82          2HB       ASP  82 -10.165 -11.449   7.223
  635    H    VAL  83           H        VAL  83  -6.961  -9.931   7.144
  636    HA   VAL  83           HA       VAL  83  -7.505  -9.267   4.435
  637    HB   VAL  83           HB       VAL  83  -5.404  -8.118   6.287
  638   1HG1  VAL  83          1HG1      VAL  83  -6.567  -7.008   3.734
  639   2HG1  VAL  83          2HG1      VAL  83  -5.450  -6.165   4.808
  640   3HG1  VAL  83          3HG1      VAL  83  -4.926  -7.615   3.949
  641   1HG2  VAL  83          1HG2      VAL  83  -7.639  -7.894   7.211
  642   2HG2  VAL  83          2HG2      VAL  83  -7.041  -6.325   6.670
  643   3HG2  VAL  83          3HG2      VAL  83  -8.216  -7.205   5.694
  644    H    LEU  84           H        LEU  84  -4.701 -10.626   6.106
  645    HA   LEU  84           HA       LEU  84  -2.898 -10.655   3.974
  646   1HB   LEU  84          1HB       LEU  84  -3.184 -12.634   6.237
  647   2HB   LEU  84          2HB       LEU  84  -1.792 -12.515   5.178
  648    HG   LEU  84           HG       LEU  84  -2.729 -10.344   7.056
  649   1HD1  LEU  84          1HD1      LEU  84  -1.855 -12.267   8.264
  650   2HD1  LEU  84          2HD1      LEU  84  -0.400 -12.245   7.267
  651   3HD1  LEU  84          3HD1      LEU  84  -0.741 -10.904   8.361
  652   1HD2  LEU  84          1HD2      LEU  84  -0.255 -10.556   5.343
  653   2HD2  LEU  84          2HD2      LEU  84  -1.608  -9.451   5.090
  654   3HD2  LEU  84          3HD2      LEU  84  -0.588  -9.283   6.518
  655    H    ALA  85           H        ALA  85  -5.151 -13.192   5.054
  656    HA   ALA  85           HA       ALA  85  -4.529 -15.049   3.039
  657   1HB   ALA  85          1HB       ALA  85  -5.734 -15.629   5.097
  658   2HB   ALA  85          2HB       ALA  85  -7.139 -14.731   4.518
  659   3HB   ALA  85          3HB       ALA  85  -6.592 -16.168   3.654
  660    H    ALA  86           H        ALA  86  -6.962 -12.479   3.173
  661    HA   ALA  86           HA       ALA  86  -8.358 -13.074   0.834
  662   1HB   ALA  86          1HB       ALA  86  -9.073 -10.745   0.843
  663   2HB   ALA  86          2HB       ALA  86  -9.112 -11.418   2.471
  664   3HB   ALA  86          3HB       ALA  86  -7.797 -10.345   1.992
  665    H    CYS  87           H        CYS  87  -5.482 -11.038   1.284
  666    HA   CYS  87           HA       CYS  87  -5.251 -10.271  -1.429
  667   1HB   CYS  87          1HB       CYS  87  -3.065 -10.446   0.657
  668   2HB   CYS  87          2HB       CYS  87  -3.016  -9.505  -0.830
  669    HG   CYS  87           HG       CYS  87  -4.891  -8.920   1.960
  670    H    LEU  88           H        LEU  88  -3.748 -12.861   0.467
  671    HA   LEU  88           HA       LEU  88  -2.059 -13.833  -1.561
  672   1HB   LEU  88          1HB       LEU  88  -3.278 -15.268   0.797
  673   2HB   LEU  88          2HB       LEU  88  -1.988 -15.911  -0.203
  674    HG   LEU  88           HG       LEU  88  -1.808 -13.413   1.484
  675   1HD1  LEU  88          1HD1      LEU  88  -1.899 -15.417   2.849
  676   2HD1  LEU  88          2HD1      LEU  88  -0.616 -16.152   1.888
  677   3HD1  LEU  88          3HD1      LEU  88  -0.277 -14.726   2.870
  678   1HD2  LEU  88          1HD2      LEU  88   0.572 -13.472   0.927
  679   2HD2  LEU  88          2HD2      LEU  88   0.292 -14.851  -0.137
  680   3HD2  LEU  88          3HD2      LEU  88  -0.422 -13.284  -0.517
  681    H    THR  89           H        THR  89  -5.384 -14.644  -0.689
  682    HA   THR  89           HA       THR  89  -5.716 -16.805  -2.468
  683    HB   THR  89           HB       THR  89  -7.846 -14.872  -1.520
  684    HG1  THR  89           HG1      THR  89  -6.790 -15.779   0.264
  685   1HG2  THR  89          1HG2      THR  89  -8.041 -17.735  -2.467
  686   2HG2  THR  89          2HG2      THR  89  -9.373 -16.763  -1.843
  687   3HG2  THR  89          3HG2      THR  89  -8.586 -16.313  -3.356
  688    H    ARG  90           H        ARG  90  -6.044 -13.323  -2.852
  689    HA   ARG  90           HA       ARG  90  -7.117 -13.404  -5.496
  690   1HB   ARG  90          1HB       ARG  90  -7.347 -11.456  -3.972
  691   2HB   ARG  90          2HB       ARG  90  -5.617 -11.180  -4.089
  692   1HG   ARG  90          1HG       ARG  90  -6.478  -9.639  -5.569
  693   2HG   ARG  90          2HG       ARG  90  -6.053 -10.982  -6.628
  694   1HD   ARG  90          1HD       ARG  90  -8.811 -10.509  -5.506
  695   2HD   ARG  90          2HD       ARG  90  -8.279  -9.951  -7.089
  696    HE   ARG  90           HE       ARG  90  -7.838 -12.439  -7.505
  697   1HH1  ARG  90          1HH1      ARG  90 -10.405 -11.168  -5.490
  698   2HH1  ARG  90          2HH1      ARG  90 -11.466 -12.519  -5.749
  699   1HH2  ARG  90          1HH2      ARG  90  -9.237 -14.233  -7.858
  700   2HH2  ARG  90          2HH2      ARG  90 -10.798 -14.255  -7.094
  701    H    GLY  91           H        GLY  91  -4.003 -13.874  -4.174
  702   1HA   GLY  91          1HA       GLY  91  -2.178 -14.732  -5.404
  703   2HA   GLY  91          2HA       GLY  91  -2.864 -14.038  -6.866
  704    H    ILE  92           H        ILE  92  -2.740 -12.077  -4.045
  705    HA   ILE  92           HA       ILE  92  -0.559 -10.513  -5.269
  706    HB   ILE  92           HB       ILE  92  -2.763  -9.454  -3.492
  707   1HG1  ILE  92          1HG1      ILE  92  -2.523  -9.238  -6.501
  708   2HG1  ILE  92          2HG1      ILE  92  -3.633 -10.317  -5.663
  709   1HG2  ILE  92          1HG2      ILE  92  -2.009  -7.269  -4.308
  710   2HG2  ILE  92          2HG2      ILE  92  -0.722  -8.132  -3.468
  711   3HG2  ILE  92          3HG2      ILE  92  -0.731  -8.060  -5.229
  712   1HD1  ILE  92          1HD1      ILE  92  -3.641  -7.313  -5.501
  713   2HD1  ILE  92          2HD1      ILE  92  -4.758  -8.310  -6.433
  714   3HD1  ILE  92          3HD1      ILE  92  -4.759  -8.397  -4.673
  715    H    GLY  93           H        GLY  93   1.155  -9.942  -4.008
  716   1HA   GLY  93          1HA       GLY  93   1.270 -11.039  -1.314
  717   2HA   GLY  93          2HA       GLY  93   2.606 -10.331  -2.213
  718    H    LEU  94           H        LEU  94   1.373  -9.877   0.534
  719    HA   LEU  94           HA       LEU  94   1.034  -6.964   0.285
  720   1HB   LEU  94          1HB       LEU  94  -1.032  -8.028   1.024
  721   2HB   LEU  94          2HB       LEU  94  -0.175  -8.841   2.319
  722    HG   LEU  94           HG       LEU  94   0.297  -6.655   3.365
  723   1HD1  LEU  94          1HD1      LEU  94   0.283  -5.267   1.367
  724   2HD1  LEU  94          2HD1      LEU  94  -1.446  -5.556   1.166
  725   3HD1  LEU  94          3HD1      LEU  94  -0.859  -4.657   2.565
  726   1HD2  LEU  94          1HD2      LEU  94  -1.665  -7.933   4.045
  727   2HD2  LEU  94          2HD2      LEU  94  -1.983  -6.199   4.118
  728   3HD2  LEU  94          3HD2      LEU  94  -2.619  -7.157   2.781
  729    H    GLU  95           H        GLU  95   2.938  -6.107   0.798
  730    HA   GLU  95           HA       GLU  95   4.497  -7.297   2.972
  731   1HB   GLU  95          1HB       GLU  95   5.252  -5.167   0.963
  732   2HB   GLU  95          2HB       GLU  95   6.327  -5.842   2.180
  733   1HG   GLU  95          1HG       GLU  95   5.069  -7.325  -0.116
  734   2HG   GLU  95          2HG       GLU  95   6.758  -6.843   0.027
  735    H    ALA  96           H        ALA  96   3.930  -6.563   4.904
  736    HA   ALA  96           HA       ALA  96   3.037  -3.814   5.248
  737   1HB   ALA  96          1HB       ALA  96   2.492  -4.482   7.530
  738   2HB   ALA  96          2HB       ALA  96   1.791  -5.601   6.362
  739   3HB   ALA  96          3HB       ALA  96   3.239  -6.056   7.258
  740    H    MET  97           H        MET  97   4.481  -2.282   5.579
  741    HA   MET  97           HA       MET  97   6.777  -2.798   7.329
  742   1HB   MET  97          1HB       MET  97   6.987  -1.486   4.605
  743   2HB   MET  97          2HB       MET  97   8.290  -1.629   5.771
  744   1HG   MET  97          1HG       MET  97   8.230  -4.057   5.553
  745   2HG   MET  97          2HG       MET  97   6.909  -3.921   4.392
  746   1HE   MET  97          1HE       MET  97   8.187  -5.332   2.583
  747   2HE   MET  97          2HE       MET  97   9.505  -5.568   3.732
  748   3HE   MET  97          3HE       MET  97   9.852  -5.024   2.091
  749    H    THR  98           H        THR  98   7.983  -0.492   7.505
  750    HA   THR  98           HA       THR  98   5.946   1.438   8.243
  751    HB   THR  98           HB       THR  98   8.039   2.790   8.918
  752    HG1  THR  98           HG1      THR  98   9.868   1.328   9.294
  753   1HG2  THR  98          1HG2      THR  98   7.451   0.149  10.260
  754   2HG2  THR  98          2HG2      THR  98   8.286   1.514  11.001
  755   3HG2  THR  98          3HG2      THR  98   6.593   1.665  10.532
  756    H    ASN  99           H        ASN  99   6.418   3.788   7.590
  757    HA   ASN  99           HA       ASN  99   6.033   4.096   4.881
  758   1HB   ASN  99          1HB       ASN  99   6.923   5.968   7.032
  759   2HB   ASN  99          2HB       ASN  99   6.921   6.516   5.360
  760   1HD2  ASN  99          2HD2      ASN  99   5.337   8.028   5.842
  761   2HD2  ASN  99          1HD2      ASN  99   3.681   7.566   6.059
  762    H    ALA 100           H        ALA 100   9.083   4.611   6.644
  763    HA   ALA 100           HA       ALA 100  10.595   5.350   4.390
  764   1HB   ALA 100          1HB       ALA 100  11.315   5.781   6.693
  765   2HB   ALA 100          2HB       ALA 100  11.548   4.051   6.943
  766   3HB   ALA 100          3HB       ALA 100  12.554   4.917   5.782
  767    H    ALA 101           H        ALA 101  10.042   2.201   5.919
  768    HA   ALA 101           HA       ALA 101  11.892   0.756   4.322
  769   1HB   ALA 101          1HB       ALA 101  11.158  -0.049   6.499
  770   2HB   ALA 101          2HB       ALA 101   9.515  -0.235   5.886
  771   3HB   ALA 101          3HB       ALA 101  10.816  -1.236   5.241
  772    H    ALA 102           H        ALA 102   8.440   1.425   4.048
  773    HA   ALA 102           HA       ALA 102   7.906  -0.305   1.881
  774   1HB   ALA 102          1HB       ALA 102   6.516   2.266   2.633
  775   2HB   ALA 102          2HB       ALA 102   5.881   1.020   1.559
  776   3HB   ALA 102          3HB       ALA 102   6.138   0.665   3.268
  777    H    ALA 103           H        ALA 103   8.728   3.155   1.998
  778    HA   ALA 103           HA       ALA 103   8.693   3.587  -0.787
  779   1HB   ALA 103          1HB       ALA 103   9.925   5.635  -0.307
  780   2HB   ALA 103          2HB       ALA 103   8.611   5.407   0.847
  781   3HB   ALA 103          3HB       ALA 103  10.272   5.056   1.323
  782    H    ARG 104           H        ARG 104  11.190   2.488   1.412
  783    HA   ARG 104           HA       ARG 104  13.455   2.612  -0.186
  784   1HB   ARG 104          1HB       ARG 104  13.137   1.887   2.283
  785   2HB   ARG 104          2HB       ARG 104  12.843   0.286   1.634
  786   1HG   ARG 104          1HG       ARG 104  15.369   1.842   1.137
  787   2HG   ARG 104          2HG       ARG 104  15.162   0.710   2.470
  788   1HD   ARG 104          1HD       ARG 104  14.477  -0.949   0.575
  789   2HD   ARG 104          2HD       ARG 104  15.341   0.182  -0.465
  790    HE   ARG 104           HE       ARG 104  16.496  -1.447   1.693
  791   1HH1  ARG 104          1HH1      ARG 104  16.954   0.792  -0.967
  792   2HH1  ARG 104          2HH1      ARG 104  18.661   0.475  -1.103
  793   1HH2  ARG 104          1HH2      ARG 104  18.722  -1.872   1.506
  794   2HH2  ARG 104          2HH2      ARG 104  19.663  -1.049   0.297
  795    H    THR 105           H        THR 105  11.077  -0.013   0.102
  796    HA   THR 105           HA       THR 105  12.348  -1.581  -1.958
  797    HB   THR 105           HB       THR 105   9.640  -2.060  -0.708
  798    HG1  THR 105           HG1      THR 105  10.854  -2.103   1.072
  799   1HG2  THR 105          1HG2      THR 105  10.164  -4.417  -1.172
  800   2HG2  THR 105          2HG2      THR 105  10.166  -3.454  -2.649
  801   3HG2  THR 105          3HG2      THR 105  11.693  -3.930  -1.905
  802    H    TYR 106           H        TYR 106   9.707   0.677  -1.724
  803    HA   TYR 106           HA       TYR 106   8.177  -0.012  -3.940
  804   1HB   TYR 106          1HB       TYR 106   7.507   1.654  -2.243
  805   2HB   TYR 106          2HB       TYR 106   8.718   2.766  -2.869
  806    HD1  TYR 106           HD1      TYR 106   5.587   0.984  -3.734
  807    HD2  TYR 106           HD2      TYR 106   8.237   4.164  -4.711
  808    HE1  TYR 106           HE1      TYR 106   3.930   1.871  -5.318
  809    HE2  TYR 106           HE2      TYR 106   6.589   5.058  -6.301
  810    HH   TYR 106           HH       TYR 106   4.678   4.256  -7.614
  811    H    ASN 107           H        ASN 107  11.114   1.922  -3.732
  812    HA   ASN 107           HA       ASN 107  11.167   3.021  -6.283
  813   1HB   ASN 107          1HB       ASN 107  12.767   3.631  -4.523
  814   2HB   ASN 107          2HB       ASN 107  13.512   2.040  -4.636
  815   1HD2  ASN 107          2HD2      ASN 107  14.850   1.569  -6.372
  816   2HD2  ASN 107          1HD2      ASN 107  15.423   2.779  -7.464
  817    H    VAL 108           H        VAL 108  12.343  -0.141  -5.188
  818    HA   VAL 108           HA       VAL 108  13.474  -0.912  -7.667
  819    HB   VAL 108           HB       VAL 108  12.449  -2.702  -5.453
  820   1HG1  VAL 108          1HG1      VAL 108  12.828  -3.900  -7.544
  821   2HG1  VAL 108          2HG1      VAL 108  14.457  -3.232  -7.643
  822   3HG1  VAL 108          3HG1      VAL 108  14.036  -4.341  -6.339
  823   1HG2  VAL 108          1HG2      VAL 108  14.747  -2.697  -4.628
  824   2HG2  VAL 108          2HG2      VAL 108  15.200  -1.547  -5.885
  825   3HG2  VAL 108          3HG2      VAL 108  14.065  -1.070  -4.623
  826    H    LEU 109           H        LEU 109  10.308  -1.469  -6.185
  827    HA   LEU 109           HA       LEU 109   9.335  -3.221  -8.171
  828   1HB   LEU 109          1HB       LEU 109   7.744  -1.368  -6.397
  829   2HB   LEU 109          2HB       LEU 109   7.129  -2.777  -7.241
  830    HG   LEU 109           HG       LEU 109   9.066  -2.744  -4.927
  831   1HD1  LEU 109          1HD1      LEU 109   7.313  -4.000  -3.793
  832   2HD1  LEU 109          2HD1      LEU 109   6.729  -2.424  -4.327
  833   3HD1  LEU 109          3HD1      LEU 109   6.290  -3.877  -5.226
  834   1HD2  LEU 109          1HD2      LEU 109   8.103  -5.091  -6.557
  835   2HD2  LEU 109          2HD2      LEU 109   9.748  -4.460  -6.509
  836   3HD2  LEU 109          3HD2      LEU 109   9.040  -5.186  -5.067
  837    H    ALA 110           H        ALA 110   9.238   0.284  -7.841
  838    HA   ALA 110           HA       ALA 110   7.591   0.787 -10.091
  839   1HB   ALA 110          1HB       ALA 110   9.667   2.568  -8.820
  840   2HB   ALA 110          2HB       ALA 110   8.400   3.084  -9.934
  841   3HB   ALA 110          3HB       ALA 110   7.973   2.454  -8.343
  842    H    SER 111           H        SER 111  11.095   0.554  -9.659
  843    HA   SER 111           HA       SER 111  11.782   1.218 -12.318
  844   1HB   SER 111          1HB       SER 111  13.265  -0.309 -10.176
  845   2HB   SER 111          2HB       SER 111  13.976   0.124 -11.730
  846    HG   SER 111           HG       SER 111  13.667   2.297 -11.229
  847    H    GLU 112           H        GLU 112  10.809  -1.789 -10.795
  848    HA   GLU 112           HA       GLU 112  11.611  -3.489 -12.930
  849   1HB   GLU 112          1HB       GLU 112  11.077  -4.283 -10.616
  850   2HB   GLU 112          2HB       GLU 112   9.379  -3.953 -10.941
  851   1HG   GLU 112          1HG       GLU 112   9.446  -5.559 -12.800
  852   2HG   GLU 112          2HG       GLU 112  11.123  -5.921 -12.405
  853    H    GLY 113           H        GLY 113   8.680  -1.684 -12.199
  854   1HA   GLY 113          1HA       GLY 113   7.166  -0.877 -13.811
  855   2HA   GLY 113          2HA       GLY 113   7.832  -2.016 -14.973
  856    H    ARG 114           H        ARG 114   6.642  -2.635 -11.720
  857    HA   ARG 114           HA       ARG 114   4.647  -4.464 -12.870
  858   1HB   ARG 114          1HB       ARG 114   4.716  -5.595 -10.648
  859   2HB   ARG 114          2HB       ARG 114   6.259  -5.627 -11.491
  860   1HG   ARG 114          1HG       ARG 114   6.798  -3.520 -10.097
  861   2HG   ARG 114          2HG       ARG 114   5.457  -4.052  -9.082
  862   1HD   ARG 114          1HD       ARG 114   7.804  -5.789  -9.814
  863   2HD   ARG 114          2HD       ARG 114   7.726  -4.819  -8.347
  864    HE   ARG 114           HE       ARG 114   5.442  -6.419  -8.436
  865   1HH1  ARG 114          1HH1      ARG 114   8.905  -6.868  -8.291
  866   2HH1  ARG 114          2HH1      ARG 114   8.815  -8.249  -7.228
  867   1HH2  ARG 114          1HH2      ARG 114   5.304  -8.257  -7.083
  868   2HH2  ARG 114          2HH2      ARG 114   6.760  -9.046  -6.544
  869    H    ARG 115           H        ARG 115   2.536  -4.499 -11.926
  870    HA   ARG 115           HA       ARG 115   1.599  -1.894 -11.239
  871   1HB   ARG 115          1HB       ARG 115   0.208  -4.571 -11.378
  872   2HB   ARG 115          2HB       ARG 115  -0.624  -3.073 -10.983
  873   1HG   ARG 115          1HG       ARG 115  -0.091  -2.144 -13.133
  874   2HG   ARG 115          2HG       ARG 115   0.918  -3.535 -13.528
  875   1HD   ARG 115          1HD       ARG 115  -1.255  -3.667 -14.631
  876   2HD   ARG 115          2HD       ARG 115  -1.037  -4.984 -13.483
  877    HE   ARG 115           HE       ARG 115  -2.468  -3.652 -11.943
  878   1HH1  ARG 115          1HH1      ARG 115  -2.660  -3.142 -15.406
  879   2HH1  ARG 115          2HH1      ARG 115  -4.316  -2.604 -15.355
  880   1HH2  ARG 115          1HH2      ARG 115  -4.637  -2.941 -11.882
  881   2HH2  ARG 115          2HH2      ARG 115  -5.436  -2.485 -13.361
  882    H    VAL 116           H        VAL 116   2.654  -1.367  -9.352
  883    HA   VAL 116           HA       VAL 116   2.105  -2.975  -6.979
  884    HB   VAL 116           HB       VAL 116   4.423  -2.346  -7.262
  885   1HG1  VAL 116          1HG1      VAL 116   4.146  -0.369  -8.643
  886   2HG1  VAL 116          2HG1      VAL 116   3.471   0.514  -7.273
  887   3HG1  VAL 116          3HG1      VAL 116   5.156  -0.007  -7.242
  888   1HG2  VAL 116          1HG2      VAL 116   3.139  -0.759  -5.042
  889   2HG2  VAL 116          2HG2      VAL 116   3.611  -2.456  -4.976
  890   3HG2  VAL 116          3HG2      VAL 116   4.843  -1.203  -5.130
  891    H    ALA 117           H        ALA 117   0.774  -2.358  -5.405
  892    HA   ALA 117           HA       ALA 117  -0.506   0.281  -5.632
  893   1HB   ALA 117          1HB       ALA 117  -1.475  -2.197  -4.204
  894   2HB   ALA 117          2HB       ALA 117  -2.334  -0.660  -4.310
  895   3HB   ALA 117          3HB       ALA 117  -2.051  -1.613  -5.767
  896    H    LEU 118           H        LEU 118   0.479   1.709  -4.362
  897    HA   LEU 118           HA       LEU 118   1.732   0.833  -1.891
  898   1HB   LEU 118          1HB       LEU 118   2.898   2.410  -3.396
  899   2HB   LEU 118          2HB       LEU 118   1.610   3.574  -3.154
  900    HG   LEU 118           HG       LEU 118   2.189   3.674  -0.744
  901   1HD1  LEU 118          1HD1      LEU 118   3.184   1.461  -0.516
  902   2HD1  LEU 118          2HD1      LEU 118   4.523   1.947  -1.557
  903   3HD1  LEU 118          3HD1      LEU 118   4.303   2.717   0.014
  904   1HD2  LEU 118          1HD2      LEU 118   3.088   5.317  -2.304
  905   2HD2  LEU 118          2HD2      LEU 118   4.251   4.955  -1.030
  906   3HD2  LEU 118          3HD2      LEU 118   4.461   4.262  -2.639
  907    H    ALA 119           H        ALA 119   0.170   0.400  -0.426
  908    HA   ALA 119           HA       ALA 119  -1.923   2.354   0.104
  909   1HB   ALA 119          1HB       ALA 119  -2.732   0.741   1.754
  910   2HB   ALA 119          2HB       ALA 119  -2.478  -0.042   0.193
  911   3HB   ALA 119          3HB       ALA 119  -1.304  -0.260   1.491
  912    H    MET 120           H        MET 120  -0.903   4.125   0.908
  913    HA   MET 120           HA       MET 120   1.147   3.740   2.962
  914   1HB   MET 120          1HB       MET 120   1.246   5.254   0.770
  915   2HB   MET 120          2HB       MET 120   0.504   6.424   1.851
  916   1HG   MET 120          1HG       MET 120   2.855   6.771   1.877
  917   2HG   MET 120          2HG       MET 120   2.391   6.070   3.428
  918   1HE   MET 120          1HE       MET 120   5.360   6.228   1.940
  919   2HE   MET 120          2HE       MET 120   6.029   4.690   2.486
  920   3HE   MET 120          3HE       MET 120   5.133   5.712   3.609
  921    H    ILE 121           H        ILE 121   0.301   3.625   4.933
  922    HA   ILE 121           HA       ILE 121  -1.910   5.397   5.664
  923    HB   ILE 121           HB       ILE 121  -0.696   3.082   7.189
  924   1HG1  ILE 121          1HG1      ILE 121  -3.308   3.270   5.665
  925   2HG1  ILE 121          2HG1      ILE 121  -1.882   2.379   5.144
  926   1HG2  ILE 121          1HG2      ILE 121  -2.678   3.284   8.632
  927   2HG2  ILE 121          2HG2      ILE 121  -1.647   4.713   8.696
  928   3HG2  ILE 121          3HG2      ILE 121  -3.143   4.746   7.761
  929   1HD1  ILE 121          1HD1      ILE 121  -3.522   1.806   7.600
  930   2HD1  ILE 121          2HD1      ILE 121  -3.544   0.894   6.091
  931   3HD1  ILE 121          3HD1      ILE 121  -2.088   0.916   7.085
  932    H    VAL 122           H        VAL 122  -1.616   7.106   6.924
  933    HA   VAL 122           HA       VAL 122   0.899   7.374   8.417
  934    HB   VAL 122           HB       VAL 122   0.600   9.929   7.794
  935   1HG1  VAL 122          1HG1      VAL 122   2.585   8.608   7.317
  936   2HG1  VAL 122          2HG1      VAL 122   1.791   7.893   5.913
  937   3HG1  VAL 122          3HG1      VAL 122   2.167   9.616   5.930
  938   1HG2  VAL 122          1HG2      VAL 122  -0.630   8.525   5.420
  939   2HG2  VAL 122          2HG2      VAL 122  -1.451   9.642   6.509
  940   3HG2  VAL 122          3HG2      VAL 122  -0.147  10.221   5.474
  941    H    GLY 123           H        GLY 123   0.479   7.679  10.486
  942   1HA   GLY 123          1HA       GLY 123  -2.194   8.147  11.391
  943   2HA   GLY 123          2HA       GLY 123  -0.774   7.948  12.404
  944    H    GLY 124           H        GLY 124   0.507  10.210  10.789
  945   1HA   GLY 124          1HA       GLY 124   0.682  12.506  10.938
  946   2HA   GLY 124          2HA       GLY 124  -0.991  12.548  11.481
  947    H    LEU 125           H        LEU 125  -1.452  12.298  13.690
  948    HA   LEU 125           HA       LEU 125   0.707  12.079  15.587
  949   1HB   LEU 125          1HB       LEU 125   0.163  14.196  16.742
  950   2HB   LEU 125          2HB       LEU 125   0.845  14.441  15.150
  951    HG   LEU 125           HG       LEU 125  -1.694  14.637  14.445
  952   1HD1  LEU 125          1HD1      LEU 125  -2.603  14.080  16.639
  953   2HD1  LEU 125          2HD1      LEU 125  -1.754  15.454  17.347
  954   3HD1  LEU 125          3HD1      LEU 125  -3.038  15.723  16.168
  955   1HD2  LEU 125          1HD2      LEU 125  -0.024  16.372  14.156
  956   2HD2  LEU 125          2HD2      LEU 125  -1.525  17.062  14.773
  957   3HD2  LEU 125          3HD2      LEU 125  -0.158  16.812  15.858
  958    H    GLU 126           H        GLU 126  -0.055  11.741  17.755
  959    HA   GLU 126           HA       GLU 126  -2.826  10.764  17.767
  960   1HB   GLU 126          1HB       GLU 126  -1.864   9.349  19.758
  961   2HB   GLU 126          2HB       GLU 126  -1.608   8.848  18.094
  962   1HG   GLU 126          1HG       GLU 126   0.414   8.609  19.431
  963   2HG   GLU 126          2HG       GLU 126   0.635   9.774  18.128
  964    H    HIS 127           H        HIS 127  -0.875  13.161  19.034
  965    HA   HIS 127           HA       HIS 127  -2.057  13.287  21.648
  966   1HB   HIS 127          1HB       HIS 127  -0.065  14.880  20.145
  967   2HB   HIS 127          2HB       HIS 127  -0.982  15.742  21.374
  968    HD1  HIS 127           HD1      HIS 127   1.183  12.622  21.079
  969    HD2  HIS 127           HD2      HIS 127  -0.029  15.440  23.893
  970    HE1  HIS 127           HE1      HIS 127   2.510  12.127  23.160
  971    HE2  HIS 127           HE2      HIS 127   1.602  13.703  24.904
  972    H    HIS 128           H        HIS 128  -4.276  13.268  21.096
  973    HA   HIS 128           HA       HIS 128  -5.299  15.741  19.905
  974   1HB   HIS 128          1HB       HIS 128  -6.761  13.206  20.686
  975   2HB   HIS 128          2HB       HIS 128  -7.495  14.602  19.907
  976    HD1  HIS 128           HD1      HIS 128  -6.720  11.416  18.976
  977    HD2  HIS 128           HD2      HIS 128  -5.552  15.098  17.418
  978    HE1  HIS 128           HE1      HIS 128  -6.002  10.960  16.605
  979    HE2  HIS 128           HE2      HIS 128  -5.339  13.207  15.662
  980    H    HIS 129           H        HIS 129  -4.333  14.735  22.819
  981    HA   HIS 129           HA       HIS 129  -5.742  16.844  24.161
  982   1HB   HIS 129          1HB       HIS 129  -6.775  15.554  25.897
  983   2HB   HIS 129          2HB       HIS 129  -7.302  14.864  24.369
  984    HD1  HIS 129           HD1      HIS 129  -6.458  12.455  23.799
  985    HD2  HIS 129           HD2      HIS 129  -5.246  13.877  27.518
  986    HE1  HIS 129           HE1      HIS 129  -5.577  10.455  25.039
  987    HE2  HIS 129           HE2      HIS 129  -5.025  11.302  27.346
  988    H    HIS 130           H        HIS 130  -4.725  17.405  26.182
  989    HA   HIS 130           HA       HIS 130  -1.936  16.692  26.289
  990   1HB   HIS 130          1HB       HIS 130  -3.653  18.412  28.083
  991   2HB   HIS 130          2HB       HIS 130  -1.935  18.149  28.353
  992    HD1  HIS 130           HD1      HIS 130  -4.044  20.591  27.033
  993    HD2  HIS 130           HD2      HIS 130  -0.515  18.851  25.698
  994    HE1  HIS 130           HE1      HIS 130  -3.076  22.215  25.371
  995    HE2  HIS 130           HE2      HIS 130  -0.833  21.238  24.754
  996    H    HIS 131           H        HIS 131  -0.861  15.672  28.053
  997    HA   HIS 131           HA       HIS 131  -2.483  13.523  29.144
  998   1HB   HIS 131          1HB       HIS 131  -0.316  12.974  28.129
  999   2HB   HIS 131          2HB       HIS 131   0.502  13.991  29.310
 1000    HD1  HIS 131           HD1      HIS 131   1.300  12.836  31.357
 1001    HD2  HIS 131           HD2      HIS 131  -1.716  10.709  29.434
 1002    HE1  HIS 131           HE1      HIS 131   1.072  10.677  32.627
 1003    HE2  HIS 131           HE2      HIS 131  -0.869   9.480  31.552
 1004    H    HIS 132           H        HIS 132  -3.250  13.462  31.109
 1005    HA   HIS 132           HA       HIS 132  -1.856  14.466  33.379
 1006   1HB   HIS 132          1HB       HIS 132  -2.750  16.604  32.658
 1007   2HB   HIS 132          2HB       HIS 132  -4.358  15.913  32.474
 1008    HD1  HIS 132           HD1      HIS 132  -5.868  16.343  34.356
 1009    HD2  HIS 132           HD2      HIS 132  -1.883  16.431  35.541
 1010    HE1  HIS 132           HE1      HIS 132  -5.902  16.947  36.799
 1011    HE2  HIS 132           HE2      HIS 132  -3.478  17.055  37.489