*HEADER    UNKNOWN FUNCTION                        29-MAY-13   2M8W              
*TITLE     RESTRAINED CS-ROSETTA SOLUTION NMR STRUCTURE OF STAPHYLOCOCCUS AUREUS 
*TITLE    2 PROTEIN SAV1430. NORTHEAST STRUCTURAL GENOMICS TARGET ZR18. STRUCTURE
*TITLE    3 DETERMINATION                                                        
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: UNCHARACTERIZED PROTEIN;                                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: SAV1430;                                                    
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS AUREUS SUBSP. AUREUS;            
*SOURCE   3 ORGANISM_TAXID: 158878;                                              
*SOURCE   4 STRAIN: MU50;                                                        
*SOURCE   5 GENE: SAV1430;                                                       
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 511693;                                     
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21MGK;                                   
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: PET21;                                
*SOURCE  10 EXPRESSION_SYSTEM_PLASMID: ZR18-21                                   
*KEYWDS    STRUCTURAL GENOMICS, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM, NESG,  
*KEYWDS   2 PSI-BIOLOGY, PROTEIN STRUCTURE INITIATIVE, UNKNOWN FUNCTION          
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    B.MAO, R.T.TEJERO, J.M.ARAMINI, D.A.SNYDER, G.T.MONTELIONE, NORTHEAST 
*AUTHOR   2 STRUCTURAL GENOMICS CONSORTIUM (NESG)                                
*REVDAT   1   21-AUG-13 2M8W    0                                                


## Rosetta constraints (v3.x) written by PdbStat 
## PdbStat v 5.7-exp mié feb 27 23:01:38 UTC 2013  
## Note: ambiguous constraints have been avoided 
AmbiguousNMRDistance    O       5  N      18   BOUNDED   2.40   3.30    0.3  NOE 
AmbiguousNMRDistance    O       5  H      18   BOUNDED   1.50   2.30    0.3  NOE 
AmbiguousNMRDistance    O      13  N      65   BOUNDED   2.40   3.30    0.3  NOE 
AmbiguousNMRDistance    O      13  H      65   BOUNDED   1.50   2.30    0.3  NOE 
AmbiguousNMRDistance    O      15  N      63   BOUNDED   2.40   3.30    0.3  NOE 
AmbiguousNMRDistance    O      15  H      63   BOUNDED   1.50   2.30    0.3  NOE 
AmbiguousNMRDistance    O      17  N      61   BOUNDED   2.40   3.30    0.3  NOE 
AmbiguousNMRDistance    O      17  H      61   BOUNDED   1.50   2.30    0.3  NOE 
AmbiguousNMRDistance    O      18  N       4   BOUNDED   2.40   3.30    0.3  NOE 
AmbiguousNMRDistance    O      18  H       4   BOUNDED   1.50   2.30    0.3  NOE 
AmbiguousNMRDistance    O      29  N      56   BOUNDED   2.40   3.30    0.3  NOE 
AmbiguousNMRDistance    O      29  H      56   BOUNDED   1.50   2.30    0.3  NOE 
AmbiguousNMRDistance    O      31  N      54   BOUNDED   2.40   3.30    0.3  NOE 
AmbiguousNMRDistance    O      31  H      54   BOUNDED   1.50   2.30    0.3  NOE 
AmbiguousNMRDistance    O      39  N      42   BOUNDED   2.40   3.30    0.3  NOE 
AmbiguousNMRDistance    O      39  H      42   BOUNDED   1.50   2.30    0.3  NOE 
AmbiguousNMRDistance    O      40  N      43   BOUNDED   2.40   3.30    0.3  NOE 
AmbiguousNMRDistance    O      40  H      43   BOUNDED   1.50   2.30    0.3  NOE 
AmbiguousNMRDistance    O      42  N      46   BOUNDED   2.40   3.30    0.3  NOE 
AmbiguousNMRDistance    O      42  H      46   BOUNDED   1.50   2.30    0.3  NOE 
AmbiguousNMRDistance    O      43  N      47   BOUNDED   2.40   3.30    0.3  NOE 
AmbiguousNMRDistance    O      43  H      47   BOUNDED   1.50   2.30    0.3  NOE 
AmbiguousNMRDistance    O      45  N      48   BOUNDED   2.40   3.30    0.3  NOE 
AmbiguousNMRDistance    O      45  H      48   BOUNDED   1.50   2.30    0.3  NOE 
AmbiguousNMRDistance    O      48  N      51   BOUNDED   2.40   3.30    0.3  NOE 
AmbiguousNMRDistance    O      48  H      51   BOUNDED   1.50   2.30    0.3  NOE 
AmbiguousNMRDistance    O      50  N      66   BOUNDED   2.40   3.30    0.3  NOE 
AmbiguousNMRDistance    O      50  H      66   BOUNDED   1.50   2.30    0.3  NOE 
AmbiguousNMRDistance    O      53  N      64   BOUNDED   2.40   3.30    0.3  NOE 
AmbiguousNMRDistance    O      53  H      64   BOUNDED   1.50   2.30    0.3  NOE 
AmbiguousNMRDistance    O      54  N      31   BOUNDED   2.40   3.30    0.3  NOE 
AmbiguousNMRDistance    O      54  H      31   BOUNDED   1.50   2.30    0.3  NOE 
AmbiguousNMRDistance    O      55  N      62   BOUNDED   2.40   3.30    0.3  NOE 
AmbiguousNMRDistance    O      55  H      62   BOUNDED   1.50   2.30    0.3  NOE 
AmbiguousNMRDistance    O      56  N      29   BOUNDED   2.40   3.30    0.3  NOE 
AmbiguousNMRDistance    O      56  H      29   BOUNDED   1.50   2.30    0.3  NOE 
AmbiguousNMRDistance    O      57  N      60   BOUNDED   2.40   3.30    0.3  NOE 
AmbiguousNMRDistance    O      57  H      60   BOUNDED   1.50   2.30    0.3  NOE 
AmbiguousNMRDistance    O      60  N      57   BOUNDED   2.40   3.30    0.3  NOE 
AmbiguousNMRDistance    O      60  H      57   BOUNDED   1.50   2.30    0.3  NOE 
AmbiguousNMRDistance    O      61  N      17   BOUNDED   2.40   3.30    0.3  NOE 
AmbiguousNMRDistance    O      61  H      17   BOUNDED   1.50   2.30    0.3  NOE 
AmbiguousNMRDistance    O      62  N      55   BOUNDED   2.40   3.30    0.3  NOE 
AmbiguousNMRDistance    O      62  H      55   BOUNDED   1.50   2.30    0.3  NOE 
AmbiguousNMRDistance    O      63  N      15   BOUNDED   2.40   3.30    0.3  NOE 
AmbiguousNMRDistance    O      63  H      15   BOUNDED   1.50   2.30    0.3  NOE 
AmbiguousNMRDistance    O      64  N      53   BOUNDED   2.40   3.30    0.3  NOE 
AmbiguousNMRDistance    O      64  H      53   BOUNDED   1.50   2.30    0.3  NOE 
AmbiguousNMRDistance    O      71  N      75   BOUNDED   2.40   3.30    0.3  NOE 
AmbiguousNMRDistance    O      71  H      75   BOUNDED   1.50   2.30    0.3  NOE 
AmbiguousNMRDistance    O      75  N      79   BOUNDED   2.40   3.30    0.3  NOE 
AmbiguousNMRDistance    O      75  H      79   BOUNDED   1.50   2.30    0.3  NOE 
AmbiguousNMRDistance    O      78  N      81   BOUNDED   2.40   3.30    0.3  NOE 
AmbiguousNMRDistance    O      78  H      81   BOUNDED   1.50   2.30    0.3  NOE 
AmbiguousNMRDistance    HA      1  1HG     1   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA      1  2HG     1   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA      1  H       2   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    HA      1  HB     20   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA      1  HE     26   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB      1  HD     82   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HG      1  H       2   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG      1  HD2    19   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG      1  H      20   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HG     1  HE     26   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HG     1  HE     26   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H       2  HA      2   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H       2  H      20   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA      2  H       3   BOUNDED   1.80   2.90    0.3  NOE 
AmbiguousNMRDistance    HB      2  HD      2   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HB      2  HE      2   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HB      2  H       3   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB      2  HG     83   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    1HG     2  HE      2   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HG     2  HE      2   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG      2  HB     82   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD      2  HB     83   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HE      2  HD1     4   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    H       3  HA      3   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H       3  HB      3   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H       3  1HG1    3   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H       3  2HG1    3   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H       3  HG2     3   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H       3  HD1     3   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H       3  HD2    19   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H       3  1HB    82   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H       3  2HB    82   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA      3  1HG1    3   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA      3  2HG1    3   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA      3  HG2     3   BOUNDED   1.80   5.60    0.3  NOE 
AmbiguousNMRDistance    HA      3  HD1     3   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA      3  H       4   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    HA      3  HB      4   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA      3  H       5   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA      3  HG2    17   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA      3  HD2    19   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB      3  HD1     3   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1     3  HG2     3   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG1     3  H       4   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1     3  HD1     4   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG1     3  HG1    17   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG1     3  HG2    17   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG1     3  HD2    19   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG1     3  H      82   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1     3  1HB    82   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1     3  2HB    82   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1     3  HD     82   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HG2     3  HD1     3   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG2     3  H       4   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2     3  HA      4   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2     3  HG1     4   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG2     3  H       5   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2     3  H       6   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2     3  HG1     6   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG2     3  H      18   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD1     3  HA     79   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD1     3  1HG    79   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD1     3  2HG    79   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD1     3  H      82   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD1     3  1HB    82   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD1     3  2HB    82   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD1     3  HD     82   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HD1     3  HE     82   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HD1     3  HZ     82   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H       4  HA      4   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H       4  HB      4   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H       4  1HG1    4   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H       4  2HG1    4   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H       4  HG2     4   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H       4  HD1     4   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H       4  H       5   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H       4  HB     18   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H       4  HA     19   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H       4  HD2    19   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA      4  1HG1    4   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA      4  2HG1    4   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA      4  HG2     4   BOUNDED   1.80   5.60    0.3  NOE 
AmbiguousNMRDistance    HA      4  HD1     4   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA      4  H       5   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB      4  HD1     4   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB      4  H       5   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB      4  HB      5   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB      4  HB     18   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB      4  HG2    18   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1     4  HG2     4   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    1HG1    4  H       5   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HG1    4  H       5   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HG1    4  HG2    18   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HG1    4  HG2    18   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HG1    4  H      20   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HG1    4  H      20   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HG1    4  HA     20   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HG1    4  HA     20   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HG2     4  H       5   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2     4  HB      5   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG2     4  HB     18   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2     4  HG2    18   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD1     4  HG2    18   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD1     4  H      20   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD1     4  HA     20   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD1     4  HB     20   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    H       5  HA      5   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H       5  HB      5   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H       5  HA     17   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H       5  H      18   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H       5  HA     18   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H       5  HB     18   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H       5  HG2    18   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA      5  H       6   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB      5  H       6   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB      5  HG2    18   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    H       6  HA      6   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H       6  HB      6   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H       6  HG1     6   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H       6  HG2     6   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H       6  HD1     6   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA      6  H       7   BOUNDED   1.80   2.90    0.3  NOE 
AmbiguousNMRDistance    HB      6  HD1     6   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB      6  H       7   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HG1    6  HG2     6   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HG1    6  HG2     6   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1     6  HB     15   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG1     6  HG1    17   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG2     6  H       7   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2     6  HB      7   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG2     6  H       8   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2     6  HB     15   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG2     6  1HG    15   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2     6  2HG    15   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2     6  HE     15   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG2     6  H      16   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD1     6  H       7   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H       7  HA      7   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H       7  1HB     7   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H       7  2HB     7   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H       7  HB     15   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H       7  H      16   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA      7  H       8   BOUNDED   1.80   2.90    0.3  NOE 
AmbiguousNMRDistance    1HB     7  H       8   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB     7  H       8   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB     7  HB     16   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HB     7  HB     16   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB      7  HD     16   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    H       8  HA      8   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H       8  1HB     8   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H       8  2HB     8   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H       8  HG      8   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H       8  HG2     9   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA      8  H       9   BOUNDED   1.80   2.90    0.3  NOE 
AmbiguousNMRDistance    1HB     8  H       9   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    2HB     8  H       9   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    HG      8  H       9   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H       9  HA      9   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H       9  HG2     9   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H       9  HA     10   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H       9  1HD    10   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H       9  2HD    10   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB      9  H      11   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HG2     9  HA     10   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2     9  HB     10   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG2     9  HD     10   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG2     9  H      11   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     10  H      11   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    10  H      11   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    10  H      11   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HG    10  H      11   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HG    10  H      11   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HD    10  H      11   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HD    10  H      11   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HD     10  HB     11   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    H      11  HA     11   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      11  1HB    11   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      11  2HB    11   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    1HB    11  2HD2   11   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    11  2HD2   11   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     12  H      14   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     12  HE1    71   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     12  HD2    12   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD2    12  HE1    71   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      13  HA     13   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      13  1HB    13   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      13  2HB    13   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      13  H      14   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    HA     13  H      14   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     13  H      65   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     13  HE1    71   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    13  2HD2   13   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    13  1HD2   13   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    13  2HD2   13   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    13  1HD2   13   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     13  H      14   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HB    13  H      65   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    13  H      65   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HD2   13  HA     67   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HD2   13  HA     67   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HD2   13  HB     67   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HD2   13  HB     67   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      14  HA     14   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      14  HB     14   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      14  HZ2    71   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     14  HG2    14   BOUNDED   1.80   5.60    0.3  NOE 
AmbiguousNMRDistance    HA     14  H      15   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    HA     14  HB     15   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     14  HA     64   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     14  H      65   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     14  HZ2    71   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     14  HH2    71   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     14  1HB    64   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    HB     14  2HB    64   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    HG2    14  H      15   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    14  HA     62   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    14  HB     62   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG2    14  H      63   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    14  HA     64   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    14  1HB    64   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    14  2HB    64   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      15  HA     15   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      15  1HB    15   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      15  2HB    15   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      15  H      63   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      15  HB     63   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      15  HZ2    71   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      15  HH2    71   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     15  H      16   BOUNDED   1.80   2.90    0.3  NOE 
AmbiguousNMRDistance    1HB    15  H      16   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    15  H      16   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     15  HB     63   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     15  HZ2    71   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     15  HH2    71   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HG    15  H      16   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HG    15  H      16   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HG     15  HB     63   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HG    15  HZ2    71   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HG    15  HZ2    71   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HE     15  HB     63   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HE     15  HB     71   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HE     15  HD1    71   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HE     15  HE1    71   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HE     15  HZ2    71   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HE     15  HE3    71   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HE     15  HG     75   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HE     15  HD1    75   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    H      16  HA     16   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      16  1HB    16   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      16  2HB    16   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      16  1HG    16   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      16  2HG    16   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      16  H      17   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     16  HG     16   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     16  H      17   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     16  H      61   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     16  H      62   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     16  H      63   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    16  HD     16   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HB    16  HD     16   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HG    16  1HE    16   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HG    16  2HE    16   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HG    16  1HE    16   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HG    16  2HE    16   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HG     16  H      17   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HG    16  HB     60   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HG    16  HB     60   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HG    16  HD     60   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    2HG    16  HD     60   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD     16  HD     60   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    1HE    16  HB     60   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HE    16  HB     60   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HE    16  HD     60   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    2HE    16  HD     60   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HE     16  HE     60   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    H      17  HA     17   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      17  HB     17   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      17  1HG1   17   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      17  2HG1   17   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      17  HD1    17   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      17  H      18   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      17  HB     60   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      17  H      61   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      17  HG1    61   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      17  HA     62   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     17  H      18   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    HA     17  H      61   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     17  HD1    17   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     17  HB     61   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     17  HG1    61   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     17  HG2    63   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    17  HG2    17   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    1HG1   17  H      18   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HG1   17  H      18   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HG1   17  HB     61   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HG1   17  HB     61   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HG1   17  HG2    63   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HG1   17  HG2    63   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    17  H      18   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    17  HD2    19   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD1    17  HB     61   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD1    17  HG2    61   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD1    17  HB     63   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD1    17  HG2    63   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD1    17  HE     82   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    H      18  HA     18   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      18  HB     18   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      18  HG2    18   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      18  H      19   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      18  HD2    19   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     18  H      19   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    HA     18  H      61   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     18  H      19   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HG2    18  H      19   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    18  HB     59   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG2    18  HB     60   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    H      19  HA     19   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      19  1HB    19   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      19  2HB    19   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      19  HG     19   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      19  HD1    19   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      19  HD2    19   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      19  HB     59   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      19  HA     60   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      19  HB     60   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     19  HD2    19   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     19  H      20   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    1HB    19  HD1    19   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HB    19  HD2    19   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HB    19  HD1    19   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HB    19  HD2    19   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HB    19  H      20   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    19  H      20   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    19  H      21   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    19  H      21   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HG     19  HA     60   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HD1    19  H      20   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD2    19  H      20   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD1    19  H      21   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD2    19  H      21   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD2    19  HE     26   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD1    19  HA     60   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD2    19  H      61   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD1    19  HG1    61   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD2    19  HG1    61   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD1    19  HD1    61   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD2    19  HD1    61   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD2    19  HD     82   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HD2    19  HE     82   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HD2    19  HZ     82   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      20  HA     20   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      20  1HB    20   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      20  2HB    20   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      20  H      21   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      20  HA     21   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     20  H      21   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     20  H      21   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      21  HA     21   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      21  1HB    21   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      21  2HB    21   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      21  HG     21   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      21  HE     26   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     21  H      22   BOUNDED   1.80   2.90    0.3  NOE 
AmbiguousNMRDistance    1HB    21  H      22   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    21  H      22   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     21  HB     59   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG     21  H      22   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      22  HA     22   BOUNDED   1.80   2.90    0.3  NOE 
AmbiguousNMRDistance    H      22  HB     22   BOUNDED   1.80   4.50    0.3  NOE 
AmbiguousNMRDistance    HA     22  H      23   BOUNDED   1.80   2.90    0.3  NOE 
AmbiguousNMRDistance    HB     22  H      23   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     22  1HB    59   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     22  2HB    59   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      23  HA     23   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      23  1HB    23   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      23  2HB    23   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      23  1HG    23   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      23  2HG    23   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      23  HD     23   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     23  HG     23   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     23  H      24   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    1HB    23  HD     23   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HB    23  HD     23   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HB    23  H      24   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    23  H      24   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     23  H      25   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG     23  H      24   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG     23  HB     24   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    H      24  HA     24   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      24  HB     24   BOUNDED   1.80   4.50    0.3  NOE 
AmbiguousNMRDistance    H      24  HG     24   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     24  HG     24   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     24  H      25   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    HB     24  H      25   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG     24  H      25   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG     24  HA     25   BOUNDED   1.80   6.60    0.3  NOE 
AmbiguousNMRDistance    H      25  HA     25   BOUNDED   1.80   5.60    0.3  NOE 
AmbiguousNMRDistance    H      25  H      26   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     25  H      26   BOUNDED   1.80   5.60    0.3  NOE 
AmbiguousNMRDistance    HA     25  H      27   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      26  HA     26   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      26  1HB    26   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      26  2HB    26   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      26  HG     26   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      26  H      27   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      26  HB     59   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     26  H      27   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG     26  HB     59   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    H      27  HA     27   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      27  HB     27   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      27  HG2    27   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     27  HG2    27   BOUNDED   1.80   5.60    0.3  NOE 
AmbiguousNMRDistance    HA     27  H      28   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    HB     27  H      28   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    HG2    27  H      28   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      28  HA     28   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      28  1HB    28   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      28  2HB    28   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     28  H      29   BOUNDED   1.80   2.90    0.3  NOE 
AmbiguousNMRDistance    HA     28  H      56   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    28  H      29   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    28  H      29   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    28  HE     55   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    2HB    28  HE     55   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    1HB    28  HB     57   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    28  HB     57   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    28  HG1    57   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HB    28  HG2    57   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HB    28  HG1    57   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HB    28  HG2    57   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      29  HA     29   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      29  1HB    29   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      29  2HB    29   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      29  H      56   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      29  1HB    56   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      29  2HB    56   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      29  HB     57   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      29  HG2    57   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     29  H      30   BOUNDED   1.80   2.90    0.3  NOE 
AmbiguousNMRDistance    HA     29  H      56   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    29  H      30   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    29  H      30   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     29  HD     31   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    1HB    29  HE     31   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    2HB    29  HE     31   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    1HB    29  H      56   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    29  H      56   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     29  HB     56   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    H      30  HA     30   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      30  HB     30   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      30  HG2    30   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      30  H      31   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     30  HG2    30   BOUNDED   1.80   5.60    0.3  NOE 
AmbiguousNMRDistance    HA     30  H      31   BOUNDED   1.80   2.90    0.3  NOE 
AmbiguousNMRDistance    HA     30  HA     55   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     30  H      56   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HG2    30  H      31   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    30  HA     55   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    30  HB     55   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG2    30  HD     55   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HG2    30  H      56   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      31  HA     31   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      31  1HB    31   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      31  2HB    31   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      31  HD     31   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    H      31  HD1    46   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      31  H      54   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      31  HB     54   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      31  HA     55   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     31  HD     31   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     31  H      32   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    HA     31  HG2    32   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     31  H      33   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    31  HD     31   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    2HB    31  HD     31   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HB     31  HE     31   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    1HB    31  H      32   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    31  H      32   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     31  HG1    34   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HB     31  HG2    34   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HB     31  2HE2   38   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     31  HG2    42   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    1HB    31  HD1    46   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HB    31  HD1    46   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HB    31  H      54   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    31  H      54   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    31  HB     54   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    31  HB     54   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     31  HG2    54   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HB     31  HD1    54   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD     31  H      35   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD     31  HB     38   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HD     31  HG     38   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HD     31  HG2    42   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HD     31  HD1    42   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HD     31  HB     54   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD     31  HG2    54   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HD     31  HD1    54   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HE     31  HB     36   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HE     31  HG     38   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HE     31  HG1    42   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HE     31  HG2    42   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HE     31  HD1    42   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HE     31  HG2    54   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HE     31  H      56   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HE     31  1HB    56   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HE     31  2HB    56   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HE     31  HG2    61   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    H      32  HA     32   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      32  HB     32   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      32  HG2    32   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      32  H      33   BOUNDED   1.80   2.90    0.3  NOE 
AmbiguousNMRDistance    H      32  HA     33   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      32  HG     33   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      32  HD1    46   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     32  H      33   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     32  HB     53   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     32  H      33   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HG2    32  H      33   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    32  1HB    53   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    32  2HB    53   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    32  H      54   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      33  HA     33   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      33  HB     33   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      33  HG     33   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      33  HD     33   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      33  HG2    34   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      33  HB     46   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      33  HD1    46   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     33  H      34   BOUNDED   1.80   2.90    0.3  NOE 
AmbiguousNMRDistance    HB     33  HD     33   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HB     33  HE     33   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG     33  HE     33   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    H      34  HA     34   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      34  HB     34   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      34  HG1    34   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      34  HG2    34   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      34  HD1    46   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     34  HG1    34   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     34  HG2    34   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     34  H      35   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    HA     34  2HE2   38   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     34  1HE2   38   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     34  1HD2   43   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     34  HD1    46   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     34  H      35   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HG1    34  H      35   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    34  H      35   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    34  HA     43   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    34  HA     43   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    34  1HB    43   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    34  2HB    43   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    34  1HB    43   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    34  2HB    43   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    34  2HD2   43   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    34  1HD2   43   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    34  H      46   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    34  1HB    46   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    34  2HB    46   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    34  HD1    46   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG2    34  H      47   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    34  HA     47   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    34  1HD    47   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    34  2HD    47   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    34  HE     47   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG2    34  HE     47   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    H      35  HA     35   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      35  1HB    35   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      35  2HB    35   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      35  HB     38   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      35  2HE2   38   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      35  1HE2   38   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      35  1HD2   43   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      35  HD1    46   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     35  H      36   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     35  H      37   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     35  1HE2   38   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      36  HA     36   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     36  H      37   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     36  H      37   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      37  HA     37   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      37  1HB    37   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      37  2HB    37   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      37  H      38   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      37  HB     38   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      37  HG     38   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     37  H      38   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     37  H      38   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      38  HA     38   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      38  1HB    38   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      38  2HB    38   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      38  HG     38   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      38  2HE2   38   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      38  1HD    39   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      38  2HD    39   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     38  HD     39   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HB    38  2HE2   38   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    38  1HE2   38   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    38  2HE2   38   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    38  1HE2   38   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    38  1HD    39   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    38  2HD    39   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    38  1HD    39   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    38  2HD    39   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    38  HB     42   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    38  HB     42   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    38  HG2    42   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HB    38  HG2    42   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HB    38  2HD2   43   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    38  1HD2   43   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    38  1HD2   43   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HG     38  2HE2   38   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG     38  HG2    42   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG     38  1HD2   43   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HE2   38  HG2    42   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HE2   38  HG2    42   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HE2   38  HD1    46   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HE2   38  HD2    46   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HE2   38  HD1    46   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     39  H      40   BOUNDED   1.80   2.90    0.3  NOE 
AmbiguousNMRDistance    HA     39  HB     40   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     39  H      41   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    39  H      40   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    39  H      40   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    39  H      41   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    39  H      41   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    39  HB     41   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HB    39  HB     41   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HB    39  HD     41   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    2HB    39  HD     41   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    1HB    39  H      42   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    39  H      42   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     39  HB     42   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HB    39  HG1    42   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HB    39  HG1    42   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     39  HG2    42   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HB     39  HD1    42   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    1HB    39  HG1    81   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HB    39  HG1    81   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG     39  1HG1   42   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG     39  2HG1   42   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG     39  HD1    42   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    1HD    39  HB     42   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HD    39  HB     42   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HD    39  1HG1   42   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HD    39  2HG1   42   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HD    39  1HG1   42   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HD    39  2HG1   42   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HD    39  HG2    42   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HD    39  HG2    42   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD     39  HD1    42   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD     39  HG1    81   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    H      40  HA     40   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      40  HB     40   BOUNDED   1.80   5.60    0.3  NOE 
AmbiguousNMRDistance    H      40  H      41   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     40  H      41   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     40  H      43   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     40  1HB    43   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     40  2HB    43   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     40  2HD2   43   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     40  1HD2   43   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     40  H      44   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     40  H      41   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     40  HB     41   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HB     40  HD     41   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HB     40  H      44   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      41  HA     41   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      41  1HB    41   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      41  2HB    41   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      41  HD     41   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    H      41  H      42   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      41  HG1    81   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     41  HD     41   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     41  H      42   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     41  HG1    81   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HB    41  HD     41   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    2HB    41  HD     41   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HB     41  H      42   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     41  HG1    81   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD     41  HG1    42   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HD     41  HG1    81   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HD     41  HD1    84   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HE     41  HD1    84   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HE     41  HD2    84   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HZ     41  HD1    84   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      42  HA     42   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      42  HB     42   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      42  1HG1   42   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      42  2HG1   42   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      42  HG2    42   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      42  HD1    42   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      42  H      43   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    HA     42  1HG1   42   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     42  2HG1   42   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     42  HG2    42   BOUNDED   1.80   5.60    0.3  NOE 
AmbiguousNMRDistance    HA     42  HD1    42   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     42  H      43   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     42  HA     43   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     42  H      45   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     42  HB     45   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     42  HD1    45   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     42  H      46   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     42  HD1    54   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     42  HD1    42   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     42  H      43   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HG1   42  HG2    42   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HG1   42  HG2    42   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    42  H      43   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    42  HG2    45   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG1    42  HD1    54   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG1    42  HZ     82   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    42  HD1    42   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG2    42  H      43   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    42  HA     43   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    42  1HD2   43   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    42  H      44   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    42  H      45   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    42  HB     45   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    42  H      46   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    42  HG     46   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    42  HD1    46   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG2    42  HB     54   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    42  HG2    54   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG2    42  HD1    54   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG2    42  HG2    61   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD1    42  H      43   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD1    42  HB     45   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD1    42  HG1    45   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD1    42  H      46   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD1    42  HG1    54   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD1    42  HG2    54   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD1    42  HD1    54   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD1    42  HG2    61   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD1    42  HD1    61   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD1    42  HG2    63   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD1    42  HE     82   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HD1    42  HZ     82   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      43  HA     43   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      43  1HB    43   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      43  2HB    43   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      43  2HD2   43   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      43  H      44   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    HA     43  2HD2   43   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     43  1HD2   43   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     43  H      44   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     43  H      46   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     43  1HB    46   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     43  2HB    46   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     43  HD1    46   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     43  H      47   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    43  2HD2   43   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    43  1HD2   43   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    43  2HD2   43   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    43  1HD2   43   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     43  HA     44   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     43  1HD    47   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     43  2HD    47   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      44  HA     44   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      44  H      45   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      44  HG1    45   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      44  HG1    81   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      44  HG2    81   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     44  H      45   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     44  H      47   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     44  HB     47   BOUNDED   1.80   4.50    0.3  NOE 
AmbiguousNMRDistance    HA     44  HG     47   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     44  HD     47   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     44  HG1    81   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    H      45  HA     45   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      45  HB     45   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      45  1HG1   45   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      45  2HG1   45   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      45  HG2    45   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      45  HD1    45   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      45  H      46   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      45  HG     46   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      45  HD1    54   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      45  HG1    81   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      45  HG2    81   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     45  1HG1   45   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     45  2HG1   45   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     45  HG2    45   BOUNDED   1.80   5.60    0.3  NOE 
AmbiguousNMRDistance    HA     45  HD1    45   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     45  H      46   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     45  H      47   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     45  HB     48   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     45  HG2    48   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     45  HD1    45   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     45  H      46   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     45  HD1    54   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HG1   45  HG2    45   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HG1   45  HG2    45   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    45  HG2    48   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG1    45  HB     77   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    1HG1   45  HA     78   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HG1   45  HA     78   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HG1    45  HG1    78   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    1HG1   45  HG1    81   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HG1   45  HG2    81   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HG1   45  HG2    81   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    45  HD1    45   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG2    45  H      46   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    45  HA     46   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    45  HG     46   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    45  HD2    46   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG2    45  HB     48   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    45  HB     51   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    45  HG2    51   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG2    45  HG1    54   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG2    45  HD1    54   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG2    45  HG1    63   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG2    45  HG2    78   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD1    45  HD1    54   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD1    45  HA     78   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD1    45  HE     82   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HD1    45  HZ     82   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      46  HA     46   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      46  1HB    46   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      46  2HB    46   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      46  HG     46   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      46  HD1    46   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      46  HD2    46   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      46  H      47   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      46  HD1    54   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     46  HG     46   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     46  HD1    46   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     46  HD2    46   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     46  H      47   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     46  HB     51   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     46  HG1    51   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     46  HD1    54   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HB    46  HD1    46   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HB    46  HD2    46   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HB    46  HD1    46   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HB    46  HD2    46   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     46  H      47   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     46  HG     47   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HB     46  HD     47   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HB     46  HG1    51   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG     46  HD1    54   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD2    46  HG1    51   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD2    46  H      53   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD2    46  H      54   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD2    46  HB     54   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD2    46  1HG1   54   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD2    46  2HG1   54   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD1    46  HD1    54   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD2    46  HD1    54   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    H      47  HA     47   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      47  1HB    47   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      47  2HB    47   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      47  1HG    47   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      47  2HG    47   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      47  HD     47   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      47  H      48   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      47  HG2    48   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     47  1HG    47   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     47  2HG    47   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     47  HD     47   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     47  H      48   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    47  HD     47   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HB    47  HD     47   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     47  HE     47   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    1HB    47  H      48   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    47  H      48   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     47  HA     48   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HG    47  HE     47   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HG    47  HE     47   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      48  HA     48   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      48  HB     48   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      48  HG2    48   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      48  H      49   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      48  HG2    51   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     48  HG1    48   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     48  HG2    48   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     48  H      49   BOUNDED   1.80   2.90    0.3  NOE 
AmbiguousNMRDistance    HA     48  HA     49   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     48  HB     49   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     48  HG     49   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     48  H      49   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     48  HG1    51   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     48  HG2    51   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    48  H      49   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    48  H      49   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    48  HA     49   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    48  H      50   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    48  H      51   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    48  HG2    51   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG1    48  HA     74   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    48  HG2    74   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG1    48  H      77   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    48  1HB    77   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    48  2HB    77   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    48  1HB    77   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    48  2HB    77   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    48  1HG    77   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    48  2HG    77   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    48  1HG    77   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    48  2HG    77   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    48  HD     77   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG2    48  HD     77   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG1    48  HE     77   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG1    48  H      78   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      49  HA     49   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      49  HB     49   BOUNDED   1.80   4.50    0.3  NOE 
AmbiguousNMRDistance    H      49  HG     49   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     49  HG     49   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     49  H      50   BOUNDED   1.80   2.90    0.3  NOE 
AmbiguousNMRDistance    HA     49  HA     50   BOUNDED   1.80   5.60    0.3  NOE 
AmbiguousNMRDistance    HA     49  H      51   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     49  H      50   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG     49  H      50   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      50  1HA    50   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      50  2HA    50   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      50  H      51   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      50  HG2    51   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      50  HB     69   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HA    50  H      51   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HA    50  H      51   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     50  H      66   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     50  HB     66   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HA     50  1HG    66   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     50  2HG    66   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HA    50  HB     69   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HA    50  HB     69   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HA    50  HG2    74   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HA    50  HG2    74   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      51  HA     51   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      51  HB     51   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      51  HG2    51   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      51  HG2    74   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     51  HG1    51   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     51  HG2    51   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     51  H      52   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    HA     51  HA     65   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     51  H      66   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     51  H      52   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HG1    51  H      52   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    51  H      52   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    51  H      53   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    51  HG1    63   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG2    51  HG1    63   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG1    51  H      64   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    51  HA     65   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    51  HG2    74   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    H      52  HA     52   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      52  1HB    52   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      52  2HB    52   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      52  H      53   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      52  HB     64   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      52  HA     65   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      52  H      66   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     52  H      53   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     52  HD     52   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    1HB    52  HE     52   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HB    52  HE     52   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HB    52  H      53   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    52  H      53   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     52  1HB    64   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     52  2HB    64   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     52  HG     66   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    1HG    52  HE     52   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HG    52  HE     52   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HE     52  HB     64   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HE     52  HB     66   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    H      53  HA     53   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      53  1HB    53   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      53  2HB    53   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      53  H      54   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      53  HG1    63   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      53  H      64   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      53  1HB    64   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      53  2HB    64   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      53  HA     65   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     53  H      54   BOUNDED   1.80   2.90    0.3  NOE 
AmbiguousNMRDistance    1HB    53  H      54   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    53  H      54   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     53  HB     64   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    H      54  HA     54   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      54  HB     54   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      54  HG1    54   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      54  HG2    54   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      54  HD1    54   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      54  H      55   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     54  HG2    54   BOUNDED   1.80   5.60    0.3  NOE 
AmbiguousNMRDistance    HA     54  H      55   BOUNDED   1.80   2.90    0.3  NOE 
AmbiguousNMRDistance    HA     54  H      64   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     54  HD1    54   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     54  H      55   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HG1   54  HG2    54   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HG1   54  HG2    54   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    54  H      55   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    54  HG2    61   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG1    54  HG1    63   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG1    54  HG2    63   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG2    54  H      55   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    54  HA     55   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    54  H      56   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    54  1HB    56   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    54  2HB    56   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    54  HA     61   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    54  HB     61   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    54  H      62   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      55  HA     55   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      55  1HB    55   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      55  2HB    55   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      55  H      56   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      55  H      62   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      55  HB     62   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      55  HA     63   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     55  HD     55   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     55  H      56   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    1HB    55  HD     55   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    2HB    55  HD     55   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HB     55  H      56   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     55  H      62   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HB    55  HB     62   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HB    55  HB     62   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD     55  H      56   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD     55  HG1    57   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HD     55  HB     62   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HE     55  HB     57   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HE     55  HG1    57   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HE     55  HG2    57   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HE     55  HZ     60   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HZ     55  HG1    57   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HZ     55  HG2    57   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      56  HA     56   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      56  1HB    56   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      56  2HB    56   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      56  HG2    61   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     56  HD2    56   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     56  H      57   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    HA     56  HG1    57   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     56  HA     61   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     56  HG2    61   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     56  HD2    56   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     56  H      57   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HB    56  HG2    61   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HB    56  HG2    61   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD2    56  H      57   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HD2    56  HA     57   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HD2    56  H      60   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HD2    56  HA     61   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HD2    56  HG1    61   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD2    56  HG2    61   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD2    56  HD1    61   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      57  HA     57   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      57  HB     57   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      57  HG1    57   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      57  HG2    57   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      57  H      60   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      57  HA     61   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      57  HG2    61   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      57  H      62   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     57  HG1    57   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     57  HG2    57   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     57  H      58   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    HB     57  H      58   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     57  HZ     60   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HG1    57  H      58   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    57  H      58   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    57  HB     58   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG1    57  HG     58   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG2    57  HG     58   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG1    57  H      60   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    57  HD     60   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HG1    57  HE     60   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HG1    57  HZ     60   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    57  HZ     60   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      58  HA     58   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      58  HB     58   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      58  HG     58   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     58  HG     58   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     58  H      59   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     58  H      59   BOUNDED   1.80   4.50    0.3  NOE 
AmbiguousNMRDistance    HB     58  H      60   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     58  HD     60   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HB     58  HE     60   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HG     58  1HB    59   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG     58  2HB    59   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      59  HA     59   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      59  1HB    59   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      59  2HB    59   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      59  H      60   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      59  HD     60   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    H      59  HE     60   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HA     59  H      60   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     59  H      60   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      60  HA     60   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      60  1HB    60   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      60  2HB    60   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      60  HD     60   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HA     60  HD     60   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     60  H      61   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    HA     60  HG1    61   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HB    60  HD     60   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    2HB    60  HD     60   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    1HB    60  H      61   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    60  H      61   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HD     60  H      61   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD     60  HA     61   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD     60  HG1    61   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HD     60  HG2    61   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HD     60  H      62   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD     60  HB     62   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HE     60  HB     62   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    H      61  HA     61   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      61  HB     61   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      61  1HG1   61   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      61  2HG1   61   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      61  HG2    61   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      61  HD1    61   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      61  H      62   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     61  HG2    61   BOUNDED   1.80   5.60    0.3  NOE 
AmbiguousNMRDistance    HA     61  H      62   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    HB     61  HD1    61   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     61  H      62   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     61  HG2    63   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HG1   61  HG2    61   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HG1   61  HG2    61   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    61  H      62   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    61  H      62   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    61  HG2    63   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD1    61  HE     82   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HD1    61  HZ     82   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      62  HA     62   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      62  HB     62   BOUNDED   1.80   4.50    0.3  NOE 
AmbiguousNMRDistance    H      62  HG2    63   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     62  H      63   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    HA     62  HG2    63   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     62  H      63   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      63  HA     63   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      63  HB     63   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      63  HG2    63   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     63  H      64   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     63  HZ2    71   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     63  HH2    71   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HG1    63  H      64   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    63  HA     64   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    63  HZ2    71   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    63  HH2    71   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    63  HZ3    71   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      64  HA     64   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      64  1HB    64   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      64  2HB    64   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     64  H      65   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    HA     64  HZ2    71   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     64  HH2    71   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    64  H      65   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    64  H      65   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      65  HA     65   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      65  1HB    65   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      65  2HB    65   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      65  1HG    65   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      65  2HG    65   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      65  1HD    65   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      65  2HD    65   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      65  HZ2    71   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      65  HH2    71   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     65  1HG    65   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     65  2HG    65   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     65  H      66   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     65  HB     69   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HB    65  1HD    65   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    65  2HD    65   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    65  1HD    65   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    65  2HD    65   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    65  H      66   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    65  H      66   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     65  HB     69   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HB     65  HZ2    71   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     65  HH2    71   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HG    65  HE     65   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HG    65  HE     65   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HG    65  H      66   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HG    65  H      66   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HG     65  HA     66   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HG    65  HE1    71   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HG    65  HE1    71   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HG    65  HZ2    71   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HG    65  HZ2    71   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HG     65  HH2    71   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HD    65  H      66   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HD    65  H      66   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HD     65  H      69   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HD    65  HB     69   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HD    65  HB     69   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD     65  H      71   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD     65  HE1    71   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HE     65  H      71   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HE     65  HD1    71   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HE     65  HE1    71   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HE     65  HZ2    71   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      66  HA     66   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      66  1HB    66   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      66  2HB    66   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      66  1HG    66   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      66  2HG    66   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      66  H      67   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      66  HB     69   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     66  1HG    66   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     66  2HG    66   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     66  H      67   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     66  HB     67   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     66  H      67   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     66  HB     67   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    1HB    66  H      68   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    66  H      68   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    66  H      69   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    66  H      69   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    66  HB     69   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HB    66  HB     69   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG     66  HB     69   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    H      67  HA     67   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      67  HB     67   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      67  H      68   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     67  H      68   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     67  2HD2   67   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     67  1HD2   67   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     67  H      68   BOUNDED   1.80   4.50    0.3  NOE 
AmbiguousNMRDistance    H      68  HA     68   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      68  HB     68   BOUNDED   1.80   4.50    0.3  NOE 
AmbiguousNMRDistance    H      68  H      69   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    HB     68  H      69   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      69  HA     69   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      69  HB     69   BOUNDED   1.80   5.60    0.3  NOE 
AmbiguousNMRDistance    HA     69  H      70   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     69  H      70   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     69  HG2    74   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    H      70  HA     70   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      70  1HB    70   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      70  2HB    70   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      70  HG2    74   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     70  H      71   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    1HB    70  2HD2   70   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    70  2HD2   70   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    70  1HD2   70   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    70  H      71   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    70  H      71   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    70  H      72   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    70  H      72   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    70  H      73   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    70  H      73   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      71  HA     71   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      71  HB     71   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      71  HD1    71   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      71  H      72   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      71  H      73   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     71  H      73   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     71  H      74   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     71  H      75   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    71  HD1    71   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    71  HD1    71   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     71  HE1    71   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     71  HE3    71   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     71  H      72   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     71  HB     75   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HB     71  HD1    75   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HH2    71  HG1    74   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HZ3    71  HB     74   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HZ3    71  HG1    74   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HZ3    71  HG2    78   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HE3    71  HB     74   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HE3    71  HG1    74   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HE3    71  H      75   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HE3    71  HB     75   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HE3    71  HG     75   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HE3    71  HD1    75   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      72  HA     72   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      72  1HB    72   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      72  2HB    72   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      72  HG     72   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      72  H      73   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    HA     72  HG     72   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     72  H      73   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     72  H      74   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     72  HB     75   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HB    72  H      73   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    72  H      73   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HG     72  H      73   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG     72  HB     75   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    H      73  HA     73   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      73  HB     73   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      73  HG2    73   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      73  H      74   BOUNDED   1.80   2.90    0.3  NOE 
AmbiguousNMRDistance    H      73  HA     74   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      73  HB     74   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      73  HG1    74   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      73  HG2    74   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      73  H      75   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     73  HG2    73   BOUNDED   1.80   5.60    0.3  NOE 
AmbiguousNMRDistance    HA     73  H      74   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     73  H      74   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HG2    73  H      74   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    73  HA     74   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    73  HG1    74   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG2    73  HD     77   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG2    73  HE     77   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    H      74  HA     74   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      74  HB     74   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      74  HG1    74   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      74  HG2    74   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      74  H      75   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      74  HD     76   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     74  HG1    74   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     74  HG2    74   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     74  H      75   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     74  H      77   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     74  HB     77   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     74  1HD    77   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     74  2HD    77   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     74  H      75   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HG1    74  H      75   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    74  H      75   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    74  H      77   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    74  H      77   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    74  HD     77   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG1    74  H      78   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    74  HG2    78   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    H      75  HA     75   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      75  HB     75   BOUNDED   1.80   4.50    0.3  NOE 
AmbiguousNMRDistance    H      75  HG     75   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      75  HD1    75   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      75  1HD    76   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      75  2HD    76   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      75  H      77   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     75  HG     75   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     75  HD1    75   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     75  HB     78   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     75  HG1    78   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     75  HG2    78   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     75  H      79   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     75  HD1    75   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HB     75  HD2    75   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HB     75  1HD    76   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     75  2HD    76   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG     75  HD     76   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD1    75  HD     76   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD2    75  HD     76   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HD1    75  HB     78   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HD2    75  HB     78   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     76  H      77   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     76  H      79   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     76  H      80   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    76  H      77   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    76  H      77   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HG     76  H      77   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG     76  HD     77   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    1HD    76  H      77   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HD    76  H      77   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      77  HA     77   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      77  1HB    77   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      77  2HB    77   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      77  1HG    77   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      77  2HG    77   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      77  HD     77   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      77  H      78   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      77  HG2    78   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      77  H      79   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     77  1HG    77   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     77  2HG    77   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     77  1HD    77   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     77  2HD    77   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     77  H      78   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     77  H      80   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     77  HB     80   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     77  1HD    77   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     77  2HD    77   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HB    77  H      78   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    77  H      78   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     77  HA     78   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     77  HG2    78   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    1HG    77  HE     77   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HG    77  HE     77   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      78  HA     78   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      78  HB     78   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      78  HG1    78   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      78  HG2    78   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      78  H      79   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    HA     78  HG1    78   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     78  HG2    78   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     78  H      79   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     78  H      81   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     78  HB     81   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     78  HG1    81   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     78  HG2    81   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     78  H      79   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    HG1    78  H      79   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    78  H      79   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    78  HA     79   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    78  HB     81   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG1    78  HD     82   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HG1    78  HE     82   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HG1    78  HZ     82   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      79  HA     79   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      79  HB     79   BOUNDED   1.80   4.50    0.3  NOE 
AmbiguousNMRDistance    H      79  HG     79   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      79  H      80   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      79  HB     80   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     79  1HG    79   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     79  2HG    79   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     79  H      80   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     79  H      82   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     79  HD     82   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HB     79  H      80   BOUNDED   1.80   4.50    0.3  NOE 
AmbiguousNMRDistance    HG     79  HD     82   BOUNDED   1.80   8.00    0.3  NOE 
AmbiguousNMRDistance    HG     79  1HB    83   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG     79  2HB    83   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG     79  HG     83   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    H      80  HA     80   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      80  HB     80   BOUNDED   1.80   5.60    0.3  NOE 
AmbiguousNMRDistance    H      80  H      81   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    HA     80  H      81   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     80  1HB    83   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     80  2HB    83   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     80  HG     83   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     80  H      81   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     80  HA     81   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     80  H      83   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      81  HA     81   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      81  HB     81   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      81  HG1    81   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      81  HG2    81   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      81  H      82   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    HA     81  HG1    81   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     81  HG2    81   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     81  H      82   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     81  HG     84   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     81  HD1    84   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     81  HD2    84   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     81  H      82   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     81  HD     82   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HB     81  HE     82   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG1    81  H      82   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG2    81  H      82   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      82  HA     82   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      82  1HB    82   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      82  2HB    82   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      82  HD     82   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    H      82  HZ     82   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      82  H      83   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    HA     82  HD     82   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     82  H      83   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    1HB    82  HD     82   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    2HB    82  HD     82   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    1HB    82  H      83   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    82  H      83   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HD     82  H      83   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    H      83  HA     83   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      83  1HB    83   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      83  2HB    83   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      83  HG     83   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      83  H      84   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      83  HG     84   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      83  HD2    84   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     83  HG     83   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     83  H      84   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    1HB    83  H      84   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    83  H      84   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     83  HB     84   BOUNDED   1.80   7.00    0.3  NOE 
AmbiguousNMRDistance    HG     83  H      84   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      84  HA     84   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      84  1HB    84   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      84  2HB    84   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      84  HG     84   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    H      84  HD2    84   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      84  H      85   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    HA     84  HG     84   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HA     84  HD1    84   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     84  HD2    84   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     84  H      85   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    1HB    84  HD1    84   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HB    84  HD2    84   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HB    84  HD1    84   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    2HB    84  HD2    84   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    1HB    84  H      85   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    2HB    84  H      85   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HD2    84  H      85   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      85  HA     85   BOUNDED   1.80   3.50    0.3  NOE 
AmbiguousNMRDistance    H      85  HB     85   BOUNDED   1.80   4.50    0.3  NOE 
AmbiguousNMRDistance    H      85  HG     85   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     85  HG     85   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HA     85  H      86   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     85  H      86   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HG     85  H      86   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      86  HA     86   BOUNDED   1.80   5.00    0.3  NOE 
AmbiguousNMRDistance    HB     86  H      87   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    HB     86  HA     87   BOUNDED   1.80   6.00    0.3  NOE 
AmbiguousNMRDistance    H      87  HA     87   BOUNDED   1.80   5.00    0.3  NOE 

# Dihedral angle --ACO--  file produced by PDBStat
Dihedral  C      2  N      3   CA     3   C      3  CIRCULARHARMONIC   -0.70   2.27 
Dihedral  C      3  N      4   CA     4   C      4  CIRCULARHARMONIC   -2.09   0.61 
Dihedral  C      4  N      5   CA     5   C      5  CIRCULARHARMONIC   -0.61   2.53 
Dihedral  C      5  N      6   CA     6   C      6  CIRCULARHARMONIC   -0.74   2.05 
Dihedral  C      6  N      7   CA     7   C      7  CIRCULARHARMONIC   -0.83   1.96 
Dihedral  C      8  N      9   CA     9   C      9  CIRCULARHARMONIC   -2.09   0.70 
Dihedral  C     10  N     11   CA    11   C     11  CIRCULARHARMONIC   -2.09   0.70 
Dihedral  C     12  N     13   CA    13   C     13  CIRCULARHARMONIC   -0.70   2.18 
Dihedral  C     13  N     14   CA    14   C     14  CIRCULARHARMONIC   -2.09   0.70 
Dihedral  N     14  CA    14   C     14   N     15  CIRCULARHARMONIC    2.09   1.05 
Dihedral  C     14  N     15   CA    15   C     15  CIRCULARHARMONIC   -2.09   0.61 
Dihedral  N     15  CA    15   C     15   N     16  CIRCULARHARMONIC    2.09   1.05 
Dihedral  C     15  N     16   CA    16   C     16  CIRCULARHARMONIC   -2.09   0.70 
Dihedral  N     16  CA    16   C     16   N     17  CIRCULARHARMONIC    2.09   1.05 
Dihedral  C     16  N     17   CA    17   C     17  CIRCULARHARMONIC   -2.09   0.70 
Dihedral  N     17  CA    17   C     17   N     18  CIRCULARHARMONIC    2.09   1.05 
Dihedral  C     17  N     18   CA    18   C     18  CIRCULARHARMONIC   -0.74   2.14 
Dihedral  C     18  N     19   CA    19   C     19  CIRCULARHARMONIC   -2.09   0.70 
Dihedral  C     19  N     20   CA    20   C     20  CIRCULARHARMONIC    1.05   2.36 
Dihedral  C     20  N     21   CA    21   C     21  CIRCULARHARMONIC   -0.74   2.14 
Dihedral  C     21  N     22   CA    22   C     22  CIRCULARHARMONIC   -0.74   2.14 
Dihedral  C     22  N     23   CA    23   C     23  CIRCULARHARMONIC   -0.65   2.49 
Dihedral  C     23  N     24   CA    24   C     24  CIRCULARHARMONIC   -0.65   2.49 
Dihedral  C     25  N     26   CA    26   C     26  CIRCULARHARMONIC   -0.74   2.05 
Dihedral  C     26  N     27   CA    27   C     27  CIRCULARHARMONIC   -0.70   2.44 
Dihedral  C     27  N     28   CA    28   C     28  CIRCULARHARMONIC   -0.65   2.31 
Dihedral  C     28  N     29   CA    29   C     29  CIRCULARHARMONIC   -2.18   0.96 
Dihedral  N     29  CA    29   C     29   N     30  CIRCULARHARMONIC    2.09   1.05 
Dihedral  C     29  N     30   CA    30   C     30  CIRCULARHARMONIC   -2.09   0.61 
Dihedral  N     30  CA    30   C     30   N     31  CIRCULARHARMONIC    2.09   1.05 
Dihedral  C     30  N     31   CA    31   C     31  CIRCULARHARMONIC   -2.09   0.61 
Dihedral  N     31  CA    31   C     31   N     32  CIRCULARHARMONIC    2.09   1.05 
Dihedral  C     31  N     32   CA    32   C     32  CIRCULARHARMONIC   -2.09   0.44 
Dihedral  C     32  N     33   CA    33   C     33  CIRCULARHARMONIC   -0.70   2.27 
Dihedral  C     33  N     34   CA    34   C     34  CIRCULARHARMONIC    1.05   2.44 
Dihedral  C     34  N     35   CA    35   C     35  CIRCULARHARMONIC   -0.65   2.31 
Dihedral  C     39  N     40   CA    40   C     40  CIRCULARHARMONIC    1.05   2.09 
Dihedral  C     40  N     41   CA    41   C     41  CIRCULARHARMONIC    1.05   2.18 
Dihedral  C     42  N     43   CA    43   C     43  CIRCULARHARMONIC   -1.09   0.22 
Dihedral  N     43  CA    43   C     43   N     44  CIRCULARHARMONIC   -0.61   0.70 
Dihedral  C     43  N     44   CA    44   C     44  CIRCULARHARMONIC   -0.83   0.31 
Dihedral  N     44  CA    44   C     44   N     45  CIRCULARHARMONIC   -0.61   0.70 
Dihedral  C     44  N     45   CA    45   C     45  CIRCULARHARMONIC   -1.13   0.61 
Dihedral  N     45  CA    45   C     45   N     46  CIRCULARHARMONIC   -0.61   0.70 
Dihedral  C     45  N     46   CA    46   C     46  CIRCULARHARMONIC   -1.13   0.61 
Dihedral  N     46  CA    46   C     46   N     47  CIRCULARHARMONIC   -0.61   0.70 
Dihedral  C     46  N     47   CA    47   C     47  CIRCULARHARMONIC   -1.48   0.26 
Dihedral  N     47  CA    47   C     47   N     48  CIRCULARHARMONIC   -0.61   0.70 
Dihedral  C     47  N     48   CA    48   C     48  CIRCULARHARMONIC   -0.61   2.53 
Dihedral  C     48  N     49   CA    49   C     49  CIRCULARHARMONIC    1.05   2.36 
Dihedral  C     50  N     51   CA    51   C     51  CIRCULARHARMONIC   -0.70   2.44 
Dihedral  C     51  N     52   CA    52   C     52  CIRCULARHARMONIC   -0.74   2.05 
Dihedral  C     52  N     53   CA    53   C     53  CIRCULARHARMONIC   -2.18   0.96 
Dihedral  N     53  CA    53   C     53   N     54  CIRCULARHARMONIC    2.09   1.05 
Dihedral  C     53  N     54   CA    54   C     54  CIRCULARHARMONIC   -2.09   0.61 
Dihedral  N     54  CA    54   C     54   N     55  CIRCULARHARMONIC    2.09   1.05 
Dihedral  C     54  N     55   CA    55   C     55  CIRCULARHARMONIC   -2.09   0.61 
Dihedral  N     55  CA    55   C     55   N     56  CIRCULARHARMONIC    2.09   1.05 
Dihedral  C     55  N     56   CA    56   C     56  CIRCULARHARMONIC   -2.09   0.70 
Dihedral  N     56  CA    56   C     56   N     57  CIRCULARHARMONIC    2.09   1.05 
Dihedral  C     56  N     57   CA    57   C     57  CIRCULARHARMONIC   -0.70   2.36 
Dihedral  C     57  N     58   CA    58   C     58  CIRCULARHARMONIC   -0.70   2.44 
Dihedral  C     58  N     59   CA    59   C     59  CIRCULARHARMONIC   -2.09   0.70 
Dihedral  C     60  N     61   CA    61   C     61  CIRCULARHARMONIC   -2.09   0.61 
Dihedral  N     61  CA    61   C     61   N     62  CIRCULARHARMONIC    2.09   1.05 
Dihedral  C     61  N     62   CA    62   C     62  CIRCULARHARMONIC   -2.09   0.61 
Dihedral  N     62  CA    62   C     62   N     63  CIRCULARHARMONIC    2.09   1.05 
Dihedral  C     62  N     63   CA    63   C     63  CIRCULARHARMONIC   -2.09   0.70 
Dihedral  N     63  CA    63   C     63   N     64  CIRCULARHARMONIC    2.09   1.05 
Dihedral  C     63  N     64   CA    64   C     64  CIRCULARHARMONIC   -2.18   0.96 
Dihedral  N     64  CA    64   C     64   N     65  CIRCULARHARMONIC    2.09   1.05 
Dihedral  C     68  N     69   CA    69   C     69  CIRCULARHARMONIC   -0.74   2.14 
Dihedral  C     69  N     70   CA    70   C     70  CIRCULARHARMONIC   -2.09   0.61 
Dihedral  C     70  N     71   CA    71   C     71  CIRCULARHARMONIC   -1.13   0.61 
Dihedral  N     71  CA    71   C     71   N     72  CIRCULARHARMONIC   -0.61   0.70 
Dihedral  C     71  N     72   CA    72   C     72  CIRCULARHARMONIC   -0.96   0.26 
Dihedral  N     72  CA    72   C     72   N     73  CIRCULARHARMONIC   -0.61   0.70 
Dihedral  C     72  N     73   CA    73   C     73  CIRCULARHARMONIC   -1.40   0.35 
Dihedral  N     73  CA    73   C     73   N     74  CIRCULARHARMONIC   -0.61   0.70 
Dihedral  C     73  N     74   CA    74   C     74  CIRCULARHARMONIC   -1.13   0.61 
Dihedral  N     74  CA    74   C     74   N     75  CIRCULARHARMONIC   -0.61   0.70 
Dihedral  C     74  N     75   CA    75   C     75  CIRCULARHARMONIC   -1.13   0.61 
Dihedral  N     75  CA    75   C     75   N     76  CIRCULARHARMONIC   -0.61   0.70 
Dihedral  C     76  N     77   CA    77   C     77  CIRCULARHARMONIC   -1.40   0.35 
Dihedral  N     77  CA    77   C     77   N     78  CIRCULARHARMONIC   -0.61   0.70 
Dihedral  C     77  N     78   CA    78   C     78  CIRCULARHARMONIC   -1.13   0.61 
Dihedral  N     78  CA    78   C     78   N     79  CIRCULARHARMONIC   -0.61   0.70 
Dihedral  C     78  N     79   CA    79   C     79  CIRCULARHARMONIC   -0.92   0.31 
Dihedral  N     79  CA    79   C     79   N     80  CIRCULARHARMONIC   -0.61   0.70 
Dihedral  C     79  N     80   CA    80   C     80  CIRCULARHARMONIC   -0.92   0.31 
Dihedral  N     80  CA    80   C     80   N     81  CIRCULARHARMONIC   -0.61   0.70 
Dihedral  C     80  N     81   CA    81   C     81  CIRCULARHARMONIC    1.05   2.36 
Dihedral  C     81  N     82   CA    82   C     82  CIRCULARHARMONIC   -0.70   2.27 
Dihedral  C     82  N     83   CA    83   C     83  CIRCULARHARMONIC   -0.70   2.36 
Dihedral  C     83  N     84   CA    84   C     84  CIRCULARHARMONIC   -0.70   2.44 
Dihedral  C     84  N     85   CA    85   C     85  CIRCULARHARMONIC   -0.65   2.49 
Dihedral  C      1  N      2   CA     2   C      2  CIRCULARHARMONIC   -2.16   1.05 
Dihedral  N      2  CA     2   C      2   N      3  CIRCULARHARMONIC   -2.95   2.54 
Dihedral  C      4  N      5   CA     5   C      5  CIRCULARHARMONIC   -2.58   2.01 
Dihedral  N      5  CA     5   C      5   N      6  CIRCULARHARMONIC    3.12   1.96 
Dihedral  C      5  N      6   CA     6   C      6  CIRCULARHARMONIC   -1.93   1.57 
Dihedral  N      6  CA     6   C      6   N      7  CIRCULARHARMONIC   -3.04   1.97 
Dihedral  C     13  N     14   CA    14   C     14  CIRCULARHARMONIC   -2.09   1.05 
Dihedral  N     14  CA    14   C     14   N     15  CIRCULARHARMONIC   -3.09   1.76 
Dihedral  C     14  N     15   CA    15   C     15  CIRCULARHARMONIC   -2.11   0.97 
Dihedral  N     15  CA    15   C     15   N     16  CIRCULARHARMONIC   -2.94   1.72 
Dihedral  C     15  N     16   CA    16   C     16  CIRCULARHARMONIC   -1.97   1.70 
Dihedral  N     16  CA    16   C     16   N     17  CIRCULARHARMONIC   -3.04   1.72 
Dihedral  C     16  N     17   CA    17   C     17  CIRCULARHARMONIC   -1.94   1.73 
Dihedral  N     17  CA    17   C     17   N     18  CIRCULARHARMONIC   -2.98   1.60 
Dihedral  C     17  N     18   CA    18   C     18  CIRCULARHARMONIC   -1.70   1.64 
Dihedral  N     18  CA    18   C     18   N     19  CIRCULARHARMONIC   -2.88   1.99 
Dihedral  C     21  N     22   CA    22   C     22  CIRCULARHARMONIC   -1.74   1.07 
Dihedral  N     22  CA    22   C     22   N     23  CIRCULARHARMONIC   -2.85   2.22 
Dihedral  N     29  CA    29   C     29   N     30  CIRCULARHARMONIC    3.09   1.86 
Dihedral  C     29  N     30   CA    30   C     30  CIRCULARHARMONIC   -1.86   0.89 
Dihedral  N     30  CA    30   C     30   N     31  CIRCULARHARMONIC   -3.03   1.98 
Dihedral  C     37  N     38   CA    38   C     38  CIRCULARHARMONIC   -1.57   1.18 
Dihedral  N     38  CA    38   C     38   N     39  CIRCULARHARMONIC   -2.75   3.00 
Dihedral  C     40  N     41   CA    41   C     41  CIRCULARHARMONIC   -1.40   1.19 
Dihedral  N     41  CA    41   C     41   N     42  CIRCULARHARMONIC   -0.91   1.02 
Dihedral  C     42  N     43   CA    43   C     43  CIRCULARHARMONIC   -1.16   0.41 
Dihedral  N     43  CA    43   C     43   N     44  CIRCULARHARMONIC   -0.94   0.35 
Dihedral  C     43  N     44   CA    44   C     44  CIRCULARHARMONIC   -1.08   0.42 
Dihedral  N     44  CA    44   C     44   N     45  CIRCULARHARMONIC   -0.92   0.28 
Dihedral  C     44  N     45   CA    45   C     45  CIRCULARHARMONIC   -1.15   0.46 
Dihedral  N     45  CA    45   C     45   N     46  CIRCULARHARMONIC   -0.94   0.36 
Dihedral  C     45  N     46   CA    46   C     46  CIRCULARHARMONIC   -1.12   0.52 
Dihedral  N     46  CA    46   C     46   N     47  CIRCULARHARMONIC   -0.89   0.23 
Dihedral  C     47  N     48   CA    48   C     48  CIRCULARHARMONIC   -1.40   1.36 
Dihedral  N     48  CA    48   C     48   N     49  CIRCULARHARMONIC   -2.77   2.40 
Dihedral  C     50  N     51   CA    51   C     51  CIRCULARHARMONIC   -1.42   1.21 
Dihedral  N     51  CA    51   C     51   N     52  CIRCULARHARMONIC   -2.72   2.23 
Dihedral  C     53  N     54   CA    54   C     54  CIRCULARHARMONIC   -2.30   0.80 
Dihedral  N     54  CA    54   C     54   N     55  CIRCULARHARMONIC    3.09   2.43 
Dihedral  C     54  N     55   CA    55   C     55  CIRCULARHARMONIC   -2.03   1.19 
Dihedral  N     55  CA    55   C     55   N     56  CIRCULARHARMONIC   -3.03   1.63 
Dihedral  C     55  N     56   CA    56   C     56  CIRCULARHARMONIC   -2.05   1.63 
Dihedral  N     56  CA    56   C     56   N     57  CIRCULARHARMONIC   -3.00   2.00 
Dihedral  C     56  N     57   CA    57   C     57  CIRCULARHARMONIC   -2.04   1.66 
Dihedral  N     57  CA    57   C     57   N     58  CIRCULARHARMONIC   -2.92   2.34 
Dihedral  C     59  N     60   CA    60   C     60  CIRCULARHARMONIC   -2.34   1.09 
Dihedral  N     60  CA    60   C     60   N     61  CIRCULARHARMONIC   -2.96   1.70 
Dihedral  C     60  N     61   CA    61   C     61  CIRCULARHARMONIC   -2.11   1.43 
Dihedral  N     61  CA    61   C     61   N     62  CIRCULARHARMONIC   -2.98   2.14 
Dihedral  C     62  N     63   CA    63   C     63  CIRCULARHARMONIC   -2.13   1.08 
Dihedral  N     63  CA    63   C     63   N     64  CIRCULARHARMONIC   -3.12   1.66 
Dihedral  C     63  N     64   CA    64   C     64  CIRCULARHARMONIC   -1.86   1.67 
Dihedral  N     64  CA    64   C     64   N     65  CIRCULARHARMONIC   -2.87   2.03 
Dihedral  C     65  N     66   CA    66   C     66  CIRCULARHARMONIC   -1.35   1.56 
Dihedral  N     66  CA    66   C     66   N     67  CIRCULARHARMONIC   -2.52   2.35 
Dihedral  C     66  N     67   CA    67   C     67  CIRCULARHARMONIC   -1.05   0.68 
Dihedral  N     67  CA    67   C     67   N     68  CIRCULARHARMONIC   -0.80   0.40 
Dihedral  C     67  N     68   CA    68   C     68  CIRCULARHARMONIC   -1.63   1.17 
Dihedral  N     68  CA    68   C     68   N     69  CIRCULARHARMONIC   -0.76   0.16 
Dihedral  C     69  N     70   CA    70   C     70  CIRCULARHARMONIC   -1.80   1.30 
Dihedral  N     70  CA    70   C     70   N     71  CIRCULARHARMONIC   -2.94   2.54 
Dihedral  C     71  N     72   CA    72   C     72  CIRCULARHARMONIC   -1.17   0.57 
Dihedral  N     72  CA    72   C     72   N     73  CIRCULARHARMONIC   -0.91   0.51 
Dihedral  C     72  N     73   CA    73   C     73  CIRCULARHARMONIC   -1.17   0.77 
Dihedral  N     73  CA    73   C     73   N     74  CIRCULARHARMONIC   -0.93   0.12 
Dihedral  C     73  N     74   CA    74   C     74  CIRCULARHARMONIC   -1.18   0.37 
Dihedral  N     74  CA    74   C     74   N     75  CIRCULARHARMONIC   -0.95   0.26 
Dihedral  C     74  N     75   CA    75   C     75  CIRCULARHARMONIC   -1.17   0.31 
Dihedral  N     75  CA    75   C     75   N     76  CIRCULARHARMONIC   -0.85   0.26 
Dihedral  N     76  CA    76   C     76   N     77  CIRCULARHARMONIC   -0.84   0.29 
Dihedral  C     76  N     77   CA    77   C     77  CIRCULARHARMONIC   -1.19   0.31 
Dihedral  N     77  CA    77   C     77   N     78  CIRCULARHARMONIC   -0.97   0.24 
Dihedral  C     77  N     78   CA    78   C     78  CIRCULARHARMONIC   -1.18   0.68 
Dihedral  N     78  CA    78   C     78   N     79  CIRCULARHARMONIC   -0.96   0.37 
Dihedral  C     78  N     79   CA    79   C     79  CIRCULARHARMONIC   -1.08   0.45 
Dihedral  N     79  CA    79   C     79   N     80  CIRCULARHARMONIC   -0.85   0.53 
Dihedral  C     79  N     80   CA    80   C     80  CIRCULARHARMONIC   -1.15   0.40 
Dihedral  N     80  CA    80   C     80   N     81  CIRCULARHARMONIC   -0.94   0.33 
Dihedral  C     80  N     81   CA    81   C     81  CIRCULARHARMONIC   -1.25   0.53 
Dihedral  N     81  CA    81   C     81   N     82  CIRCULARHARMONIC   -0.92   0.39 
Dihedral  C     85  N     86   CA    86   C     86  CIRCULARHARMONIC   -1.33   0.76 

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           1H       MET   1 -11.978   0.989   1.208
    2    H2   MET   1           2H       MET   1 -12.925   1.072   2.369
    3    H3   MET   1           3H       MET   1 -12.441   2.326   1.704
    4    HA   MET   1           HA       MET   1 -11.214   1.119   3.961
    5    HB2  MET   1           1HB      MET   1  -9.675   0.960   1.383
    6    HB3  MET   1           2HB      MET   1  -8.866   1.038   2.967
    7    HG2  MET   1           1HG      MET   1  -9.903  -1.029   3.660
    8    HG3  MET   1           2HG      MET   1 -10.887  -1.077   2.178
    9    HE1  MET   1           3HE      MET   1  -9.321  -0.683  -0.271
   10    HE2  MET   1           1HE      MET   1  -8.528  -2.249  -0.565
   11    HE3  MET   1           2HE      MET   1 -10.203  -2.199   0.039
   12    H    LYS   2           H        LYS   2 -11.183   2.857   5.144
   13    HA   LYS   2           HA       LYS   2 -10.090   5.374   3.943
   14    HB2  LYS   2           1HB      LYS   2 -12.366   5.505   4.818
   15    HB3  LYS   2           2HB      LYS   2 -11.792   4.922   6.398
   16    HG2  LYS   2           1HG      LYS   2 -10.427   6.935   6.670
   17    HG3  LYS   2           2HG      LYS   2 -10.938   7.514   5.066
   18    HD2  LYS   2           1HD      LYS   2 -13.234   7.705   5.801
   19    HD3  LYS   2           2HD      LYS   2 -12.839   6.948   7.364
   20    HE2  LYS   2           1HE      LYS   2 -11.432   8.824   7.972
   21    HE3  LYS   2           2HE      LYS   2 -11.664   9.561   6.369
   22    HZ1  LYS   2           3HZ      LYS   2 -13.783   9.116   8.372
   23    HZ2  LYS   2           1HZ      LYS   2 -13.084  10.569   8.023
   24    HZ3  LYS   2           2HZ      LYS   2 -13.997   9.798   6.887
   25    H    ILE   3           H        ILE   3  -8.325   6.317   4.656
   26    HA   ILE   3           HA       ILE   3  -6.602   4.787   6.485
   27    HB   ILE   3           HB       ILE   3  -6.238   7.465   5.065
   28   HG12  ILE   3          1HG1      ILE   3  -5.001   4.778   4.527
   29   HG13  ILE   3          2HG1      ILE   3  -6.371   5.481   3.635
   30   HG21  ILE   3          1HG2      ILE   3  -3.866   7.274   5.736
   31   HG22  ILE   3          2HG2      ILE   3  -4.927   7.369   7.159
   32   HG23  ILE   3          3HG2      ILE   3  -4.246   5.803   6.663
   33   HD11  ILE   3          3HD1      ILE   3  -3.572   6.652   3.807
   34   HD12  ILE   3          1HD1      ILE   3  -4.256   5.794   2.409
   35   HD13  ILE   3          2HD1      ILE   3  -4.942   7.355   2.917
   36    H    ILE   4           H        ILE   4  -6.313   4.966   8.538
   37    HA   ILE   4           HA       ILE   4  -7.294   7.418   9.936
   38    HB   ILE   4           HB       ILE   4  -6.109   4.803  10.974
   39   HG12  ILE   4          1HG1      ILE   4  -8.894   5.889  11.266
   40   HG13  ILE   4          2HG1      ILE   4  -8.393   4.733  10.011
   41   HG21  ILE   4          1HG2      ILE   4  -6.699   5.665  13.214
   42   HG22  ILE   4          2HG2      ILE   4  -5.508   6.719  12.416
   43   HG23  ILE   4          3HG2      ILE   4  -7.219   7.203  12.485
   44   HD11  ILE   4          3HD1      ILE   4  -8.253   4.272  13.012
   45   HD12  ILE   4          1HD1      ILE   4  -9.462   3.579  11.907
   46   HD13  ILE   4          2HD1      ILE   4  -7.750   3.115  11.756
   47    H    SER   5           H        SER   5  -4.269   5.572   9.562
   48    HA   SER   5           HA       SER   5  -2.734   8.104   9.378
   49    HB2  SER   5           1HB      SER   5  -1.429   7.917  11.232
   50    HB3  SER   5           2HB      SER   5  -3.137   7.988  11.726
   51    HG   SER   5           HG       SER   5  -1.945   6.406  12.875
   52    H    ILE   6           H        ILE   6  -0.609   7.751   8.700
   53    HA   ILE   6           HA       ILE   6   0.111   4.902   8.050
   54    HB   ILE   6           HB       ILE   6   0.859   7.462   6.563
   55   HG12  ILE   6          1HG1      ILE   6  -0.886   5.167   5.707
   56   HG13  ILE   6          2HG1      ILE   6  -1.456   6.764   6.248
   57   HG21  ILE   6          1HG2      ILE   6   1.932   5.926   4.949
   58   HG22  ILE   6          2HG2      ILE   6   2.665   5.773   6.561
   59   HG23  ILE   6          3HG2      ILE   6   1.515   4.543   5.987
   60   HD11  ILE   6          3HD1      ILE   6   0.275   6.227   3.808
   61   HD12  ILE   6          1HD1      ILE   6  -1.464   6.604   3.790
   62   HD13  ILE   6          2HD1      ILE   6  -0.294   7.823   4.350
   63    H    SER   7           H        SER   7   1.694   4.067   9.066
   64    HA   SER   7           HA       SER   7   3.647   5.908  10.476
   65    HB2  SER   7           1HB      SER   7   3.873   4.360  12.132
   66    HB3  SER   7           2HB      SER   7   2.151   4.740  11.912
   67    HG   SER   7           HG       SER   7   3.526   2.425  11.027
   68    H    GLU   8           H        GLU   8   5.763   4.870  10.886
   69    HA   GLU   8           HA       GLU   8   6.759   3.535   8.429
   70    HB2  GLU   8           1HB      GLU   8   8.163   4.640  10.867
   71    HB3  GLU   8           2HB      GLU   8   8.971   3.901   9.464
   72    HG2  GLU   8           1HG      GLU   8   8.042   5.775   8.006
   73    HG3  GLU   8           2HG      GLU   8   7.269   6.358   9.497
   74    H    THR   9           H        THR   9   8.469   1.850   8.731
   75    HA   THR   9           HA       THR   9   7.743  -0.023  10.950
   76    HB   THR   9           HB       THR   9   7.651  -1.900   9.460
   77    HG1  THR   9           HG1      THR   9   7.927  -0.407   7.118
   78   HG21  THR   9          3HG2      THR   9   6.107   0.401   8.201
   79   HG22  THR   9          1HG2      THR   9   5.758  -1.328   7.981
   80   HG23  THR   9          2HG2      THR   9   5.566  -0.578   9.584
   81    HA   PRO  10           HA       PRO  10  11.969  -0.852  11.615
   82    HB2  PRO  10           2HB      PRO  10  12.163  -3.080  12.442
   83    HB3  PRO  10           1HB      PRO  10  11.394  -3.782  11.014
   84    HG2  PRO  10           1HG      PRO  10   9.647  -3.949  12.605
   85    HG3  PRO  10           2HG      PRO  10  10.098  -2.441  13.411
   86    HD2  PRO  10           1HD      PRO  10   8.582  -2.824  10.800
   87    HD3  PRO  10           2HD      PRO  10   8.315  -1.626  12.072
   88    H    ASN  11           H        ASN  11  10.499  -2.362   8.776
   89    HA   ASN  11           HA       ASN  11  13.093  -1.932   7.344
   90    HB2  ASN  11           1HB      ASN  11  11.785  -4.276   7.023
   91    HB3  ASN  11           2HB      ASN  11  10.637  -3.051   6.427
   92   HD21  ASN  11          2HD2      ASN  11  11.871  -5.320   5.063
   93   HD22  ASN  11          1HD2      ASN  11  12.693  -4.662   3.688
   94    H    HIS  12           H        HIS  12  13.380  -0.059   6.433
   95    HA   HIS  12           HA       HIS  12  11.181   1.830   6.333
   96    HB2  HIS  12           1HB      HIS  12  12.836   3.435   5.612
   97    HB3  HIS  12           2HB      HIS  12  13.625   2.397   6.824
   98    HD2  HIS  12           HD2      HIS  12  14.131   3.483   3.077
   99    HE1  HIS  12           HE1      HIS  12  16.901   0.413   4.052
  100    HE2  HIS  12           HE2      HIS  12  16.165   2.244   2.313
  101    H    ASN  13           H        ASN  13  12.194  -0.567   4.197
  102    HA   ASN  13           HA       ASN  13  11.594   0.850   1.711
  103    HB2  ASN  13           1HB      ASN  13  12.014  -2.204   2.133
  104    HB3  ASN  13           2HB      ASN  13  11.519  -1.173   0.769
  105   HD21  ASN  13          2HD2      ASN  13  13.852  -2.870   1.043
  106   HD22  ASN  13          1HD2      ASN  13  15.231  -1.842   0.845
  107    H    THR  14           H        THR  14   9.698  -0.458   4.184
  108    HA   THR  14           HA       THR  14   7.312  -0.267   2.387
  109    HB   THR  14           HB       THR  14   7.744  -2.674   2.776
  110    HG1  THR  14           HG1      THR  14   5.651  -2.939   4.105
  111   HG21  THR  14          3HG2      THR  14   7.478  -1.935   5.717
  112   HG22  THR  14          1HG2      THR  14   7.593  -3.586   5.066
  113   HG23  THR  14          2HG2      THR  14   8.972  -2.471   4.911
  114    H    MET  15           H        MET  15   5.471   0.552   3.244
  115    HA   MET  15           HA       MET  15   5.790   1.796   5.960
  116    HB2  MET  15           1HB      MET  15   4.239   2.700   3.534
  117    HB3  MET  15           2HB      MET  15   4.139   3.451   5.144
  118    HG2  MET  15           1HG      MET  15   6.695   3.231   3.530
  119    HG3  MET  15           2HG      MET  15   5.619   4.647   3.489
  120    HE1  MET  15           3HE      MET  15   4.632   5.036   6.404
  121    HE2  MET  15           1HE      MET  15   5.897   6.086   7.088
  122    HE3  MET  15           2HE      MET  15   5.323   6.354   5.424
  123    H    LYS  16           H        LYS  16   3.975   1.988   7.295
  124    HA   LYS  16           HA       LYS  16   2.022  -0.238   6.843
  125    HB2  LYS  16           1HB      LYS  16   3.458  -0.448   8.813
  126    HB3  LYS  16           2HB      LYS  16   2.898   1.139   9.387
  127    HG2  LYS  16           1HG      LYS  16   0.590   0.239   9.539
  128    HG3  LYS  16           2HG      LYS  16   1.203  -1.355   9.045
  129    HD2  LYS  16           1HD      LYS  16   2.657  -1.417  11.026
  130    HD3  LYS  16           2HD      LYS  16   2.060   0.185  11.518
  131    HE2  LYS  16           1HE      LYS  16  -0.219  -0.722  11.700
  132    HE3  LYS  16           2HE      LYS  16   0.382  -2.325  11.216
  133    HZ1  LYS  16           3HZ      LYS  16   1.190  -0.852  13.643
  134    HZ2  LYS  16           1HZ      LYS  16   0.160  -2.141  13.600
  135    HZ3  LYS  16           2HZ      LYS  16   1.747  -2.338  13.194
  136    H    ILE  17           H        ILE  17   0.063   0.243   6.295
  137    HA   ILE  17           HA       ILE  17  -0.978   2.985   6.952
  138    HB   ILE  17           HB       ILE  17  -1.869   1.019   4.791
  139   HG12  ILE  17          1HG1      ILE  17  -0.418   3.631   4.472
  140   HG13  ILE  17          2HG1      ILE  17   0.361   2.032   4.446
  141   HG21  ILE  17          1HG2      ILE  17  -3.245   2.910   3.994
  142   HG22  ILE  17          2HG2      ILE  17  -3.693   2.448   5.652
  143   HG23  ILE  17          3HG2      ILE  17  -2.694   3.893   5.370
  144   HD11  ILE  17          3HD1      ILE  17  -1.779   3.000   2.517
  145   HD12  ILE  17          1HD1      ILE  17  -0.042   2.861   2.161
  146   HD13  ILE  17          2HD1      ILE  17  -1.002   1.399   2.492
  147    H    THR  18           H        THR  18  -2.144   3.082   8.653
  148    HA   THR  18           HA       THR  18  -3.773   0.752   9.478
  149    HB   THR  18           HB       THR  18  -3.423   3.506  10.738
  150    HG1  THR  18           HG1      THR  18  -2.159   2.266  12.247
  151   HG21  THR  18          3HG2      THR  18  -4.750   0.977  11.794
  152   HG22  THR  18          1HG2      THR  18  -4.501   2.482  12.709
  153   HG23  THR  18          2HG2      THR  18  -5.593   2.466  11.302
  154    H    LEU  19           H        LEU  19  -5.802   0.429   9.049
  155    HA   LEU  19           HA       LEU  19  -7.304   2.685   7.767
  156    HB2  LEU  19           1HB      LEU  19  -7.485  -0.239   7.441
  157    HB3  LEU  19           2HB      LEU  19  -8.529   0.855   6.505
  158    HG   LEU  19           HG       LEU  19  -5.500   0.653   6.299
  159   HD11  LEU  19          1HD1      LEU  19  -5.969  -0.263   4.010
  160   HD12  LEU  19          2HD1      LEU  19  -6.684  -1.288   5.276
  161   HD13  LEU  19          3HD1      LEU  19  -7.714  -0.172   4.349
  162   HD21  LEU  19          3HD2      LEU  19  -6.281   2.916   5.915
  163   HD22  LEU  19          1HD2      LEU  19  -5.739   2.193   4.383
  164   HD23  LEU  19          2HD2      LEU  19  -7.479   2.334   4.734
  165    H    SER  20           H        SER  20  -9.411   3.059   8.265
  166    HA   SER  20           HA       SER  20 -10.565   1.849  10.721
  167    HB2  SER  20           1HB      SER  20 -10.837   4.129  10.358
  168    HB3  SER  20           2HB      SER  20 -11.644   3.824   8.803
  169    HG   SER  20           HG       SER  20 -13.121   4.133  10.525
  170    H    GLU  21           H        GLU  21 -11.703   2.195   7.320
  171    HA   GLU  21           HA       GLU  21 -13.013  -0.468   7.493
  172    HB2  GLU  21           1HB      GLU  21 -14.200   1.366   6.411
  173    HB3  GLU  21           2HB      GLU  21 -12.849   1.575   5.271
  174    HG2  GLU  21           1HG      GLU  21 -13.332  -0.752   4.354
  175    HG3  GLU  21           2HG      GLU  21 -14.619  -0.814   5.579
  176    H    SER  22           H        SER  22 -12.356  -2.275   6.569
  177    HA   SER  22           HA       SER  22  -9.656  -2.232   5.182
  178    HB2  SER  22           1HB      SER  22  -9.723  -3.160   7.430
  179    HB3  SER  22           2HB      SER  22 -10.754  -4.455   6.778
  180    HG   SER  22           HG       SER  22  -8.522  -4.977   6.731
  181    H    ARG  23           H        ARG  23  -9.584  -4.764   4.306
  182    HA   ARG  23           HA       ARG  23 -11.242  -4.799   1.958
  183    HB2  ARG  23           1HB      ARG  23  -9.062  -5.823   2.070
  184    HB3  ARG  23           2HB      ARG  23  -9.712  -7.055   3.177
  185    HG2  ARG  23           1HG      ARG  23 -11.277  -7.791   1.418
  186    HG3  ARG  23           2HG      ARG  23 -10.590  -6.579   0.311
  187    HD2  ARG  23           1HD      ARG  23  -9.678  -8.662  -0.247
  188    HD3  ARG  23           2HD      ARG  23  -8.405  -7.720   0.563
  189    HE   ARG  23           HE       ARG  23  -9.513  -9.477   2.553
  190   HH11  ARG  23          1HH1      ARG  23  -7.840  -9.813  -0.487
  191   HH12  ARG  23          2HH1      ARG  23  -7.131 -11.318   0.063
  192   HH21  ARG  23          2HH2      ARG  23  -7.629 -12.113   2.161
  193   HH22  ARG  23          1HH2      ARG  23  -8.714 -11.203   3.195
  194    H    GLU  24           H        GLU  24 -12.869  -6.215   1.318
  195    HA   GLU  24           HA       GLU  24 -15.076  -6.579   2.943
  196    HB2  GLU  24           1HB      GLU  24 -14.978  -7.031   0.522
  197    HB3  GLU  24           2HB      GLU  24 -14.078  -8.530   0.861
  198    HG2  GLU  24           1HG      GLU  24 -16.102  -9.434   2.086
  199    HG3  GLU  24           2HG      GLU  24 -16.842  -7.848   1.775
  200    H    GLY  25           H        GLY  25 -12.482  -9.012   2.512
  201    HA2  GLY  25           1HA      GLY  25 -13.213  -9.997   5.241
  202    HA3  GLY  25           2HA      GLY  25 -12.344 -10.952   4.016
  203    H    MET  26           H        MET  26 -11.843  -9.699   6.880
  204    HA   MET  26           HA       MET  26  -9.443  -8.049   6.334
  205    HB2  MET  26           1HB      MET  26 -10.887  -8.885   8.843
  206    HB3  MET  26           2HB      MET  26  -9.374  -7.949   8.838
  207    HG2  MET  26           1HG      MET  26 -10.513  -6.175   7.536
  208    HG3  MET  26           2HG      MET  26 -12.028  -7.102   7.637
  209    HE1  MET  26           3HE      MET  26 -13.111  -4.787   8.600
  210    HE2  MET  26           1HE      MET  26 -12.508  -3.969  10.062
  211    HE3  MET  26           2HE      MET  26 -11.515  -3.998   8.583
  212    H    THR  27           H        THR  27  -9.791 -11.131   5.947
  213    HA   THR  27           HA       THR  27  -7.635 -12.234   7.550
  214    HB   THR  27           HB       THR  27  -7.647 -14.082   5.938
  215    HG1  THR  27           HG1      THR  27  -9.074 -13.918   4.108
  216   HG21  THR  27          3HG2      THR  27 -10.461 -13.094   6.553
  217   HG22  THR  27          1HG2      THR  27 -10.012 -14.768   6.144
  218   HG23  THR  27          2HG2      THR  27  -9.425 -14.032   7.654
  219    H    SER  28           H        SER  28  -5.626 -13.085   6.616
  220    HA   SER  28           HA       SER  28  -4.054 -10.850   5.533
  221    HB2  SER  28           1HB      SER  28  -2.216 -12.166   5.810
  222    HB3  SER  28           2HB      SER  28  -3.262 -12.309   7.242
  223    HG   SER  28           HG       SER  28  -2.429 -14.325   6.544
  224    H    ASP  29           H        ASP  29  -2.956 -10.782   3.581
  225    HA   ASP  29           HA       ASP  29  -3.042 -12.920   1.631
  226    HB2  ASP  29           1HB      ASP  29  -5.457 -11.624   1.583
  227    HB3  ASP  29           2HB      ASP  29  -4.369 -10.493   0.741
  228    H    THR  30           H        THR  30  -1.975 -12.405  -0.353
  229    HA   THR  30           HA       THR  30  -0.291  -9.930  -0.166
  230    HB   THR  30           HB       THR  30   0.640 -12.700  -1.034
  231    HG1  THR  30           HG1      THR  30   1.965 -12.483   0.865
  232   HG21  THR  30          3HG2      THR  30   2.132 -10.060  -0.768
  233   HG22  THR  30          1HG2      THR  30   2.859 -11.627  -1.187
  234   HG23  THR  30          2HG2      THR  30   1.700 -10.860  -2.298
  235    H    TYR  31           H        TYR  31  -0.267  -8.691  -1.864
  236    HA   TYR  31           HA       TYR  31  -1.014  -9.901  -4.507
  237    HB2  TYR  31           1HB      TYR  31  -1.759  -7.174  -3.427
  238    HB3  TYR  31           2HB      TYR  31  -2.074  -7.767  -5.076
  239    HD1  TYR  31           HD1      TYR  31  -3.451  -7.391  -1.839
  240    HD2  TYR  31           HD2      TYR  31  -3.443 -10.027  -5.190
  241    HE1  TYR  31           HE1      TYR  31  -5.600  -8.355  -1.075
  242    HE2  TYR  31           HE2      TYR  31  -5.588 -11.002  -4.442
  243    HH   TYR  31           HH       TYR  31  -7.240 -10.964  -2.873
  244    H    THR  32           H        THR  32   0.341  -9.626  -6.091
  245    HA   THR  32           HA       THR  32   2.412  -7.471  -5.811
  246    HB   THR  32           HB       THR  32   4.010  -8.955  -6.947
  247    HG1  THR  32           HG1      THR  32   3.389 -11.176  -7.250
  248   HG21  THR  32          3HG2      THR  32   2.705 -10.292  -4.544
  249   HG22  THR  32          1HG2      THR  32   4.356 -10.596  -5.134
  250   HG23  THR  32          2HG2      THR  32   3.925  -8.999  -4.478
  251    H    LYS  33           H        LYS  33   0.077  -9.084  -7.793
  252    HA   LYS  33           HA       LYS  33   0.935  -7.390 -10.121
  253    HB2  LYS  33           1HB      LYS  33  -0.392 -10.104 -10.071
  254    HB3  LYS  33           2HB      LYS  33  -0.155  -9.108 -11.528
  255    HG2  LYS  33           1HG      LYS  33   2.292  -9.232 -11.197
  256    HG3  LYS  33           2HG      LYS  33   2.035 -10.267  -9.770
  257    HD2  LYS  33           1HD      LYS  33   0.937 -11.953 -11.181
  258    HD3  LYS  33           2HD      LYS  33   1.174 -10.918 -12.610
  259    HE2  LYS  33           1HE      LYS  33   3.613 -11.044 -12.288
  260    HE3  LYS  33           2HE      LYS  33   3.367 -12.100 -10.878
  261    HZ1  LYS  33           3HZ      LYS  33   2.573 -12.728 -13.649
  262    HZ2  LYS  33           1HZ      LYS  33   3.873 -13.363 -12.857
  263    HZ3  LYS  33           2HZ      LYS  33   2.345 -13.707 -12.341
  264    H    VAL  34           H        VAL  34  -0.604  -6.413 -11.382
  265    HA   VAL  34           HA       VAL  34  -3.095  -5.681  -9.989
  266    HB   VAL  34           HB       VAL  34  -2.062  -5.029 -12.780
  267   HG11  VAL  34          1HG1      VAL  34  -3.823  -3.293 -12.777
  268   HG12  VAL  34          2HG1      VAL  34  -4.527  -4.921 -12.639
  269   HG13  VAL  34          3HG1      VAL  34  -4.401  -3.882 -11.201
  270   HG21  VAL  34          3HG2      VAL  34  -0.659  -4.101 -11.037
  271   HG22  VAL  34          1HG2      VAL  34  -1.586  -2.820 -11.852
  272   HG23  VAL  34          2HG2      VAL  34  -2.084  -3.391 -10.241
  273    H    ASP  35           H        ASP  35  -4.998  -6.488 -10.103
  274    HA   ASP  35           HA       ASP  35  -6.000  -7.808 -12.491
  275    HB2  ASP  35           1HB      ASP  35  -4.468  -9.580 -11.063
  276    HB3  ASP  35           2HB      ASP  35  -5.980  -9.491 -10.125
  277    H    ASP  36           H        ASP  36  -8.157  -8.914 -11.991
  278    HA   ASP  36           HA       ASP  36  -9.758  -6.747 -10.881
  279    HB2  ASP  36           1HB      ASP  36 -10.568  -9.478 -12.047
  280    HB3  ASP  36           2HB      ASP  36 -11.594  -8.198 -11.353
  281    H    SER  37           H        SER  37  -8.386  -9.601  -9.589
  282    HA   SER  37           HA       SER  37 -10.450 -10.226  -7.595
  283    HB2  SER  37           1HB      SER  37  -8.996 -11.764  -6.749
  284    HB3  SER  37           2HB      SER  37  -8.991 -11.860  -8.523
  285    HG   SER  37           HG       SER  37  -7.079 -10.218  -7.952
  286    H    GLN  38           H        GLN  38  -7.870  -7.910  -7.878
  287    HA   GLN  38           HA       GLN  38  -7.717  -7.486  -4.948
  288    HB2  GLN  38           1HB      GLN  38  -6.417  -6.093  -7.299
  289    HB3  GLN  38           2HB      GLN  38  -6.151  -5.672  -5.591
  290    HG2  GLN  38           1HG      GLN  38  -4.231  -7.277  -5.907
  291    HG3  GLN  38           2HG      GLN  38  -5.728  -8.096  -5.402
  292   HE21  GLN  38          2HE2      GLN  38  -3.195  -8.680  -7.174
  293   HE22  GLN  38          1HE2      GLN  38  -3.880  -9.475  -8.553
  294    HA   PRO  39           HA       PRO  39 -10.595  -4.071  -4.646
  295    HB2  PRO  39           2HB      PRO  39 -10.011  -3.053  -2.581
  296    HB3  PRO  39           1HB      PRO  39  -8.319  -2.843  -3.057
  297    HG2  PRO  39           1HG      PRO  39  -8.135  -4.630  -1.517
  298    HG3  PRO  39           2HG      PRO  39  -9.702  -5.317  -1.969
  299    HD2  PRO  39           1HD      PRO  39  -7.050  -5.487  -3.464
  300    HD3  PRO  39           2HD      PRO  39  -8.262  -6.749  -3.213
  301    H    ALA  40           H        ALA  40 -10.933  -2.274  -5.720
  302    HA   ALA  40           HA       ALA  40  -9.344  -1.435  -7.847
  303    HB1  ALA  40           3HB      ALA  40 -11.142   0.281  -6.102
  304    HB2  ALA  40           1HB      ALA  40 -10.564   0.703  -7.730
  305    HB3  ALA  40           2HB      ALA  40 -11.655  -0.684  -7.506
  306    H    PHE  41           H        PHE  41  -9.285  -0.190  -4.506
  307    HA   PHE  41           HA       PHE  41  -7.269   1.774  -4.860
  308    HB2  PHE  41           1HB      PHE  41  -7.960   0.012  -2.475
  309    HB3  PHE  41           2HB      PHE  41  -6.778   1.338  -2.409
  310    HD1  PHE  41           HD1      PHE  41  -8.840   2.715  -4.613
  311    HD2  PHE  41           HD2      PHE  41  -8.941   1.364  -0.561
  312    HE1  PHE  41           HE1      PHE  41 -10.660   4.317  -4.125
  313    HE2  PHE  41           HE2      PHE  41 -10.763   2.962  -0.071
  314    HZ   PHE  41           HZ       PHE  41 -11.621   4.440  -1.853
  315    H    ILE  42           H        ILE  42  -6.935  -1.700  -4.152
  316    HA   ILE  42           HA       ILE  42  -4.058  -1.582  -3.828
  317    HB   ILE  42           HB       ILE  42  -5.925  -3.901  -4.511
  318   HG12  ILE  42          1HG1      ILE  42  -6.408  -2.956  -2.384
  319   HG13  ILE  42          2HG1      ILE  42  -5.626  -4.543  -2.200
  320   HG21  ILE  42          1HG2      ILE  42  -4.033  -5.352  -3.861
  321   HG22  ILE  42          2HG2      ILE  42  -3.613  -4.345  -5.266
  322   HG23  ILE  42          3HG2      ILE  42  -3.003  -3.917  -3.651
  323   HD11  ILE  42          3HD1      ILE  42  -4.275  -1.843  -1.848
  324   HD12  ILE  42          1HD1      ILE  42  -4.778  -2.936  -0.536
  325   HD13  ILE  42          2HD1      ILE  42  -3.493  -3.431  -1.665
  326    H    ASN  43           H        ASN  43  -6.138  -2.144  -6.616
  327    HA   ASN  43           HA       ASN  43  -3.996  -2.843  -8.417
  328    HB2  ASN  43           1HB      ASN  43  -6.803  -1.700  -9.130
  329    HB3  ASN  43           2HB      ASN  43  -5.335  -2.087 -10.060
  330   HD21  ASN  43          2HD2      ASN  43  -8.155  -3.220  -9.835
  331   HD22  ASN  43          1HD2      ASN  43  -7.901  -4.926  -9.673
  332    H    ASP  44           H        ASP  44  -5.616   0.268  -7.747
  333    HA   ASP  44           HA       ASP  44  -4.032   1.857  -9.494
  334    HB2  ASP  44           1HB      ASP  44  -5.373   2.608  -6.826
  335    HB3  ASP  44           2HB      ASP  44  -4.468   3.638  -7.963
  336    H    ILE  45           H        ILE  45  -3.475   0.974  -6.087
  337    HA   ILE  45           HA       ILE  45  -1.053   2.509  -5.800
  338    HB   ILE  45           HB       ILE  45  -2.053   0.005  -4.371
  339   HG12  ILE  45          1HG1      ILE  45  -1.913   2.840  -3.392
  340   HG13  ILE  45          2HG1      ILE  45  -3.343   2.131  -4.177
  341   HG21  ILE  45          1HG2      ILE  45  -0.324   0.500  -2.675
  342   HG22  ILE  45          2HG2      ILE  45   0.413   0.147  -4.256
  343   HG23  ILE  45          3HG2      ILE  45   0.289   1.829  -3.686
  344   HD11  ILE  45          3HD1      ILE  45  -2.045   1.141  -1.614
  345   HD12  ILE  45          1HD1      ILE  45  -3.554   2.074  -1.724
  346   HD13  ILE  45          2HD1      ILE  45  -3.475   0.429  -2.399
  347    H    LEU  46           H        LEU  46  -1.567  -0.878  -6.738
  348    HA   LEU  46           HA       LEU  46   1.178  -1.529  -7.116
  349    HB2  LEU  46           1HB      LEU  46  -1.337  -2.312  -8.416
  350    HB3  LEU  46           2HB      LEU  46   0.148  -3.160  -8.906
  351    HG   LEU  46           HG       LEU  46  -1.006  -3.101  -6.091
  352   HD11  LEU  46          1HD1      LEU  46  -1.546  -5.515  -6.510
  353   HD12  LEU  46          2HD1      LEU  46  -2.400  -4.454  -7.654
  354   HD13  LEU  46          3HD1      LEU  46  -0.949  -5.344  -8.177
  355   HD21  LEU  46          3HD2      LEU  46   1.412  -3.294  -6.111
  356   HD22  LEU  46          1HD2      LEU  46   0.683  -4.840  -5.612
  357   HD23  LEU  46          2HD2      LEU  46   1.323  -4.649  -7.263
  358    H    LYS  47           H        LYS  47  -1.087   0.208  -9.189
  359    HA   LYS  47           HA       LYS  47   0.692   0.178 -11.499
  360    HB2  LYS  47           1HB      LYS  47  -1.770   1.763 -10.772
  361    HB3  LYS  47           2HB      LYS  47  -0.875   1.987 -12.294
  362    HG2  LYS  47           1HG      LYS  47  -1.308  -0.362 -12.893
  363    HG3  LYS  47           2HG      LYS  47  -2.207  -0.582 -11.373
  364    HD2  LYS  47           1HD      LYS  47  -3.821   1.140 -12.081
  365    HD3  LYS  47           2HD      LYS  47  -2.924   1.349 -13.604
  366    HE2  LYS  47           1HE      LYS  47  -3.356  -1.011 -14.171
  367    HE3  LYS  47           2HE      LYS  47  -4.280  -1.196 -12.664
  368    HZ1  LYS  47           3HZ      LYS  47  -4.962   0.628 -14.879
  369    HZ2  LYS  47           1HZ      LYS  47  -5.719  -0.798 -14.545
  370    HZ3  LYS  47           2HZ      LYS  47  -5.820   0.458 -13.480
  371    H    VAL  48           H        VAL  48   0.353   2.158  -8.669
  372    HA   VAL  48           HA       VAL  48   1.727   4.516  -9.591
  373    HB   VAL  48           HB       VAL  48   1.654   3.199  -6.845
  374   HG11  VAL  48          1HG1      VAL  48   2.427   5.393  -6.008
  375   HG12  VAL  48          2HG1      VAL  48   3.627   4.666  -7.104
  376   HG13  VAL  48          3HG1      VAL  48   2.574   5.980  -7.681
  377   HG21  VAL  48          3HG2      VAL  48  -0.535   3.882  -7.630
  378   HG22  VAL  48          1HG2      VAL  48   0.022   4.940  -6.312
  379   HG23  VAL  48          2HG2      VAL  48   0.083   5.510  -7.997
  380    H    GLU  49           H        GLU  49   3.637   4.895 -10.267
  381    HA   GLU  49           HA       GLU  49   5.577   2.839 -10.617
  382    HB2  GLU  49           1HB      GLU  49   5.438   4.933 -11.921
  383    HB3  GLU  49           2HB      GLU  49   6.001   5.830 -10.488
  384    HG2  GLU  49           1HG      GLU  49   8.191   4.540 -10.597
  385    HG3  GLU  49           2HG      GLU  49   7.465   3.693 -11.980
  386    H    GLY  50           H        GLY  50   6.892   1.856  -9.320
  387    HA2  GLY  50           1HA      GLY  50   8.851   2.191  -7.842
  388    HA3  GLY  50           2HA      GLY  50   7.872   3.358  -6.921
  389    H    VAL  51           H        VAL  51   5.442   1.702  -7.114
  390    HA   VAL  51           HA       VAL  51   5.839   0.193  -4.649
  391    HB   VAL  51           HB       VAL  51   3.500   0.264  -6.603
  392   HG11  VAL  51          1HG1      VAL  51   2.208  -0.701  -4.730
  393   HG12  VAL  51          2HG1      VAL  51   3.524  -1.790  -5.229
  394   HG13  VAL  51          3HG1      VAL  51   3.693  -0.803  -3.756
  395   HG21  VAL  51          3HG2      VAL  51   3.948   2.436  -5.630
  396   HG22  VAL  51          1HG2      VAL  51   2.454   1.741  -4.962
  397   HG23  VAL  51          2HG2      VAL  51   3.949   1.727  -3.997
  398    H    LYS  52           H        LYS  52   6.437  -1.750  -4.276
  399    HA   LYS  52           HA       LYS  52   6.972  -3.476  -6.650
  400    HB2  LYS  52           1HB      LYS  52   8.833  -2.928  -5.148
  401    HB3  LYS  52           2HB      LYS  52   7.937  -3.651  -3.790
  402    HG2  LYS  52           1HG      LYS  52   8.015  -5.843  -4.895
  403    HG3  LYS  52           2HG      LYS  52   8.894  -5.125  -6.268
  404    HD2  LYS  52           1HD      LYS  52  10.733  -4.491  -4.742
  405    HD3  LYS  52           2HD      LYS  52   9.859  -5.249  -3.390
  406    HE2  LYS  52           1HE      LYS  52   9.972  -7.420  -4.501
  407    HE3  LYS  52           2HE      LYS  52  10.783  -6.680  -5.900
  408    HZ1  LYS  52           3HZ      LYS  52  11.866  -6.798  -3.159
  409    HZ2  LYS  52           1HZ      LYS  52  12.352  -7.739  -4.423
  410    HZ3  LYS  52           2HZ      LYS  52  12.616  -6.111  -4.457
  411    H    SER  53           H        SER  53   5.725  -3.819  -3.312
  412    HA   SER  53           HA       SER  53   3.830  -5.959  -4.262
  413    HB2  SER  53           1HB      SER  53   4.514  -7.541  -2.759
  414    HB3  SER  53           2HB      SER  53   5.866  -7.095  -3.825
  415    HG   SER  53           HG       SER  53   6.491  -7.280  -1.629
  416    H    ILE  54           H        ILE  54   2.143  -6.342  -2.812
  417    HA   ILE  54           HA       ILE  54   1.958  -4.497  -0.447
  418    HB   ILE  54           HB       ILE  54  -0.263  -5.189  -2.427
  419   HG12  ILE  54          1HG1      ILE  54   1.013  -2.528  -1.856
  420   HG13  ILE  54          2HG1      ILE  54   1.410  -3.572  -3.241
  421   HG21  ILE  54          1HG2      ILE  54  -1.626  -3.641  -1.066
  422   HG22  ILE  54          2HG2      ILE  54  -1.055  -5.016  -0.092
  423   HG23  ILE  54          3HG2      ILE  54  -0.265  -3.429   0.058
  424   HD11  ILE  54          3HD1      ILE  54  -1.311  -2.353  -2.654
  425   HD12  ILE  54          1HD1      ILE  54  -0.163  -1.791  -3.891
  426   HD13  ILE  54          2HD1      ILE  54  -0.915  -3.397  -4.038
  427    H    PHE  55           H        PHE  55   1.513  -5.346   1.389
  428    HA   PHE  55           HA       PHE  55   0.213  -8.055   1.393
  429    HB2  PHE  55           1HB      PHE  55   2.480  -8.174   2.322
  430    HB3  PHE  55           2HB      PHE  55   2.129  -6.820   3.419
  431    HD1  PHE  55           HD1      PHE  55   0.949 -10.248   2.552
  432    HD2  PHE  55           HD2      PHE  55   1.416  -7.237   5.546
  433    HE1  PHE  55           HE1      PHE  55   0.178 -11.846   4.275
  434    HE2  PHE  55           HE2      PHE  55   0.649  -8.833   7.273
  435    HZ   PHE  55           HZ       PHE  55   0.028 -11.137   6.636
  436    H    HIS  56           H        HIS  56  -1.685  -8.279   2.272
  437    HA   HIS  56           HA       HIS  56  -2.697  -6.040   3.994
  438    HB2  HIS  56           1HB      HIS  56  -3.963  -6.194   1.890
  439    HB3  HIS  56           2HB      HIS  56  -4.244  -7.930   2.164
  440    HD2  HIS  56           HD2      HIS  56  -5.806  -4.455   3.230
  441    HE1  HIS  56           HE1      HIS  56  -7.872  -7.629   5.156
  442    HE2  HIS  56           HE2      HIS  56  -7.806  -5.060   4.606
  443    H    VAL  57           H        VAL  57  -3.526  -6.428   5.931
  444    HA   VAL  57           HA       VAL  57  -4.503  -9.089   6.699
  445    HB   VAL  57           HB       VAL  57  -2.058  -9.400   7.061
  446   HG11  VAL  57          1HG1      VAL  57  -0.928  -8.053   8.800
  447   HG12  VAL  57          2HG1      VAL  57  -1.457  -7.032   7.441
  448   HG13  VAL  57          3HG1      VAL  57  -2.383  -7.042   8.962
  449   HG21  VAL  57          3HG2      VAL  57  -3.648 -10.543   8.488
  450   HG22  VAL  57          1HG2      VAL  57  -2.194 -10.083   9.403
  451   HG23  VAL  57          2HG2      VAL  57  -3.695  -9.144   9.587
  452    H    MET  58           H        MET  58  -5.947  -9.054   8.236
  453    HA   MET  58           HA       MET  58  -7.471  -8.128   9.734
  454    HB2  MET  58           1HB      MET  58  -5.371  -8.174  11.072
  455    HB3  MET  58           2HB      MET  58  -5.086  -6.487  10.582
  456    HG2  MET  58           1HG      MET  58  -7.207  -5.834  11.665
  457    HG3  MET  58           2HG      MET  58  -7.443  -7.516  12.192
  458    HE1  MET  58           3HE      MET  58  -4.700  -8.549  13.133
  459    HE2  MET  58           1HE      MET  58  -4.667  -8.048  14.841
  460    HE3  MET  58           2HE      MET  58  -6.176  -8.668  14.124
  461    H    ASP  59           H        ASP  59  -5.930  -5.119  10.159
  462    HA   ASP  59           HA       ASP  59  -7.787  -3.807   8.222
  463    HB2  ASP  59           1HB      ASP  59  -8.666  -2.296   9.973
  464    HB3  ASP  59           2HB      ASP  59  -8.846  -4.034  10.322
  465    H    PHE  60           H        PHE  60  -4.898  -4.257   8.242
  466    HA   PHE  60           HA       PHE  60  -4.264  -1.450   7.566
  467    HB2  PHE  60           1HB      PHE  60  -2.138  -1.448   8.791
  468    HB3  PHE  60           2HB      PHE  60  -3.480  -1.689   9.932
  469    HD1  PHE  60           HD1      PHE  60  -0.508  -3.129   8.416
  470    HD2  PHE  60           HD2      PHE  60  -3.856  -3.856  10.969
  471    HE1  PHE  60           HE1      PHE  60   0.603  -5.155   9.294
  472    HE2  PHE  60           HE2      PHE  60  -2.746  -5.881  11.852
  473    HZ   PHE  60           HZ       PHE  60  -0.516  -6.532  11.010
  474    H    ILE  61           H        ILE  61  -2.385  -1.213   6.250
  475    HA   ILE  61           HA       ILE  61  -1.769  -3.730   4.724
  476    HB   ILE  61           HB       ILE  61  -2.390  -0.951   3.622
  477   HG12  ILE  61          1HG1      ILE  61  -3.816  -3.567   3.213
  478   HG13  ILE  61          2HG1      ILE  61  -4.330  -2.273   4.321
  479   HG21  ILE  61          1HG2      ILE  61  -2.022  -1.986   1.407
  480   HG22  ILE  61          2HG2      ILE  61  -0.546  -2.052   2.398
  481   HG23  ILE  61          3HG2      ILE  61  -1.548  -3.508   2.197
  482   HD11  ILE  61          3HD1      ILE  61  -4.067  -2.030   1.303
  483   HD12  ILE  61          1HD1      ILE  61  -5.591  -2.186   2.207
  484   HD13  ILE  61          2HD1      ILE  61  -4.580  -0.736   2.411
  485    H    SER  62           H        SER  62   0.217  -4.181   4.297
  486    HA   SER  62           HA       SER  62   2.357  -2.163   4.956
  487    HB2  SER  62           1HB      SER  62   2.520  -4.195   6.078
  488    HB3  SER  62           2HB      SER  62   2.497  -5.088   4.540
  489    HG   SER  62           HG       SER  62   4.618  -4.654   5.422
  490    H    VAL  63           H        VAL  63   2.894  -0.916   3.252
  491    HA   VAL  63           HA       VAL  63   2.853  -2.132   0.495
  492    HB   VAL  63           HB       VAL  63   2.796   0.789   1.364
  493   HG11  VAL  63          1HG1      VAL  63   2.392   1.229  -1.034
  494   HG12  VAL  63          2HG1      VAL  63   3.958   0.422  -0.786
  495   HG13  VAL  63          3HG1      VAL  63   2.562  -0.506  -1.383
  496   HG21  VAL  63          3HG2      VAL  63   0.703  -0.318   1.870
  497   HG22  VAL  63          1HG2      VAL  63   0.511   0.801   0.501
  498   HG23  VAL  63          2HG2      VAL  63   0.614  -0.951   0.210
  499    H    ASP  64           H        ASP  64   4.644  -2.778  -0.294
  500    HA   ASP  64           HA       ASP  64   7.162  -1.465   0.674
  501    HB2  ASP  64           1HB      ASP  64   6.862  -3.979   1.226
  502    HB3  ASP  64           2HB      ASP  64   6.734  -4.117  -0.544
  503    H    LYS  65           H        LYS  65   8.537  -0.569  -0.672
  504    HA   LYS  65           HA       LYS  65   7.875  -0.748  -3.596
  505    HB2  LYS  65           1HB      LYS  65   8.672   1.566  -3.769
  506    HB3  LYS  65           2HB      LYS  65   7.205   1.393  -2.776
  507    HG2  LYS  65           1HG      LYS  65   8.559   2.957  -1.624
  508    HG3  LYS  65           2HG      LYS  65   8.748   1.420  -0.745
  509    HD2  LYS  65           1HD      LYS  65  10.841   0.998  -2.047
  510    HD3  LYS  65           2HD      LYS  65  10.673   2.617  -2.766
  511    HE2  LYS  65           1HE      LYS  65  10.619   2.335   0.217
  512    HE3  LYS  65           2HE      LYS  65  12.179   2.213  -0.627
  513    HZ1  LYS  65           3HZ      LYS  65  10.304   4.482  -0.812
  514    HZ2  LYS  65           1HZ      LYS  65  11.710   4.468   0.050
  515    HZ3  LYS  65           2HZ      LYS  65  11.750   4.369  -1.595
  516    H    GLU  66           H        GLU  66   9.725   0.077  -4.972
  517    HA   GLU  66           HA       GLU  66  11.937  -1.751  -4.411
  518    HB2  GLU  66           1HB      GLU  66  11.434   0.227  -6.640
  519    HB3  GLU  66           2HB      GLU  66  12.805  -0.907  -6.573
  520    HG2  GLU  66           1HG      GLU  66  11.101  -2.832  -6.597
  521    HG3  GLU  66           2HG      GLU  66   9.889  -1.537  -6.722
  522    H    ASN  67           H        ASN  67  14.167  -1.214  -4.463
  523    HA   ASN  67           HA       ASN  67  14.761   0.674  -2.413
  524    HB2  ASN  67           1HB      ASN  67  16.801  -0.657  -4.352
  525    HB3  ASN  67           2HB      ASN  67  16.901   0.505  -3.008
  526   HD21  ASN  67          2HD2      ASN  67  17.949  -2.237  -3.338
  527   HD22  ASN  67          1HD2      ASN  67  17.353  -3.125  -1.975
  528    H    ASP  68           H        ASP  68  14.924   0.954  -5.936
  529    HA   ASP  68           HA       ASP  68  16.234   3.532  -5.936
  530    HB2  ASP  68           1HB      ASP  68  14.516   2.145  -8.080
  531    HB3  ASP  68           2HB      ASP  68  15.318   3.734  -8.133
  532    H    ALA  69           H        ALA  69  12.835   2.522  -5.937
  533    HA   ALA  69           HA       ALA  69  11.750   5.121  -6.405
  534    HB1  ALA  69           3HB      ALA  69  10.556   2.765  -4.903
  535    HB2  ALA  69           1HB      ALA  69   9.660   4.180  -5.498
  536    HB3  ALA  69           2HB      ALA  69  10.431   3.067  -6.653
  537    H    ASN  70           H        ASN  70  10.903   6.680  -5.067
  538    HA   ASN  70           HA       ASN  70  11.853   6.552  -2.220
  539    HB2  ASN  70           1HB      ASN  70  11.596   9.200  -3.827
  540    HB3  ASN  70           2HB      ASN  70  11.930   8.699  -2.152
  541   HD21  ASN  70          2HD2      ASN  70  13.178   9.160  -5.305
  542   HD22  ASN  70          1HD2      ASN  70  14.816   8.698  -4.979
  543    H    TRP  71           H        TRP  71  10.561   7.263  -0.595
  544    HA   TRP  71           HA       TRP  71   7.718   6.886  -1.036
  545    HB2  TRP  71           1HB      TRP  71   9.402   7.711   1.352
  546    HB3  TRP  71           2HB      TRP  71   7.624   7.680   1.417
  547    HD1  TRP  71           HD1      TRP  71  10.294   5.771   2.393
  548    HE1  TRP  71           HE1      TRP  71   9.731   3.132   2.565
  549    HE3  TRP  71           HE3      TRP  71   6.027   5.748  -0.369
  550    HZ2  TRP  71           HZ2      TRP  71   7.732   1.481   1.611
  551    HZ3  TRP  71           HZ3      TRP  71   4.824   3.681  -0.728
  552    HH2  TRP  71           HH2      TRP  71   5.607   1.555   0.221
  553    H    GLU  72           H        GLU  72   9.829   9.647  -0.996
  554    HA   GLU  72           HA       GLU  72   7.990  11.732  -0.482
  555    HB2  GLU  72           1HB      GLU  72  10.410  12.019  -0.788
  556    HB3  GLU  72           2HB      GLU  72  10.222  11.653  -2.519
  557    HG2  GLU  72           1HG      GLU  72   8.800  13.744  -2.768
  558    HG3  GLU  72           2HG      GLU  72   9.017  13.936  -1.013
  559    H    THR  73           H        THR  73   8.561   9.931  -3.488
  560    HA   THR  73           HA       THR  73   6.369  11.401  -4.828
  561    HB   THR  73           HB       THR  73   8.052   9.034  -5.752
  562    HG1  THR  73           HG1      THR  73   8.164  11.817  -6.415
  563   HG21  THR  73          3HG2      THR  73   6.123  10.835  -7.268
  564   HG22  THR  73          1HG2      THR  73   7.141   9.565  -7.986
  565   HG23  THR  73          2HG2      THR  73   5.840   9.129  -6.850
  566    H    VAL  74           H        VAL  74   6.995   8.116  -3.580
  567    HA   VAL  74           HA       VAL  74   4.617   7.034  -4.884
  568    HB   VAL  74           HB       VAL  74   6.433   5.920  -2.707
  569   HG11  VAL  74          1HG1      VAL  74   5.360   3.751  -3.211
  570   HG12  VAL  74          2HG1      VAL  74   4.173   4.925  -2.598
  571   HG13  VAL  74          3HG1      VAL  74   4.249   4.561  -4.339
  572   HG21  VAL  74          3HG2      VAL  74   7.565   6.247  -4.822
  573   HG22  VAL  74          1HG2      VAL  74   7.321   4.515  -4.497
  574   HG23  VAL  74          2HG2      VAL  74   6.280   5.355  -5.671
  575    H    LEU  75           H        LEU  75   5.330   8.016  -1.529
  576    HA   LEU  75           HA       LEU  75   3.093   6.519  -0.506
  577    HB2  LEU  75           1HB      LEU  75   5.052   7.069   0.665
  578    HB3  LEU  75           2HB      LEU  75   4.683   8.804   0.784
  579    HG   LEU  75           HG       LEU  75   2.595   8.204   2.040
  580   HD11  LEU  75          1HD1      LEU  75   2.468   5.900   3.027
  581   HD12  LEU  75          2HD1      LEU  75   2.407   5.846   1.250
  582   HD13  LEU  75          3HD1      LEU  75   3.916   5.441   2.101
  583   HD21  LEU  75          3HD2      LEU  75   4.579   8.957   3.213
  584   HD22  LEU  75          1HD2      LEU  75   3.742   7.714   4.174
  585   HD23  LEU  75          2HD2      LEU  75   5.215   7.295   3.264
  586    HA   PRO  76           HA       PRO  76   0.975  10.966  -0.343
  587    HB2  PRO  76           2HB      PRO  76   1.749  12.839  -1.615
  588    HB3  PRO  76           1HB      PRO  76   2.260  11.830  -2.975
  589    HG2  PRO  76           1HG      PRO  76   4.337  12.363  -1.940
  590    HG3  PRO  76           2HG      PRO  76   3.658  12.285  -0.309
  591    HD2  PRO  76           1HD      PRO  76   4.419   9.993  -2.165
  592    HD3  PRO  76           2HD      PRO  76   4.640  10.124  -0.415
  593    H    LYS  77           H        LYS  77   1.881   9.335  -3.377
  594    HA   LYS  77           HA       LYS  77  -0.755   9.613  -4.537
  595    HB2  LYS  77           1HB      LYS  77   1.530   7.716  -5.080
  596    HB3  LYS  77           2HB      LYS  77   0.033   7.783  -6.041
  597    HG2  LYS  77           1HG      LYS  77   0.525  10.118  -6.647
  598    HG3  LYS  77           2HG      LYS  77   2.023  10.052  -5.688
  599    HD2  LYS  77           1HD      LYS  77   2.847   8.222  -7.139
  600    HD3  LYS  77           2HD      LYS  77   1.366   8.349  -8.116
  601    HE2  LYS  77           1HE      LYS  77   1.929  10.672  -8.677
  602    HE3  LYS  77           2HE      LYS  77   3.404  10.554  -7.694
  603    HZ1  LYS  77           3HZ      LYS  77   2.811   8.948 -10.096
  604    HZ2  LYS  77           1HZ      LYS  77   3.861  10.219 -10.027
  605    HZ3  LYS  77           2HZ      LYS  77   4.182   8.837  -9.184
  606    H    VAL  78           H        VAL  78   0.857   6.965  -2.780
  607    HA   VAL  78           HA       VAL  78  -1.301   5.084  -2.888
  608    HB   VAL  78           HB       VAL  78   0.774   5.578  -0.711
  609   HG11  VAL  78          1HG1      VAL  78   0.214   3.290   0.041
  610   HG12  VAL  78          2HG1      VAL  78  -1.199   4.366   0.158
  611   HG13  VAL  78          3HG1      VAL  78  -1.072   3.202  -1.183
  612   HG21  VAL  78          3HG2      VAL  78   1.763   5.008  -2.847
  613   HG22  VAL  78          1HG2      VAL  78   1.927   3.662  -1.695
  614   HG23  VAL  78          2HG2      VAL  78   0.700   3.588  -2.983
  615    H    GLU  79           H        GLU  79  -0.613   7.553  -0.406
  616    HA   GLU  79           HA       GLU  79  -2.949   7.101   1.146
  617    HB2  GLU  79           1HB      GLU  79  -1.067   8.530   1.811
  618    HB3  GLU  79           2HB      GLU  79  -1.532   9.705   0.555
  619    HG2  GLU  79           1HG      GLU  79  -3.732  10.077   1.784
  620    HG3  GLU  79           2HG      GLU  79  -3.142   8.845   2.924
  621    H    ALA  80           H        ALA  80  -2.483   9.138  -1.728
  622    HA   ALA  80           HA       ALA  80  -5.060  10.316  -1.742
  623    HB1  ALA  80           3HB      ALA  80  -3.296   9.554  -4.093
  624    HB2  ALA  80           1HB      ALA  80  -4.671  10.680  -4.148
  625    HB3  ALA  80           2HB      ALA  80  -3.230  11.082  -3.185
  626    H    VAL  81           H        VAL  81  -3.954   7.170  -2.911
  627    HA   VAL  81           HA       VAL  81  -6.182   6.489  -4.555
  628    HB   VAL  81           HB       VAL  81  -4.382   4.751  -2.821
  629   HG11  VAL  81          1HG1      VAL  81  -5.246   2.850  -4.145
  630   HG12  VAL  81          2HG1      VAL  81  -6.548   3.629  -3.213
  631   HG13  VAL  81          3HG1      VAL  81  -6.393   3.939  -4.960
  632   HG21  VAL  81          3HG2      VAL  81  -3.223   5.915  -4.602
  633   HG22  VAL  81          1HG2      VAL  81  -3.324   4.173  -4.946
  634   HG23  VAL  81          2HG2      VAL  81  -4.402   5.309  -5.790
  635    H    PHE  82           H        PHE  82  -5.739   5.829  -1.078
  636    HA   PHE  82           HA       PHE  82  -8.371   4.692  -0.766
  637    HB2  PHE  82           1HB      PHE  82  -6.511   5.990   1.274
  638    HB3  PHE  82           2HB      PHE  82  -7.960   5.036   1.663
  639    HD1  PHE  82           HD1      PHE  82  -4.493   4.951   0.557
  640    HD2  PHE  82           HD2      PHE  82  -8.005   2.641   1.323
  641    HE1  PHE  82           HE1      PHE  82  -3.132   2.888   0.563
  642    HE2  PHE  82           HE2      PHE  82  -6.647   0.576   1.332
  643    HZ   PHE  82           HZ       PHE  82  -4.208   0.699   0.951
  644    H    GLU  83           H        GLU  83  -7.142   7.982  -0.674
  645    HA   GLU  83           HA       GLU  83  -9.514   9.143   0.516
  646    HB2  GLU  83           1HB      GLU  83  -7.287  10.217   0.459
  647    HB3  GLU  83           2HB      GLU  83  -7.449  10.389  -1.305
  648    HG2  GLU  83           1HG      GLU  83  -9.427  11.923  -0.953
  649    HG3  GLU  83           2HG      GLU  83  -9.237  11.567   0.778
  650    H    LEU  84           H        LEU  84  -8.769   7.987  -2.652
  651    HA   LEU  84           HA       LEU  84 -10.133   9.770  -4.313
  652    HB2  LEU  84           1HB      LEU  84  -9.893   6.842  -4.300
  653    HB3  LEU  84           2HB      LEU  84 -10.610   7.615  -5.733
  654    HG   LEU  84           HG       LEU  84  -7.782   8.004  -4.679
  655   HD11  LEU  84          1HD1      LEU  84  -7.118   6.924  -6.845
  656   HD12  LEU  84          2HD1      LEU  84  -8.134   5.840  -5.865
  657   HD13  LEU  84          3HD1      LEU  84  -8.838   6.712  -7.248
  658   HD21  LEU  84          3HD2      LEU  84  -8.658  10.070  -5.597
  659   HD22  LEU  84          1HD2      LEU  84  -7.428   9.394  -6.690
  660   HD23  LEU  84          2HD2      LEU  84  -9.157   9.233  -7.085
  661    H    GLU  85           H        GLU  85 -11.521   7.090  -2.436
  662    HA   GLU  85           HA       GLU  85 -14.244   8.020  -3.248
  663    HB2  GLU  85           1HB      GLU  85 -13.325   5.528  -1.805
  664    HB3  GLU  85           2HB      GLU  85 -15.007   5.927  -2.231
  665    HG2  GLU  85           1HG      GLU  85 -14.357   5.818  -4.692
  666    HG3  GLU  85           2HG      GLU  85 -12.718   5.467  -4.097
  667    H    HIS  86           H        HIS  86 -12.052   7.846  -0.543
  668    HA   HIS  86           HA       HIS  86 -14.280   8.497   1.337
  669    HB2  HIS  86           1HB      HIS  86 -11.410   7.598   1.861
  670    HB3  HIS  86           2HB      HIS  86 -12.622   7.952   3.114
  671    HD1  HIS  86           HD1      HIS  86 -14.698   6.316   3.237
  672    HD2  HIS  86           HD2      HIS  86 -11.583   4.971   0.738
  673    HE1  HIS  86           HE1      HIS  86 -15.060   3.919   2.940
  674    H    HIS  87           H        HIS  87 -12.841  10.323  -0.653
  675    HA   HIS  87           HA       HIS  87 -11.474  12.317   0.891
  676    HB2  HIS  87           1HB      HIS  87 -11.385  12.328  -1.567
  677    HB3  HIS  87           2HB      HIS  87 -13.143  12.595  -1.648
  678    HD1  HIS  87           HD1      HIS  87 -10.004  14.333  -0.371
  679    HD2  HIS  87           HD2      HIS  87 -13.842  15.319  -1.803
  680    HE1  HIS  87           HE1      HIS  87 -10.085  16.773  -0.454
  681    H    HIS  88           H        HIS  88 -12.082  13.857   2.209
  682    HA   HIS  88           HA       HIS  88 -15.018  14.449   2.396
  683    HB2  HIS  88           1HB      HIS  88 -12.927  14.469   4.620
  684    HB3  HIS  88           2HB      HIS  88 -14.618  14.996   4.791
  685    HD1  HIS  88           HD1      HIS  88 -16.456  13.067   4.372
  686    HD2  HIS  88           HD2      HIS  88 -12.528  11.694   5.039
  687    HE1  HIS  88           HE1      HIS  88 -16.667  10.731   5.061
  688    H    HIS  89           H        HIS  89 -15.658  16.556   2.843
  689    HA   HIS  89           HA       HIS  89 -13.716  18.734   2.807
  690    HB2  HIS  89           1HB      HIS  89 -14.373  19.696   0.650
  691    HB3  HIS  89           2HB      HIS  89 -13.735  18.055   0.385
  692    HD2  HIS  89           HD2      HIS  89 -15.560  16.258  -0.881
  693    HE1  HIS  89           HE1      HIS  89 -18.795  19.012  -0.850
  694    HE2  HIS  89           HE2      HIS  89 -17.890  16.688  -1.683
  695    H    HIS  90           H        HIS  90 -14.905  20.882   2.423
  696    HA   HIS  90           HA       HIS  90 -17.708  20.725   3.444
  697    HB2  HIS  90           1HB      HIS  90 -15.547  22.577   4.549
  698    HB3  HIS  90           2HB      HIS  90 -17.263  22.564   5.021
  699    HD2  HIS  90           HD2      HIS  90 -13.917  20.817   6.058
  700    HE1  HIS  90           HE1      HIS  90 -17.167  18.817   7.922
  701    HE2  HIS  90           HE2      HIS  90 -14.561  19.132   7.790
  702    H    HIS  91           H        HIS  91 -17.770  20.993   0.989
  703    HA   HIS  91           HA       HIS  91 -17.357  23.816   0.164
  704    HB2  HIS  91           1HB      HIS  91 -18.257  21.365  -1.418
  705    HB3  HIS  91           2HB      HIS  91 -17.958  22.983  -2.096
  706    HD1  HIS  91           HD1      HIS  91 -16.337  21.185  -3.517
  707    HD2  HIS  91           HD2      HIS  91 -15.028  22.464   0.278
  708    HE1  HIS  91           HE1      HIS  91 -13.943  20.699  -3.430
  Start of MODEL    2
    1    H1   MET   1           1H       MET   1 -12.570   0.866   2.207
    2    H2   MET   1           2H       MET   1 -12.807   0.806   3.686
    3    H3   MET   1           3H       MET   1 -12.913   2.116   2.962
    4    HA   MET   1           HA       MET   1 -10.560   1.151   4.220
    5    HB2  MET   1           1HB      MET   1 -10.419   1.347   1.213
    6    HB3  MET   1           2HB      MET   1  -9.001   1.330   2.288
    7    HG2  MET   1           1HG      MET   1  -9.505  -0.902   3.027
    8    HG3  MET   1           2HG      MET   1 -11.063  -0.886   2.168
    9    HE1  MET   1           3HE      MET   1 -10.808  -0.016  -0.636
   10    HE2  MET   1           1HE      MET   1 -10.194  -1.447  -1.498
   11    HE3  MET   1           2HE      MET   1 -11.407  -1.636  -0.208
   12    H    LYS   2           H        LYS   2 -10.521   2.945   5.394
   13    HA   LYS   2           HA       LYS   2  -9.709   5.414   3.905
   14    HB2  LYS   2           1HB      LYS   2 -11.551   5.218   6.292
   15    HB3  LYS   2           2HB      LYS   2 -10.848   6.727   5.664
   16    HG2  LYS   2           1HG      LYS   2 -12.020   6.352   3.513
   17    HG3  LYS   2           2HG      LYS   2 -12.758   4.881   4.190
   18    HD2  LYS   2           1HD      LYS   2 -13.793   6.274   5.979
   19    HD3  LYS   2           2HD      LYS   2 -13.129   7.724   5.193
   20    HE2  LYS   2           1HE      LYS   2 -14.398   7.210   3.156
   21    HE3  LYS   2           2HE      LYS   2 -15.052   5.748   3.928
   22    HZ1  LYS   2           3HZ      LYS   2 -15.504   8.515   4.842
   23    HZ2  LYS   2           1HZ      LYS   2 -16.601   7.579   4.040
   24    HZ3  LYS   2           2HZ      LYS   2 -16.110   7.159   5.558
   25    H    ILE   3           H        ILE   3  -8.047   6.542   4.680
   26    HA   ILE   3           HA       ILE   3  -6.300   5.044   6.516
   27    HB   ILE   3           HB       ILE   3  -5.949   7.700   5.051
   28   HG12  ILE   3          1HG1      ILE   3  -4.716   5.008   4.524
   29   HG13  ILE   3          2HG1      ILE   3  -6.118   5.683   3.658
   30   HG21  ILE   3          1HG2      ILE   3  -3.569   7.502   5.687
   31   HG22  ILE   3          2HG2      ILE   3  -4.607   7.620   7.127
   32   HG23  ILE   3          3HG2      ILE   3  -3.942   6.045   6.636
   33   HD11  ILE   3          3HD1      ILE   3  -3.329   6.885   3.736
   34   HD12  ILE   3          1HD1      ILE   3  -4.041   5.996   2.371
   35   HD13  ILE   3          2HD1      ILE   3  -4.730   7.560   2.871
   36    H    ILE   4           H        ILE   4  -6.037   5.236   8.560
   37    HA   ILE   4           HA       ILE   4  -6.968   7.763   9.890
   38    HB   ILE   4           HB       ILE   4  -6.249   5.040  11.069
   39   HG12  ILE   4          1HG1      ILE   4  -8.294   4.927   9.855
   40   HG13  ILE   4          2HG1      ILE   4  -8.596   4.849  11.605
   41   HG21  ILE   4          1HG2      ILE   4  -7.114   5.990  13.181
   42   HG22  ILE   4          2HG2      ILE   4  -5.720   6.919  12.585
   43   HG23  ILE   4          3HG2      ILE   4  -7.368   7.555  12.372
   44   HD11  ILE   4          3HD1      ILE   4  -8.985   7.292   9.842
   45   HD12  ILE   4          1HD1      ILE   4 -10.279   6.248  10.475
   46   HD13  ILE   4          2HD1      ILE   4  -9.285   7.215  11.593
   47    H    SER   5           H        SER   5  -4.179   5.593   9.613
   48    HA   SER   5           HA       SER   5  -2.349   7.908  10.008
   49    HB2  SER   5           1HB      SER   5  -2.883   7.520  12.229
   50    HB3  SER   5           2HB      SER   5  -2.493   5.792  12.068
   51    HG   SER   5           HG       SER   5  -0.758   7.019  12.924
   52    H    ILE   6           H        ILE   6  -0.544   7.564   8.861
   53    HA   ILE   6           HA       ILE   6   0.162   4.745   8.092
   54    HB   ILE   6           HB       ILE   6   1.030   7.411   6.880
   55   HG12  ILE   6          1HG1      ILE   6  -0.738   5.260   5.746
   56   HG13  ILE   6          2HG1      ILE   6  -1.299   6.794   6.449
   57   HG21  ILE   6          1HG2      ILE   6   2.106   6.009   5.152
   58   HG22  ILE   6          2HG2      ILE   6   2.790   5.681   6.760
   59   HG23  ILE   6          3HG2      ILE   6   1.627   4.544   6.041
   60   HD11  ILE   6          3HD1      ILE   6   0.486   6.505   4.008
   61   HD12  ILE   6          1HD1      ILE   6  -1.245   6.912   3.990
   62   HD13  ILE   6          2HD1      ILE   6  -0.075   8.041   4.712
   63    H    SER   7           H        SER   7   1.552   3.776   9.263
   64    HA   SER   7           HA       SER   7   3.475   5.384  10.933
   65    HB2  SER   7           1HB      SER   7   2.111   4.000  12.155
   66    HB3  SER   7           2HB      SER   7   2.515   2.596  11.142
   67    HG   SER   7           HG       SER   7   4.648   2.772  11.863
   68    H    GLU   8           H        GLU   8   5.674   4.988  10.895
   69    HA   GLU   8           HA       GLU   8   6.835   3.551   8.613
   70    HB2  GLU   8           1HB      GLU   8   8.069   4.708  11.117
   71    HB3  GLU   8           2HB      GLU   8   8.967   4.032   9.737
   72    HG2  GLU   8           1HG      GLU   8   7.965   5.878   8.271
   73    HG3  GLU   8           2HG      GLU   8   7.168   6.416   9.767
   74    H    THR   9           H        THR   9   8.547   1.916   8.965
   75    HA   THR   9           HA       THR   9   7.818   0.020  11.160
   76    HB   THR   9           HB       THR   9   7.713  -1.849   9.655
   77    HG1  THR   9           HG1      THR   9   7.894  -0.382   7.306
   78   HG21  THR   9          3HG2      THR   9   6.128   0.458   8.461
   79   HG22  THR   9          1HG2      THR   9   5.782  -1.271   8.226
   80   HG23  THR   9          2HG2      THR   9   5.624  -0.542   9.843
   81    HA   PRO  10           HA       PRO  10  12.048  -0.823  11.781
   82    HB2  PRO  10           2HB      PRO  10  12.247  -3.059  12.588
   83    HB3  PRO  10           1HB      PRO  10  11.444  -3.746  11.169
   84    HG2  PRO  10           1HG      PRO  10   9.726  -3.909  12.795
   85    HG3  PRO  10           2HG      PRO  10  10.205  -2.409  13.599
   86    HD2  PRO  10           1HD      PRO  10   8.633  -2.766  11.018
   87    HD3  PRO  10           2HD      PRO  10   8.406  -1.569  12.299
   88    H    ASN  11           H        ASN  11  10.561  -2.394   8.969
   89    HA   ASN  11           HA       ASN  11  13.109  -1.899   7.485
   90    HB2  ASN  11           1HB      ASN  11  11.803  -4.251   7.173
   91    HB3  ASN  11           2HB      ASN  11  10.647  -3.025   6.596
   92   HD21  ASN  11          2HD2      ASN  11  11.844  -5.275   5.194
   93   HD22  ASN  11          1HD2      ASN  11  12.663  -4.609   3.819
   94    H    HIS  12           H        HIS  12  13.345   0.027   6.671
   95    HA   HIS  12           HA       HIS  12  11.088   1.843   6.520
   96    HB2  HIS  12           1HB      HIS  12  12.714   3.505   5.837
   97    HB3  HIS  12           2HB      HIS  12  13.480   2.504   7.095
   98    HD2  HIS  12           HD2      HIS  12  14.101   3.542   3.344
   99    HE1  HIS  12           HE1      HIS  12  16.959   0.624   4.512
  100    HE2  HIS  12           HE2      HIS  12  16.217   2.376   2.697
  101    H    ASN  13           H        ASN  13  12.198  -0.521   4.417
  102    HA   ASN  13           HA       ASN  13  11.616   0.889   1.914
  103    HB2  ASN  13           1HB      ASN  13  12.127  -2.153   2.330
  104    HB3  ASN  13           2HB      ASN  13  11.641  -1.123   0.962
  105   HD21  ASN  13          2HD2      ASN  13  14.005  -2.748   1.248
  106   HD22  ASN  13          1HD2      ASN  13  15.363  -1.679   1.116
  107    H    THR  14           H        THR  14   9.714  -0.449   4.354
  108    HA   THR  14           HA       THR  14   7.360  -0.312   2.515
  109    HB   THR  14           HB       THR  14   7.847  -2.716   2.905
  110    HG1  THR  14           HG1      THR  14   5.697  -2.908   4.297
  111   HG21  THR  14          3HG2      THR  14   7.459  -1.989   5.836
  112   HG22  THR  14          1HG2      THR  14   7.635  -3.637   5.187
  113   HG23  THR  14          2HG2      THR  14   8.993  -2.491   5.084
  114    H    MET  15           H        MET  15   5.486   0.462   3.347
  115    HA   MET  15           HA       MET  15   5.747   1.716   6.065
  116    HB2  MET  15           1HB      MET  15   4.180   2.597   3.639
  117    HB3  MET  15           2HB      MET  15   4.136   3.373   5.241
  118    HG2  MET  15           1HG      MET  15   6.625   3.111   3.531
  119    HG3  MET  15           2HG      MET  15   5.574   4.546   3.552
  120    HE1  MET  15           3HE      MET  15   4.726   4.908   6.522
  121    HE2  MET  15           1HE      MET  15   6.033   5.937   7.155
  122    HE3  MET  15           2HE      MET  15   5.380   6.230   5.525
  123    H    LYS  16           H        LYS  16   3.945   1.845   7.398
  124    HA   LYS  16           HA       LYS  16   1.962  -0.338   6.873
  125    HB2  LYS  16           1HB      LYS  16   3.323  -0.602   8.876
  126    HB3  LYS  16           2HB      LYS  16   2.819   1.009   9.440
  127    HG2  LYS  16           1HG      LYS  16   0.459   0.182   9.504
  128    HG3  LYS  16           2HG      LYS  16   1.061  -1.441   9.096
  129    HD2  LYS  16           1HD      LYS  16   2.422  -1.466  11.135
  130    HD3  LYS  16           2HD      LYS  16   1.869   0.175  11.537
  131    HE2  LYS  16           1HE      LYS  16  -0.451  -0.645  11.666
  132    HE3  LYS  16           2HE      LYS  16   0.115  -2.287  11.285
  133    HZ1  LYS  16           3HZ      LYS  16   0.876  -0.721  13.667
  134    HZ2  LYS  16           1HZ      LYS  16  -0.193  -1.978  13.646
  135    HZ3  LYS  16           2HZ      LYS  16   1.401  -2.244  13.314
  136    H    ILE  17           H        ILE  17   0.019   0.166   6.289
  137    HA   ILE  17           HA       ILE  17  -0.983   2.935   6.899
  138    HB   ILE  17           HB       ILE  17  -1.825   0.984   4.705
  139   HG12  ILE  17          1HG1      ILE  17  -0.323   3.576   4.458
  140   HG13  ILE  17          2HG1      ILE  17   0.423   1.961   4.433
  141   HG21  ILE  17          1HG2      ILE  17  -3.148   2.894   3.862
  142   HG22  ILE  17          2HG2      ILE  17  -3.664   2.432   5.501
  143   HG23  ILE  17          3HG2      ILE  17  -2.639   3.866   5.262
  144   HD11  ILE  17          3HD1      ILE  17  -1.634   3.001   2.453
  145   HD12  ILE  17          1HD1      ILE  17   0.110   2.833   2.151
  146   HD13  ILE  17          2HD1      ILE  17  -0.889   1.386   2.428
  147    H    THR  18           H        THR  18  -2.196   3.049   8.568
  148    HA   THR  18           HA       THR  18  -3.893   0.759   9.346
  149    HB   THR  18           HB       THR  18  -3.587   3.532  10.575
  150    HG1  THR  18           HG1      THR  18  -2.372   2.321  12.146
  151   HG21  THR  18          3HG2      THR  18  -4.938   1.012  11.621
  152   HG22  THR  18          1HG2      THR  18  -4.731   2.531  12.523
  153   HG23  THR  18          2HG2      THR  18  -5.770   2.488  11.079
  154    H    LEU  19           H        LEU  19  -5.881   0.427   8.782
  155    HA   LEU  19           HA       LEU  19  -7.382   2.716   7.557
  156    HB2  LEU  19           1HB      LEU  19  -7.557  -0.203   7.186
  157    HB3  LEU  19           2HB      LEU  19  -8.636   0.894   6.295
  158    HG   LEU  19           HG       LEU  19  -5.614   0.681   6.009
  159   HD11  LEU  19          1HD1      LEU  19  -6.162  -0.096   3.687
  160   HD12  LEU  19          2HD1      LEU  19  -6.874  -1.170   4.913
  161   HD13  LEU  19          3HD1      LEU  19  -7.895   0.021   4.074
  162   HD21  LEU  19          3HD2      LEU  19  -6.344   2.980   5.769
  163   HD22  LEU  19          1HD2      LEU  19  -5.858   2.330   4.186
  164   HD23  LEU  19          2HD2      LEU  19  -7.585   2.494   4.589
  165    H    SER  20           H        SER  20  -9.535   3.007   7.982
  166    HA   SER  20           HA       SER  20 -10.427   2.264  10.690
  167    HB2  SER  20           1HB      SER  20 -10.812   4.412   9.873
  168    HB3  SER  20           2HB      SER  20 -11.777   3.764   8.528
  169    HG   SER  20           HG       SER  20 -13.062   4.427  10.305
  170    H    GLU  21           H        GLU  21 -11.818   1.821   7.405
  171    HA   GLU  21           HA       GLU  21 -12.948  -0.798   8.336
  172    HB2  GLU  21           1HB      GLU  21 -14.220   1.282   6.552
  173    HB3  GLU  21           2HB      GLU  21 -14.850  -0.361   6.826
  174    HG2  GLU  21           1HG      GLU  21 -15.142   0.229   9.295
  175    HG3  GLU  21           2HG      GLU  21 -14.480   1.816   8.841
  176    H    SER  22           H        SER  22 -11.075  -1.794   7.495
  177    HA   SER  22           HA       SER  22 -10.273  -1.605   4.697
  178    HB2  SER  22           1HB      SER  22  -8.893  -3.362   5.085
  179    HB3  SER  22           2HB      SER  22  -8.833  -2.272   6.489
  180    HG   SER  22           HG       SER  22  -8.995  -4.639   6.864
  181    H    ARG  23           H        ARG  23 -10.253  -3.653   3.356
  182    HA   ARG  23           HA       ARG  23 -12.879  -4.243   2.495
  183    HB2  ARG  23           1HB      ARG  23 -10.938  -4.490   1.110
  184    HB3  ARG  23           2HB      ARG  23 -10.423  -5.889   2.081
  185    HG2  ARG  23           1HG      ARG  23 -12.436  -7.113   1.412
  186    HG3  ARG  23           2HG      ARG  23 -12.985  -5.707   0.465
  187    HD2  ARG  23           1HD      ARG  23 -11.087  -5.941  -0.999
  188    HD3  ARG  23           2HD      ARG  23 -10.506  -7.324  -0.040
  189    HE   ARG  23           HE       ARG  23 -13.109  -8.037  -1.065
  190   HH11  ARG  23          1HH1      ARG  23  -9.953  -7.289  -2.347
  191   HH12  ARG  23          2HH1      ARG  23 -10.250  -8.346  -3.712
  192   HH21  ARG  23          2HH2      ARG  23 -12.254  -9.462  -3.874
  193   HH22  ARG  23          1HH2      ARG  23 -13.467  -9.246  -2.626
  194    H    GLU  24           H        GLU  24 -14.334  -5.816   2.789
  195    HA   GLU  24           HA       GLU  24 -14.705  -6.826   5.370
  196    HB2  GLU  24           1HB      GLU  24 -16.423  -6.725   3.616
  197    HB3  GLU  24           2HB      GLU  24 -15.617  -8.069   2.772
  198    HG2  GLU  24           1HG      GLU  24 -16.124  -9.571   4.755
  199    HG3  GLU  24           2HG      GLU  24 -16.822  -8.119   5.507
  200    H    GLY  25           H        GLY  25 -13.088  -8.426   2.639
  201    HA2  GLY  25           1HA      GLY  25 -12.410 -10.782   4.197
  202    HA3  GLY  25           2HA      GLY  25 -11.729 -10.312   2.623
  203    H    MET  26           H        MET  26 -11.660  -9.447   6.094
  204    HA   MET  26           HA       MET  26  -9.164  -7.943   5.801
  205    HB2  MET  26           1HB      MET  26 -10.745  -8.872   8.195
  206    HB3  MET  26           2HB      MET  26  -9.279  -7.867   8.281
  207    HG2  MET  26           1HG      MET  26 -10.479  -6.171   6.854
  208    HG3  MET  26           2HG      MET  26 -11.954  -7.144   7.056
  209    HE1  MET  26           3HE      MET  26 -13.375  -5.223   8.111
  210    HE2  MET  26           1HE      MET  26 -12.796  -4.153   9.410
  211    HE3  MET  26           2HE      MET  26 -12.015  -4.115   7.809
  212    H    THR  27           H        THR  27  -9.794 -11.187   5.773
  213    HA   THR  27           HA       THR  27  -7.575 -12.237   7.251
  214    HB   THR  27           HB       THR  27  -7.703 -14.164   5.723
  215    HG1  THR  27           HG1      THR  27  -8.097 -12.991   3.780
  216   HG21  THR  27          3HG2      THR  27 -10.450 -13.067   6.441
  217   HG22  THR  27          1HG2      THR  27 -10.069 -14.769   6.089
  218   HG23  THR  27          2HG2      THR  27  -9.379 -13.982   7.529
  219    H    SER  28           H        SER  28  -5.608 -13.165   6.367
  220    HA   SER  28           HA       SER  28  -3.928 -11.085   5.270
  221    HB2  SER  28           1HB      SER  28  -2.217 -12.614   5.285
  222    HB3  SER  28           2HB      SER  28  -3.168 -12.732   6.784
  223    HG   SER  28           HG       SER  28  -2.629 -14.780   5.909
  224    H    ASP  29           H        ASP  29  -3.130 -10.753   3.253
  225    HA   ASP  29           HA       ASP  29  -3.526 -12.689   1.087
  226    HB2  ASP  29           1HB      ASP  29  -5.759 -11.169   1.374
  227    HB3  ASP  29           2HB      ASP  29  -4.603 -10.010   0.675
  228    H    THR  30           H        THR  30  -2.416 -12.196  -0.811
  229    HA   THR  30           HA       THR  30  -0.290 -10.120  -0.381
  230    HB   THR  30           HB       THR  30  -0.048 -12.824  -1.765
  231    HG1  THR  30           HG1      THR  30   1.376 -13.229   0.031
  232   HG21  THR  30          3HG2      THR  30   2.017 -10.656  -1.210
  233   HG22  THR  30          1HG2      THR  30   2.349 -12.250  -1.928
  234   HG23  THR  30          2HG2      THR  30   1.346 -11.069  -2.805
  235    H    TYR  31           H        TYR  31   0.018  -8.643  -1.852
  236    HA   TYR  31           HA       TYR  31  -1.341  -9.016  -4.502
  237    HB2  TYR  31           1HB      TYR  31  -1.193  -6.485  -2.851
  238    HB3  TYR  31           2HB      TYR  31  -1.940  -6.667  -4.457
  239    HD1  TYR  31           HD1      TYR  31  -2.683  -6.408  -1.074
  240    HD2  TYR  31           HD2      TYR  31  -3.721  -8.734  -4.493
  241    HE1  TYR  31           HE1      TYR  31  -4.832  -7.012  -0.001
  242    HE2  TYR  31           HE2      TYR  31  -5.870  -9.346  -3.438
  243    HH   TYR  31           HH       TYR  31  -6.820  -9.498  -1.032
  244    H    THR  32           H        THR  32   0.224  -9.311  -5.896
  245    HA   THR  32           HA       THR  32   2.552  -7.418  -5.782
  246    HB   THR  32           HB       THR  32   3.902  -9.181  -6.846
  247    HG1  THR  32           HG1      THR  32   2.970 -11.298  -7.012
  248   HG21  THR  32          3HG2      THR  32   2.469 -10.162  -4.345
  249   HG22  THR  32          1HG2      THR  32   4.047 -10.738  -4.934
  250   HG23  THR  32          2HG2      THR  32   3.864  -9.057  -4.379
  251    H    LYS  33           H        LYS  33   0.121  -8.992  -7.752
  252    HA   LYS  33           HA       LYS  33   0.919  -7.179 -10.004
  253    HB2  LYS  33           1HB      LYS  33   0.004 -10.056 -10.146
  254    HB3  LYS  33           2HB      LYS  33   0.145  -8.962 -11.541
  255    HG2  LYS  33           1HG      LYS  33   2.572  -8.738 -11.094
  256    HG3  LYS  33           2HG      LYS  33   2.412  -9.890  -9.747
  257    HD2  LYS  33           1HD      LYS  33   1.594 -11.604 -11.338
  258    HD3  LYS  33           2HD      LYS  33   1.819 -10.450 -12.674
  259    HE2  LYS  33           1HE      LYS  33   4.218 -10.328 -12.167
  260    HE3  LYS  33           2HE      LYS  33   3.996 -11.478 -10.828
  261    HZ1  LYS  33           3HZ      LYS  33   3.493 -12.046 -13.679
  262    HZ2  LYS  33           1HZ      LYS  33   4.796 -12.566 -12.813
  263    HZ3  LYS  33           2HZ      LYS  33   3.286 -13.113 -12.438
  264    H    VAL  34           H        VAL  34  -0.650  -6.200 -11.135
  265    HA   VAL  34           HA       VAL  34  -3.130  -5.673  -9.774
  266    HB   VAL  34           HB       VAL  34  -2.313  -5.217 -12.672
  267   HG11  VAL  34          1HG1      VAL  34  -4.218  -3.643 -12.745
  268   HG12  VAL  34          2HG1      VAL  34  -4.771  -5.305 -12.426
  269   HG13  VAL  34          3HG1      VAL  34  -4.679  -4.126 -11.094
  270   HG21  VAL  34          3HG2      VAL  34  -0.929  -4.014 -11.089
  271   HG22  VAL  34          1HG2      VAL  34  -1.997  -2.898 -11.972
  272   HG23  VAL  34          2HG2      VAL  34  -2.379  -3.355 -10.293
  273    H    ASP  35           H        ASP  35  -5.080  -6.446  -9.807
  274    HA   ASP  35           HA       ASP  35  -5.953  -8.387 -11.814
  275    HB2  ASP  35           1HB      ASP  35  -4.388  -9.702 -10.103
  276    HB3  ASP  35           2HB      ASP  35  -5.735  -9.268  -9.023
  277    H    ASP  36           H        ASP  36  -8.113  -8.895 -11.718
  278    HA   ASP  36           HA       ASP  36  -9.718  -6.739 -10.675
  279    HB2  ASP  36           1HB      ASP  36 -10.527  -9.442 -11.904
  280    HB3  ASP  36           2HB      ASP  36 -11.566  -8.135 -11.284
  281    H    SER  37           H        SER  37  -8.853  -9.891  -9.438
  282    HA   SER  37           HA       SER  37 -10.968 -10.160  -7.451
  283    HB2  SER  37           1HB      SER  37  -9.718 -11.850  -6.532
  284    HB3  SER  37           2HB      SER  37  -9.746 -11.994  -8.304
  285    HG   SER  37           HG       SER  37  -7.650 -11.258  -8.371
  286    H    GLN  38           H        GLN  38  -8.181  -8.130  -7.708
  287    HA   GLN  38           HA       GLN  38  -7.875  -7.855  -4.771
  288    HB2  GLN  38           1HB      GLN  38  -6.481  -6.369  -7.001
  289    HB3  GLN  38           2HB      GLN  38  -6.015  -6.434  -5.285
  290    HG2  GLN  38           1HG      GLN  38  -5.444  -9.040  -5.700
  291    HG3  GLN  38           2HG      GLN  38  -6.125  -8.537  -7.266
  292   HE21  GLN  38          2HE2      GLN  38  -3.543  -9.740  -6.776
  293   HE22  GLN  38          1HE2      GLN  38  -2.345  -8.601  -7.295
  294    HA   PRO  39           HA       PRO  39 -10.254  -4.167  -4.173
  295    HB2  PRO  39           2HB      PRO  39  -9.348  -3.158  -2.219
  296    HB3  PRO  39           1HB      PRO  39  -7.716  -3.089  -2.895
  297    HG2  PRO  39           1HG      PRO  39  -7.493  -4.872  -1.355
  298    HG3  PRO  39           2HG      PRO  39  -9.149  -5.437  -1.611
  299    HD2  PRO  39           1HD      PRO  39  -6.707  -5.838  -3.387
  300    HD3  PRO  39           2HD      PRO  39  -7.993  -6.986  -2.996
  301    H    ALA  40           H        ALA  40 -10.704  -2.608  -5.464
  302    HA   ALA  40           HA       ALA  40  -9.213  -1.805  -7.671
  303    HB1  ALA  40           3HB      ALA  40 -11.075  -0.090  -5.991
  304    HB2  ALA  40           1HB      ALA  40 -10.558   0.260  -7.657
  305    HB3  ALA  40           2HB      ALA  40 -11.558  -1.172  -7.319
  306    H    PHE  41           H        PHE  41  -9.158  -0.349  -4.413
  307    HA   PHE  41           HA       PHE  41  -7.236   1.675  -4.928
  308    HB2  PHE  41           1HB      PHE  41  -7.806   0.033  -2.427
  309    HB3  PHE  41           2HB      PHE  41  -6.684   1.411  -2.466
  310    HD1  PHE  41           HD1      PHE  41  -8.977   2.409  -4.734
  311    HD2  PHE  41           HD2      PHE  41  -8.683   1.605  -0.549
  312    HE1  PHE  41           HE1      PHE  41 -10.859   3.954  -4.306
  313    HE2  PHE  41           HE2      PHE  41 -10.565   3.147  -0.117
  314    HZ   PHE  41           HZ       PHE  41 -11.653   4.324  -1.998
  315    H    ILE  42           H        ILE  42  -6.723  -1.711  -3.928
  316    HA   ILE  42           HA       ILE  42  -3.860  -1.567  -3.826
  317    HB   ILE  42           HB       ILE  42  -5.763  -3.876  -4.411
  318   HG12  ILE  42          1HG1      ILE  42  -5.904  -2.916  -2.196
  319   HG13  ILE  42          2HG1      ILE  42  -5.293  -4.586  -2.193
  320   HG21  ILE  42          1HG2      ILE  42  -3.820  -5.360  -4.054
  321   HG22  ILE  42          2HG2      ILE  42  -3.568  -4.306  -5.465
  322   HG23  ILE  42          3HG2      ILE  42  -2.757  -3.939  -3.925
  323   HD11  ILE  42          3HD1      ILE  42  -3.609  -2.075  -1.891
  324   HD12  ILE  42          1HD1      ILE  42  -4.065  -3.186  -0.579
  325   HD13  ILE  42          2HD1      ILE  42  -2.996  -3.745  -1.888
  326    H    ASN  43           H        ASN  43  -6.050  -2.165  -6.530
  327    HA   ASN  43           HA       ASN  43  -3.977  -2.899  -8.392
  328    HB2  ASN  43           1HB      ASN  43  -6.813  -1.796  -9.046
  329    HB3  ASN  43           2HB      ASN  43  -5.383  -2.248 -10.005
  330   HD21  ASN  43          2HD2      ASN  43  -8.189  -3.347  -9.642
  331   HD22  ASN  43          1HD2      ASN  43  -7.942  -5.042  -9.376
  332    H    ASP  44           H        ASP  44  -5.612   0.220  -7.789
  333    HA   ASP  44           HA       ASP  44  -4.064   1.765  -9.610
  334    HB2  ASP  44           1HB      ASP  44  -5.360   2.586  -6.942
  335    HB3  ASP  44           2HB      ASP  44  -4.481   3.588  -8.123
  336    H    ILE  45           H        ILE  45  -3.441   0.958  -6.197
  337    HA   ILE  45           HA       ILE  45  -1.047   2.562  -5.993
  338    HB   ILE  45           HB       ILE  45  -1.995   0.113  -4.440
  339   HG12  ILE  45          1HG1      ILE  45  -1.902   2.990  -3.588
  340   HG13  ILE  45          2HG1      ILE  45  -3.320   2.231  -4.349
  341   HG21  ILE  45          1HG2      ILE  45  -0.270   0.722  -2.779
  342   HG22  ILE  45          2HG2      ILE  45   0.467   0.308  -4.344
  343   HG23  ILE  45          3HG2      ILE  45   0.312   2.013  -3.856
  344   HD11  ILE  45          3HD1      ILE  45  -2.020   1.360  -1.743
  345   HD12  ILE  45          1HD1      ILE  45  -3.540   2.271  -1.895
  346   HD13  ILE  45          2HD1      ILE  45  -3.438   0.601  -2.503
  347    H    LEU  46           H        LEU  46  -1.526  -0.861  -6.801
  348    HA   LEU  46           HA       LEU  46   1.223  -1.506  -7.152
  349    HB2  LEU  46           1HB      LEU  46  -1.291  -2.345  -8.413
  350    HB3  LEU  46           2HB      LEU  46   0.195  -3.188  -8.908
  351    HG   LEU  46           HG       LEU  46  -0.948  -3.088  -6.089
  352   HD11  LEU  46          1HD1      LEU  46  -1.400  -5.529  -6.448
  353   HD12  LEU  46          2HD1      LEU  46  -2.283  -4.528  -7.625
  354   HD13  LEU  46          3HD1      LEU  46  -0.800  -5.379  -8.116
  355   HD21  LEU  46          3HD2      LEU  46   1.475  -3.196  -6.090
  356   HD22  LEU  46          1HD2      LEU  46   0.798  -4.752  -5.557
  357   HD23  LEU  46          2HD2      LEU  46   1.440  -4.580  -7.208
  358    H    LYS  47           H        LYS  47  -1.049   0.142  -9.290
  359    HA   LYS  47           HA       LYS  47   0.756   0.079 -11.581
  360    HB2  LYS  47           1HB      LYS  47  -1.729   1.661 -10.926
  361    HB3  LYS  47           2HB      LYS  47  -0.827   1.829 -12.450
  362    HG2  LYS  47           1HG      LYS  47  -1.246  -0.537 -12.966
  363    HG3  LYS  47           2HG      LYS  47  -2.137  -0.717 -11.436
  364    HD2  LYS  47           1HD      LYS  47  -3.775   0.959 -12.194
  365    HD3  LYS  47           2HD      LYS  47  -2.884   1.135 -13.724
  366    HE2  LYS  47           1HE      LYS  47  -3.285  -1.245 -14.220
  367    HE3  LYS  47           2HE      LYS  47  -4.201  -1.400 -12.705
  368    HZ1  LYS  47           3HZ      LYS  47  -4.919   0.348 -14.969
  369    HZ2  LYS  47           1HZ      LYS  47  -5.653  -1.079 -14.590
  370    HZ3  LYS  47           2HZ      LYS  47  -5.768   0.205 -13.562
  371    H    VAL  48           H        VAL  48   0.353   2.127  -8.807
  372    HA   VAL  48           HA       VAL  48   1.759   4.456  -9.772
  373    HB   VAL  48           HB       VAL  48   1.599   3.231  -6.987
  374   HG11  VAL  48          1HG1      VAL  48   2.362   5.446  -6.199
  375   HG12  VAL  48          2HG1      VAL  48   3.586   4.678  -7.236
  376   HG13  VAL  48          3HG1      VAL  48   2.559   5.978  -7.887
  377   HG21  VAL  48          3HG2      VAL  48  -0.563   3.899  -7.854
  378   HG22  VAL  48          1HG2      VAL  48  -0.037   4.996  -6.556
  379   HG23  VAL  48          2HG2      VAL  48   0.075   5.511  -8.257
  380    H    GLU  49           H        GLU  49   3.681   4.774 -10.439
  381    HA   GLU  49           HA       GLU  49   5.629   2.685 -10.580
  382    HB2  GLU  49           1HB      GLU  49   5.504   4.651 -12.075
  383    HB3  GLU  49           2HB      GLU  49   6.041   5.677 -10.723
  384    HG2  GLU  49           1HG      GLU  49   8.235   4.391 -10.677
  385    HG3  GLU  49           2HG      GLU  49   7.532   3.413 -11.986
  386    H    GLY  50           H        GLY  50   6.951   1.851  -9.188
  387    HA2  GLY  50           1HA      GLY  50   8.877   2.379  -7.711
  388    HA3  GLY  50           2HA      GLY  50   7.832   3.565  -6.896
  389    H    VAL  51           H        VAL  51   5.510   1.654  -7.164
  390    HA   VAL  51           HA       VAL  51   5.907   0.278  -4.593
  391    HB   VAL  51           HB       VAL  51   3.607   0.197  -6.592
  392   HG11  VAL  51          1HG1      VAL  51   2.324  -0.768  -4.713
  393   HG12  VAL  51          2HG1      VAL  51   3.697  -1.811  -5.153
  394   HG13  VAL  51          3HG1      VAL  51   3.793  -0.772  -3.710
  395   HG21  VAL  51          3HG2      VAL  51   3.938   2.417  -5.680
  396   HG22  VAL  51          1HG2      VAL  51   2.463   1.674  -5.017
  397   HG23  VAL  51          2HG2      VAL  51   3.938   1.758  -4.026
  398    H    LYS  52           H        LYS  52   6.595  -1.626  -4.179
  399    HA   LYS  52           HA       LYS  52   7.252  -3.367  -6.508
  400    HB2  LYS  52           1HB      LYS  52   9.035  -2.725  -4.941
  401    HB3  LYS  52           2HB      LYS  52   8.124  -3.491  -3.616
  402    HG2  LYS  52           1HG      LYS  52   8.340  -5.675  -4.713
  403    HG3  LYS  52           2HG      LYS  52   9.226  -4.919  -6.060
  404    HD2  LYS  52           1HD      LYS  52  10.993  -4.207  -4.491
  405    HD3  LYS  52           2HD      LYS  52  10.111  -4.986  -3.155
  406    HE2  LYS  52           1HE      LYS  52  10.342  -7.161  -4.241
  407    HE3  LYS  52           2HE      LYS  52  11.164  -6.402  -5.624
  408    HZ1  LYS  52           3HZ      LYS  52  12.168  -6.452  -2.849
  409    HZ2  LYS  52           1HZ      LYS  52  12.728  -7.385  -4.088
  410    HZ3  LYS  52           2HZ      LYS  52  12.929  -5.748  -4.130
  411    H    SER  53           H        SER  53   5.998  -3.788  -3.179
  412    HA   SER  53           HA       SER  53   4.098  -5.898  -4.174
  413    HB2  SER  53           1HB      SER  53   4.814  -7.549  -2.772
  414    HB3  SER  53           2HB      SER  53   6.149  -7.047  -3.833
  415    HG   SER  53           HG       SER  53   6.805  -7.339  -1.658
  416    H    ILE  54           H        ILE  54   2.372  -6.216  -2.808
  417    HA   ILE  54           HA       ILE  54   2.281  -4.561  -0.300
  418    HB   ILE  54           HB       ILE  54   0.031  -5.000  -2.319
  419   HG12  ILE  54          1HG1      ILE  54   1.387  -2.431  -1.558
  420   HG13  ILE  54          2HG1      ILE  54   1.820  -3.405  -2.981
  421   HG21  ILE  54          1HG2      ILE  54  -1.254  -3.487  -0.847
  422   HG22  ILE  54          2HG2      ILE  54  -0.752  -4.954   0.025
  423   HG23  ILE  54          3HG2      ILE  54   0.116  -3.422   0.284
  424   HD11  ILE  54          3HD1      ILE  54  -0.898  -2.156  -2.441
  425   HD12  ILE  54          1HD1      ILE  54   0.314  -1.555  -3.595
  426   HD13  ILE  54          2HD1      ILE  54  -0.465  -3.131  -3.863
  427    H    PHE  55           H        PHE  55   1.513  -5.409   1.471
  428    HA   PHE  55           HA       PHE  55   0.170  -8.082   1.242
  429    HB2  PHE  55           1HB      PHE  55   2.469  -8.392   2.107
  430    HB3  PHE  55           2HB      PHE  55   2.152  -7.198   3.386
  431    HD1  PHE  55           HD1      PHE  55   0.888 -10.434   2.032
  432    HD2  PHE  55           HD2      PHE  55   1.393  -7.889   5.426
  433    HE1  PHE  55           HE1      PHE  55   0.055 -12.236   3.505
  434    HE2  PHE  55           HE2      PHE  55   0.563  -9.689   6.903
  435    HZ   PHE  55           HZ       PHE  55  -0.109 -11.864   5.941
  436    H    HIS  56           H        HIS  56  -1.800  -8.097   1.939
  437    HA   HIS  56           HA       HIS  56  -2.637  -6.007   3.907
  438    HB2  HIS  56           1HB      HIS  56  -3.996  -6.014   1.877
  439    HB3  HIS  56           2HB      HIS  56  -4.260  -7.767   2.015
  440    HD2  HIS  56           HD2      HIS  56  -4.866  -5.426   5.217
  441    HE1  HIS  56           HE1      HIS  56  -8.539  -6.942   3.712
  442    HE2  HIS  56           HE2      HIS  56  -7.327  -5.609   5.627
  443    H    VAL  57           H        VAL  57  -2.988  -6.469   5.926
  444    HA   VAL  57           HA       VAL  57  -4.199  -9.116   6.605
  445    HB   VAL  57           HB       VAL  57  -1.782  -9.417   7.058
  446   HG11  VAL  57          1HG1      VAL  57  -0.681  -8.012   8.769
  447   HG12  VAL  57          2HG1      VAL  57  -1.182  -7.039   7.366
  448   HG13  VAL  57          3HG1      VAL  57  -2.136  -6.992   8.868
  449   HG21  VAL  57          3HG2      VAL  57  -3.402 -10.504   8.495
  450   HG22  VAL  57          1HG2      VAL  57  -1.964 -10.014   9.421
  451   HG23  VAL  57          2HG2      VAL  57  -3.466  -9.067   9.542
  452    H    MET  58           H        MET  58  -5.872  -8.965   7.808
  453    HA   MET  58           HA       MET  58  -7.485  -8.045   9.212
  454    HB2  MET  58           1HB      MET  58  -5.006  -6.748  10.337
  455    HB3  MET  58           2HB      MET  58  -6.624  -6.605  11.064
  456    HG2  MET  58           1HG      MET  58  -6.708  -8.969  11.500
  457    HG3  MET  58           2HG      MET  58  -5.203  -9.239  10.589
  458    HE1  MET  58           3HE      MET  58  -6.847  -8.007  13.905
  459    HE2  MET  58           1HE      MET  58  -5.502  -7.188  14.733
  460    HE3  MET  58           2HE      MET  58  -6.208  -6.475  13.262
  461    H    ASP  59           H        ASP  59  -6.243  -5.137  10.162
  462    HA   ASP  59           HA       ASP  59  -7.903  -3.747   8.082
  463    HB2  ASP  59           1HB      ASP  59  -8.748  -2.256   9.874
  464    HB3  ASP  59           2HB      ASP  59  -8.953  -3.999  10.177
  465    H    PHE  60           H        PHE  60  -4.970  -4.226   8.203
  466    HA   PHE  60           HA       PHE  60  -4.332  -1.433   7.468
  467    HB2  PHE  60           1HB      PHE  60  -2.261  -1.368   8.761
  468    HB3  PHE  60           2HB      PHE  60  -3.618  -1.653   9.873
  469    HD1  PHE  60           HD1      PHE  60  -0.578  -3.003   8.405
  470    HD2  PHE  60           HD2      PHE  60  -3.938  -3.824  10.913
  471    HE1  PHE  60           HE1      PHE  60   0.581  -4.993   9.303
  472    HE2  PHE  60           HE2      PHE  60  -2.781  -5.813  11.816
  473    HZ   PHE  60           HZ       PHE  60  -0.521  -6.399  11.009
  474    H    ILE  61           H        ILE  61  -2.435  -1.216   6.183
  475    HA   ILE  61           HA       ILE  61  -1.816  -3.760   4.702
  476    HB   ILE  61           HB       ILE  61  -2.454  -1.005   3.550
  477   HG12  ILE  61          1HG1      ILE  61  -3.865  -3.637   3.195
  478   HG13  ILE  61          2HG1      ILE  61  -4.385  -2.325   4.276
  479   HG21  ILE  61          1HG2      ILE  61  -2.085  -2.076   1.354
  480   HG22  ILE  61          2HG2      ILE  61  -0.605  -2.115   2.342
  481   HG23  ILE  61          3HG2      ILE  61  -1.598  -3.582   2.168
  482   HD11  ILE  61          3HD1      ILE  61  -4.126  -2.143   1.255
  483   HD12  ILE  61          1HD1      ILE  61  -5.649  -2.290   2.162
  484   HD13  ILE  61          2HD1      ILE  61  -4.647  -0.829   2.336
  485    H    SER  62           H        SER  62   0.168  -4.208   4.259
  486    HA   SER  62           HA       SER  62   2.307  -2.207   4.955
  487    HB2  SER  62           1HB      SER  62   2.455  -4.249   6.049
  488    HB3  SER  62           2HB      SER  62   2.432  -5.127   4.502
  489    HG   SER  62           HG       SER  62   4.551  -4.817   5.236
  490    H    VAL  63           H        VAL  63   2.894  -0.943   3.284
  491    HA   VAL  63           HA       VAL  63   2.918  -2.125   0.512
  492    HB   VAL  63           HB       VAL  63   2.830   0.789   1.401
  493   HG11  VAL  63          1HG1      VAL  63   2.476   1.243  -1.002
  494   HG12  VAL  63          2HG1      VAL  63   4.038   0.438  -0.725
  495   HG13  VAL  63          3HG1      VAL  63   2.656  -0.491  -1.357
  496   HG21  VAL  63          3HG2      VAL  63   0.728  -0.325   1.856
  497   HG22  VAL  63          1HG2      VAL  63   0.564   0.803   0.490
  498   HG23  VAL  63          2HG2      VAL  63   0.676  -0.948   0.191
  499    H    ASP  64           H        ASP  64   4.731  -2.748  -0.240
  500    HA   ASP  64           HA       ASP  64   7.216  -1.449   0.825
  501    HB2  ASP  64           1HB      ASP  64   6.915  -3.979   1.294
  502    HB3  ASP  64           2HB      ASP  64   6.830  -4.066  -0.482
  503    H    LYS  65           H        LYS  65   8.492  -0.362  -0.446
  504    HA   LYS  65           HA       LYS  65   7.784  -0.288  -3.344
  505    HB2  LYS  65           1HB      LYS  65   8.854   1.815  -3.418
  506    HB3  LYS  65           2HB      LYS  65   7.773   1.802  -2.006
  507    HG2  LYS  65           1HG      LYS  65   9.629   1.542  -0.498
  508    HG3  LYS  65           2HG      LYS  65  10.758   1.290  -1.849
  509    HD2  LYS  65           1HD      LYS  65  10.421   3.574  -2.612
  510    HD3  LYS  65           2HD      LYS  65   9.186   3.840  -1.360
  511    HE2  LYS  65           1HE      LYS  65  11.191   4.837  -0.556
  512    HE3  LYS  65           2HE      LYS  65  10.960   3.332   0.359
  513    HZ1  LYS  65           3HZ      LYS  65  12.768   3.675  -1.946
  514    HZ2  LYS  65           1HZ      LYS  65  13.235   3.590  -0.367
  515    HZ3  LYS  65           2HZ      LYS  65  12.555   2.277  -1.098
  516    H    GLU  66           H        GLU  66   9.773   0.389  -4.732
  517    HA   GLU  66           HA       GLU  66  11.818  -1.715  -4.407
  518    HB2  GLU  66           1HB      GLU  66  11.434   0.455  -6.473
  519    HB3  GLU  66           2HB      GLU  66  12.699  -0.795  -6.519
  520    HG2  GLU  66           1HG      GLU  66  10.819  -2.553  -6.639
  521    HG3  GLU  66           2HG      GLU  66   9.735  -1.145  -6.660
  522    H    ASN  67           H        ASN  67  14.093  -1.264  -4.568
  523    HA   ASN  67           HA       ASN  67  14.904   0.527  -2.475
  524    HB2  ASN  67           1HB      ASN  67  16.752  -0.907  -4.529
  525    HB3  ASN  67           2HB      ASN  67  16.991   0.222  -3.174
  526   HD21  ASN  67          2HD2      ASN  67  17.816  -2.594  -3.615
  527   HD22  ASN  67          1HD2      ASN  67  17.235  -3.459  -2.232
  528    H    ASP  68           H        ASP  68  14.947   0.819  -6.007
  529    HA   ASP  68           HA       ASP  68  16.347   3.362  -6.003
  530    HB2  ASP  68           1HB      ASP  68  14.609   2.009  -8.153
  531    HB3  ASP  68           2HB      ASP  68  15.438   3.583  -8.203
  532    H    ALA  69           H        ALA  69  12.935   2.413  -5.974
  533    HA   ALA  69           HA       ALA  69  11.865   4.996  -6.506
  534    HB1  ALA  69           3HB      ALA  69  10.690   2.727  -4.864
  535    HB2  ALA  69           1HB      ALA  69   9.791   4.121  -5.504
  536    HB3  ALA  69           2HB      ALA  69  10.521   2.945  -6.622
  537    H    ASN  70           H        ASN  70  10.792   6.477  -5.099
  538    HA   ASN  70           HA       ASN  70  11.865   6.468  -2.294
  539    HB2  ASN  70           1HB      ASN  70  11.476   9.091  -3.918
  540    HB3  ASN  70           2HB      ASN  70  11.854   8.614  -2.244
  541   HD21  ASN  70          2HD2      ASN  70  13.024   9.017  -5.454
  542   HD22  ASN  70          1HD2      ASN  70  14.690   8.661  -5.134
  543    H    TRP  71           H        TRP  71  10.562   7.165  -0.664
  544    HA   TRP  71           HA       TRP  71   7.725   6.696  -1.060
  545    HB2  TRP  71           1HB      TRP  71   9.427   7.608   1.280
  546    HB3  TRP  71           2HB      TRP  71   7.651   7.576   1.376
  547    HD1  TRP  71           HD1      TRP  71  10.224   5.736   2.523
  548    HE1  TRP  71           HE1      TRP  71   9.709   3.090   2.723
  549    HE3  TRP  71           HE3      TRP  71   6.192   5.540  -0.564
  550    HZ2  TRP  71           HZ2      TRP  71   7.829   1.367   1.658
  551    HZ3  TRP  71           HZ3      TRP  71   5.067   3.437  -0.962
  552    HH2  TRP  71           HH2      TRP  71   5.821   1.354   0.102
  553    H    GLU  72           H        GLU  72   9.760   9.519  -1.094
  554    HA   GLU  72           HA       GLU  72   7.805  11.527  -0.590
  555    HB2  GLU  72           1HB      GLU  72  10.243  11.490  -2.370
  556    HB3  GLU  72           2HB      GLU  72   9.259  12.943  -2.064
  557    HG2  GLU  72           1HG      GLU  72   9.846  12.797   0.392
  558    HG3  GLU  72           2HG      GLU  72  10.691  11.288  -0.027
  559    H    THR  73           H        THR  73   8.527   9.693  -3.519
  560    HA   THR  73           HA       THR  73   6.512  11.186  -5.070
  561    HB   THR  73           HB       THR  73   8.040   8.628  -5.715
  562    HG1  THR  73           HG1      THR  73   8.434  11.339  -6.542
  563   HG21  THR  73          3HG2      THR  73   6.367  10.464  -7.477
  564   HG22  THR  73          1HG2      THR  73   7.313   9.063  -8.035
  565   HG23  THR  73          2HG2      THR  73   5.914   8.822  -6.961
  566    H    VAL  74           H        VAL  74   6.784   7.973  -3.543
  567    HA   VAL  74           HA       VAL  74   4.400   6.988  -4.918
  568    HB   VAL  74           HB       VAL  74   6.003   5.890  -2.571
  569   HG11  VAL  74          1HG1      VAL  74   4.783   3.781  -2.992
  570   HG12  VAL  74          2HG1      VAL  74   3.666   5.085  -2.527
  571   HG13  VAL  74          3HG1      VAL  74   3.802   4.596  -4.233
  572   HG21  VAL  74          3HG2      VAL  74   7.267   5.977  -4.636
  573   HG22  VAL  74          1HG2      VAL  74   6.865   4.297  -4.212
  574   HG23  VAL  74          2HG2      VAL  74   5.958   5.131  -5.496
  575    H    LEU  75           H        LEU  75   5.020   8.139  -1.602
  576    HA   LEU  75           HA       LEU  75   2.637   6.926  -0.574
  577    HB2  LEU  75           1HB      LEU  75   4.485   9.039   0.245
  578    HB3  LEU  75           2HB      LEU  75   3.103   8.748   1.326
  579    HG   LEU  75           HG       LEU  75   5.306   6.787   0.578
  580   HD11  LEU  75          1HD1      LEU  75   5.801   6.852   3.037
  581   HD12  LEU  75          2HD1      LEU  75   5.940   8.468   2.306
  582   HD13  LEU  75          3HD1      LEU  75   4.494   8.042   3.252
  583   HD21  LEU  75          3HD2      LEU  75   3.175   5.637   0.701
  584   HD22  LEU  75          1HD2      LEU  75   4.181   5.200   2.103
  585   HD23  LEU  75          2HD2      LEU  75   2.843   6.359   2.292
  586    HA   PRO  76           HA       PRO  76   0.821  11.512  -0.996
  587    HB2  PRO  76           2HB      PRO  76   1.707  13.117  -2.550
  588    HB3  PRO  76           1HB      PRO  76   2.220  11.873  -3.697
  589    HG2  PRO  76           1HG      PRO  76   4.277  12.477  -2.665
  590    HG3  PRO  76           2HG      PRO  76   3.530  12.701  -1.078
  591    HD2  PRO  76           1HD      PRO  76   4.279  10.111  -2.479
  592    HD3  PRO  76           2HD      PRO  76   4.368  10.510  -0.759
  593    H    LYS  77           H        LYS  77   1.630   9.435  -3.779
  594    HA   LYS  77           HA       LYS  77  -1.035   9.692  -4.921
  595    HB2  LYS  77           1HB      LYS  77   1.215   7.729  -5.364
  596    HB3  LYS  77           2HB      LYS  77  -0.309   7.728  -6.280
  597    HG2  LYS  77           1HG      LYS  77   0.181   9.987  -7.114
  598    HG3  LYS  77           2HG      LYS  77   1.699  10.005  -6.186
  599    HD2  LYS  77           1HD      LYS  77   2.514   8.076  -7.480
  600    HD3  LYS  77           2HD      LYS  77   0.997   8.057  -8.408
  601    HE2  LYS  77           1HE      LYS  77   1.476  10.327  -9.231
  602    HE3  LYS  77           2HE      LYS  77   2.997  10.336  -8.310
  603    HZ1  LYS  77           3HZ      LYS  77   2.332   8.476 -10.502
  604    HZ2  LYS  77           1HZ      LYS  77   3.356   9.765 -10.614
  605    HZ3  LYS  77           2HZ      LYS  77   3.743   8.484  -9.648
  606    H    VAL  78           H        VAL  78   0.601   7.200  -2.973
  607    HA   VAL  78           HA       VAL  78  -1.547   5.297  -2.969
  608    HB   VAL  78           HB       VAL  78   0.583   5.899  -0.875
  609   HG11  VAL  78          1HG1      VAL  78   0.028   3.670   0.035
  610   HG12  VAL  78          2HG1      VAL  78  -1.370   4.764   0.130
  611   HG13  VAL  78          3HG1      VAL  78  -1.298   3.518  -1.139
  612   HG21  VAL  78          3HG2      VAL  78   1.497   5.186  -3.003
  613   HG22  VAL  78          1HG2      VAL  78   1.685   3.913  -1.774
  614   HG23  VAL  78          2HG2      VAL  78   0.417   3.772  -3.015
  615    H    GLU  79           H        GLU  79  -0.834   7.893  -0.630
  616    HA   GLU  79           HA       GLU  79  -3.099   7.491   1.022
  617    HB2  GLU  79           1HB      GLU  79  -1.249   9.017   1.526
  618    HB3  GLU  79           2HB      GLU  79  -1.779  10.085   0.205
  619    HG2  GLU  79           1HG      GLU  79  -3.955  10.485   1.470
  620    HG3  GLU  79           2HG      GLU  79  -3.290   9.365   2.682
  621    H    ALA  80           H        ALA  80  -2.806   9.399  -1.968
  622    HA   ALA  80           HA       ALA  80  -5.447  10.418  -1.991
  623    HB1  ALA  80           3HB      ALA  80  -3.696   9.609  -4.337
  624    HB2  ALA  80           1HB      ALA  80  -5.135  10.651  -4.425
  625    HB3  ALA  80           2HB      ALA  80  -3.698  11.192  -3.527
  626    H    VAL  81           H        VAL  81  -4.181   7.292  -3.072
  627    HA   VAL  81           HA       VAL  81  -6.492   6.395  -4.508
  628    HB   VAL  81           HB       VAL  81  -4.388   4.855  -2.937
  629   HG11  VAL  81          1HG1      VAL  81  -5.207   2.864  -4.152
  630   HG12  VAL  81          2HG1      VAL  81  -6.479   3.547  -3.111
  631   HG13  VAL  81          3HG1      VAL  81  -6.513   3.837  -4.867
  632   HG21  VAL  81          3HG2      VAL  81  -3.505   6.079  -4.832
  633   HG22  VAL  81          1HG2      VAL  81  -3.487   4.327  -5.146
  634   HG23  VAL  81          2HG2      VAL  81  -4.733   5.354  -5.897
  635    H    PHE  82           H        PHE  82  -5.649   5.904  -1.079
  636    HA   PHE  82           HA       PHE  82  -8.129   4.526  -0.501
  637    HB2  PHE  82           1HB      PHE  82  -6.099   5.928   1.286
  638    HB3  PHE  82           2HB      PHE  82  -7.488   4.997   1.891
  639    HD1  PHE  82           HD1      PHE  82  -4.122   4.884   0.659
  640    HD2  PHE  82           HD2      PHE  82  -7.640   2.561   1.354
  641    HE1  PHE  82           HE1      PHE  82  -2.772   2.815   0.572
  642    HE2  PHE  82           HE2      PHE  82  -6.293   0.490   1.270
  643    HZ   PHE  82           HZ       PHE  82  -3.857   0.618   0.878
  644    H    GLU  83           H        GLU  83  -7.201   7.893  -0.638
  645    HA   GLU  83           HA       GLU  83  -9.821   8.650   0.599
  646    HB2  GLU  83           1HB      GLU  83  -7.395  10.362   0.049
  647    HB3  GLU  83           2HB      GLU  83  -8.859  10.822   0.951
  648    HG2  GLU  83           1HG      GLU  83  -6.741   8.786   1.869
  649    HG3  GLU  83           2HG      GLU  83  -7.075  10.438   2.437
  650    H    LEU  84           H        LEU  84  -9.454   7.660  -2.154
  651    HA   LEU  84           HA       LEU  84  -9.791   9.858  -3.976
  652    HB2  LEU  84           1HB      LEU  84 -10.605   7.042  -3.878
  653    HB3  LEU  84           2HB      LEU  84 -11.051   7.966  -5.331
  654    HG   LEU  84           HG       LEU  84  -8.226   7.452  -4.326
  655   HD11  LEU  84          1HD1      LEU  84  -8.011   6.064  -6.405
  656   HD12  LEU  84          2HD1      LEU  84  -9.291   5.438  -5.339
  657   HD13  LEU  84          3HD1      LEU  84  -9.720   6.391  -6.780
  658   HD21  LEU  84          3HD2      LEU  84  -8.420   9.620  -5.395
  659   HD22  LEU  84          1HD2      LEU  84  -7.507   8.508  -6.441
  660   HD23  LEU  84          2HD2      LEU  84  -9.207   8.883  -6.811
  661    H    GLU  85           H        GLU  85 -12.029   8.131  -1.876
  662    HA   GLU  85           HA       GLU  85 -14.462   9.144  -2.975
  663    HB2  GLU  85           1HB      GLU  85 -14.264   7.322  -1.312
  664    HB3  GLU  85           2HB      GLU  85 -13.809   8.533  -0.089
  665    HG2  GLU  85           1HG      GLU  85 -16.093   9.610  -0.358
  666    HG3  GLU  85           2HG      GLU  85 -16.374   8.385  -1.616
  667    H    HIS  86           H        HIS  86 -15.327  11.046  -3.096
  668    HA   HIS  86           HA       HIS  86 -13.980  13.341  -1.876
  669    HB2  HIS  86           1HB      HIS  86 -15.089  13.335  -4.185
  670    HB3  HIS  86           2HB      HIS  86 -16.652  13.335  -3.333
  671    HD2  HIS  86           HD2      HIS  86 -13.822  15.895  -4.351
  672    HE1  HIS  86           HE1      HIS  86 -16.774  17.861  -2.013
  673    HE2  HIS  86           HE2      HIS  86 -14.651  18.113  -3.542
  674    H    HIS  87           H        HIS  87 -14.785  14.815  -0.423
  675    HA   HIS  87           HA       HIS  87 -16.141  13.850   1.845
  676    HB2  HIS  87           1HB      HIS  87 -14.855  15.993   1.780
  677    HB3  HIS  87           2HB      HIS  87 -16.152  16.717   0.800
  678    HD2  HIS  87           HD2      HIS  87 -15.488  15.712   4.611
  679    HE1  HIS  87           HE1      HIS  87 -19.149  17.833   4.225
  680    HE2  HIS  87           HE2      HIS  87 -17.366  16.800   5.856
  681    H    HIS  88           H        HIS  88 -17.549  15.714  -0.868
  682    HA   HIS  88           HA       HIS  88 -20.185  14.497  -0.139
  683    HB2  HIS  88           1HB      HIS  88 -19.571  16.787  -2.063
  684    HB3  HIS  88           2HB      HIS  88 -21.185  16.191  -1.609
  685    HD2  HIS  88           HD2      HIS  88 -18.708  18.938  -0.468
  686    HE1  HIS  88           HE1      HIS  88 -21.456  18.231   2.692
  687    HE2  HIS  88           HE2      HIS  88 -19.578  19.790   1.715
  688    H    HIS  89           H        HIS  89 -19.049  12.472  -0.924
  689    HA   HIS  89           HA       HIS  89 -18.359  12.191  -3.693
  690    HB2  HIS  89           1HB      HIS  89 -17.636  10.613  -1.866
  691    HB3  HIS  89           2HB      HIS  89 -19.309  10.011  -1.781
  692    HD2  HIS  89           HD2      HIS  89 -19.806   7.852  -3.523
  693    HE1  HIS  89           HE1      HIS  89 -16.357   8.479  -5.925
  694    HE2  HIS  89           HE2      HIS  89 -18.438   6.955  -5.416
  695    H    HIS  90           H        HIS  90 -19.427  11.743  -5.473
  696    HA   HIS  90           HA       HIS  90 -22.227  10.792  -5.315
  697    HB2  HIS  90           1HB      HIS  90 -23.054  12.592  -6.796
  698    HB3  HIS  90           2HB      HIS  90 -22.438  13.274  -5.271
  699    HD2  HIS  90           HD2      HIS  90 -20.182  15.049  -5.565
  700    HE1  HIS  90           HE1      HIS  90 -20.121  14.705  -9.800
  701    HE2  HIS  90           HE2      HIS  90 -19.197  15.955  -7.679
  702    H    HIS  91           H        HIS  91 -23.131  10.326  -7.476
  703    HA   HIS  91           HA       HIS  91 -22.971   9.111  -9.447
  704    HB2  HIS  91           1HB      HIS  91 -20.327  10.618  -9.655
  705    HB3  HIS  91           2HB      HIS  91 -21.005   9.598 -10.946
  706    HD2  HIS  91           HD2      HIS  91 -24.101  11.377  -9.761
  707    HE1  HIS  91           HE1      HIS  91 -22.156  14.057 -12.425
  708    HE2  HIS  91           HE2      HIS  91 -24.362  13.459 -11.125
  Start of MODEL    3
    1    H1   MET   1           1H       MET   1 -11.984   0.578   1.404
    2    H2   MET   1           2H       MET   1 -12.741   0.806   2.679
    3    H3   MET   1           3H       MET   1 -12.366   1.971   1.811
    4    HA   MET   1           HA       MET   1 -10.809   1.003   3.977
    5    HB2  MET   1           1HB      MET   1  -9.520   0.698   1.264
    6    HB3  MET   1           2HB      MET   1  -8.670   0.617   2.826
    7    HG2  MET   1           1HG      MET   1 -10.048  -1.343   3.444
    8    HG3  MET   1           2HG      MET   1 -10.822  -1.281   1.842
    9    HE1  MET   1           3HE      MET   1  -8.697  -0.759  -0.257
   10    HE2  MET   1           1HE      MET   1  -8.056  -2.384  -0.599
   11    HE3  MET   1           2HE      MET   1  -9.802  -2.152  -0.333
   12    H    LYS   2           H        LYS   2 -11.008   3.000   4.796
   13    HA   LYS   2           HA       LYS   2  -9.463   5.134   3.360
   14    HB2  LYS   2           1HB      LYS   2 -11.554   5.307   5.534
   15    HB3  LYS   2           2HB      LYS   2 -10.595   6.680   4.933
   16    HG2  LYS   2           1HG      LYS   2 -11.574   6.410   2.703
   17    HG3  LYS   2           2HG      LYS   2 -12.508   5.007   3.271
   18    HD2  LYS   2           1HD      LYS   2 -12.749   7.709   4.599
   19    HD3  LYS   2           2HD      LYS   2 -13.697   7.304   3.150
   20    HE2  LYS   2           1HE      LYS   2 -14.610   5.330   4.313
   21    HE3  LYS   2           2HE      LYS   2 -13.686   5.770   5.767
   22    HZ1  LYS   2           3HZ      LYS   2 -15.798   7.407   4.518
   23    HZ2  LYS   2           1HZ      LYS   2 -15.962   6.522   5.900
   24    HZ3  LYS   2           2HZ      LYS   2 -14.940   7.817   5.868
   25    H    ILE   3           H        ILE   3  -8.127   6.539   4.630
   26    HA   ILE   3           HA       ILE   3  -6.483   4.802   6.408
   27    HB   ILE   3           HB       ILE   3  -5.918   7.476   5.050
   28   HG12  ILE   3          1HG1      ILE   3  -4.736   4.766   4.521
   29   HG13  ILE   3          2HG1      ILE   3  -6.087   5.475   3.606
   30   HG21  ILE   3          1HG2      ILE   3  -3.597   7.152   5.834
   31   HG22  ILE   3          2HG2      ILE   3  -4.724   7.277   7.205
   32   HG23  ILE   3          3HG2      ILE   3  -4.098   5.687   6.710
   33   HD11  ILE   3          3HD1      ILE   3  -3.289   6.638   3.836
   34   HD12  ILE   3          1HD1      ILE   3  -3.949   5.786   2.421
   35   HD13  ILE   3          2HD1      ILE   3  -4.639   7.349   2.921
   36    H    ILE   4           H        ILE   4  -6.176   5.022   8.471
   37    HA   ILE   4           HA       ILE   4  -7.178   7.503   9.810
   38    HB   ILE   4           HB       ILE   4  -6.095   4.876  10.928
   39   HG12  ILE   4          1HG1      ILE   4  -8.869   6.032  11.039
   40   HG13  ILE   4          2HG1      ILE   4  -8.324   4.791   9.888
   41   HG21  ILE   4          1HG2      ILE   4  -6.760   5.784  13.128
   42   HG22  ILE   4          2HG2      ILE   4  -5.516   6.801  12.367
   43   HG23  ILE   4          3HG2      ILE   4  -7.217   7.322  12.358
   44   HD11  ILE   4          3HD1      ILE   4  -8.369   4.512  12.913
   45   HD12  ILE   4          1HD1      ILE   4  -9.529   3.778  11.782
   46   HD13  ILE   4          2HD1      ILE   4  -7.823   3.272  11.762
   47    H    SER   5           H        SER   5  -4.197   5.536   9.761
   48    HA   SER   5           HA       SER   5  -2.609   8.051   9.448
   49    HB2  SER   5           1HB      SER   5  -1.282   7.820  11.284
   50    HB3  SER   5           2HB      SER   5  -2.980   7.943  11.799
   51    HG   SER   5           HG       SER   5  -1.824   6.324  12.932
   52    H    ILE   6           H        ILE   6  -0.521   7.651   8.705
   53    HA   ILE   6           HA       ILE   6   0.134   4.784   8.062
   54    HB   ILE   6           HB       ILE   6   1.030   7.351   6.670
   55   HG12  ILE   6          1HG1      ILE   6  -0.750   5.138   5.683
   56   HG13  ILE   6          2HG1      ILE   6  -1.297   6.730   6.258
   57   HG21  ILE   6          1HG2      ILE   6   2.111   5.819   5.059
   58   HG22  ILE   6          2HG2      ILE   6   2.778   5.602   6.693
   59   HG23  ILE   6          3HG2      ILE   6   1.611   4.426   6.047
   60   HD11  ILE   6          3HD1      ILE   6   0.509   6.225   3.865
   61   HD12  ILE   6          1HD1      ILE   6  -1.217   6.651   3.796
   62   HD13  ILE   6          2HD1      ILE   6  -0.038   7.818   4.439
   63    H    SER   7           H        SER   7   1.653   3.860   9.101
   64    HA   SER   7           HA       SER   7   3.513   5.567  10.765
   65    HB2  SER   7           1HB      SER   7   2.585   2.786  11.144
   66    HB3  SER   7           2HB      SER   7   3.788   3.658  12.120
   67    HG   SER   7           HG       SER   7   1.681   3.770  13.004
   68    H    GLU   8           H        GLU   8   5.698   4.965  10.922
   69    HA   GLU   8           HA       GLU   8   6.812   3.636   8.521
   70    HB2  GLU   8           1HB      GLU   8   8.113   4.947  10.913
   71    HB3  GLU   8           2HB      GLU   8   8.976   4.270   9.511
   72    HG2  GLU   8           1HG      GLU   8   7.839   6.002   8.034
   73    HG3  GLU   8           2HG      GLU   8   7.012   6.524   9.519
   74    H    THR   9           H        THR   9   8.664   2.133   8.828
   75    HA   THR   9           HA       THR   9   8.193   0.273  11.121
   76    HB   THR   9           HB       THR   9   8.109  -1.647   9.723
   77    HG1  THR   9           HG1      THR   9   8.345  -0.208   7.321
   78   HG21  THR   9          3HG2      THR   9   6.462   0.517   8.358
   79   HG22  THR   9          1HG2      THR   9   6.179  -1.235   8.237
   80   HG23  THR   9          2HG2      THR   9   5.974  -0.405   9.799
   81    HA   PRO  10           HA       PRO  10  12.494  -0.253  11.559
   82    HB2  PRO  10           2HB      PRO  10  12.917  -2.467  12.341
   83    HB3  PRO  10           1HB      PRO  10  12.133  -3.215  10.943
   84    HG2  PRO  10           1HG      PRO  10  10.496  -3.542  12.623
   85    HG3  PRO  10           2HG      PRO  10  10.859  -2.005  13.421
   86    HD2  PRO  10           1HD      PRO  10   9.247  -2.499  10.885
   87    HD3  PRO  10           2HD      PRO  10   8.945  -1.337  12.185
   88    H    ASN  11           H        ASN  11  11.000  -1.794   8.759
   89    HA   ASN  11           HA       ASN  11  13.496  -1.232   7.217
   90    HB2  ASN  11           1HB      ASN  11  12.149  -3.549   6.835
   91    HB3  ASN  11           2HB      ASN  11  10.992  -2.284   6.355
   92   HD21  ASN  11          2HD2      ASN  11  12.106  -4.475   4.804
   93   HD22  ASN  11          1HD2      ASN  11  12.892  -3.753   3.440
   94    H    HIS  12           H        HIS  12  13.733   0.732   6.519
   95    HA   HIS  12           HA       HIS  12  11.733   2.712   6.415
   96    HB2  HIS  12           1HB      HIS  12  14.139   3.255   6.321
   97    HB3  HIS  12           2HB      HIS  12  14.259   2.496   4.716
   98    HD2  HIS  12           HD2      HIS  12  13.792   4.285   2.578
   99    HE1  HIS  12           HE1      HIS  12  12.129   7.353   5.002
  100    HE2  HIS  12           HE2      HIS  12  12.936   6.636   2.605
  101    H    ASN  13           H        ASN  13  12.552   0.267   4.031
  102    HA   ASN  13           HA       ASN  13  11.228   1.732   1.853
  103    HB2  ASN  13           1HB      ASN  13  12.459  -1.125   1.756
  104    HB3  ASN  13           2HB      ASN  13  11.536  -0.091   0.638
  105   HD21  ASN  13          2HD2      ASN  13  14.319  -1.184   0.616
  106   HD22  ASN  13          1HD2      ASN  13  15.332   0.193   0.346
  107    H    THR  14           H        THR  14  10.026   0.110   4.426
  108    HA   THR  14           HA       THR  14   7.534  -0.506   2.878
  109    HB   THR  14           HB       THR  14   8.597  -2.026   5.296
  110    HG1  THR  14           HG1      THR  14   8.710  -3.749   3.738
  111   HG21  THR  14          3HG2      THR  14   6.100  -2.428   3.602
  112   HG22  THR  14          1HG2      THR  14   6.644  -3.490   4.923
  113   HG23  THR  14          2HG2      THR  14   6.135  -1.820   5.274
  114    H    MET  15           H        MET  15   5.675   0.252   3.615
  115    HA   MET  15           HA       MET  15   5.766   1.759   6.212
  116    HB2  MET  15           1HB      MET  15   4.296   2.435   3.664
  117    HB3  MET  15           2HB      MET  15   4.156   3.306   5.210
  118    HG2  MET  15           1HG      MET  15   6.726   3.023   3.627
  119    HG3  MET  15           2HG      MET  15   5.631   4.421   3.511
  120    HE1  MET  15           3HE      MET  15   4.645   4.961   6.400
  121    HE2  MET  15           1HE      MET  15   5.896   6.063   7.023
  122    HE3  MET  15           2HE      MET  15   5.318   6.230   5.346
  123    H    LYS  16           H        LYS  16   3.914   1.852   7.455
  124    HA   LYS  16           HA       LYS  16   1.993  -0.379   6.889
  125    HB2  LYS  16           1HB      LYS  16   3.312  -0.657   8.915
  126    HB3  LYS  16           2HB      LYS  16   2.788   0.944   9.487
  127    HG2  LYS  16           1HG      LYS  16   0.429   0.102   9.488
  128    HG3  LYS  16           2HG      LYS  16   1.054  -1.513   9.086
  129    HD2  LYS  16           1HD      LYS  16   2.360  -1.551  11.155
  130    HD3  LYS  16           2HD      LYS  16   1.808   0.093  11.551
  131    HE2  LYS  16           1HE      LYS  16  -0.516  -0.708  11.638
  132    HE3  LYS  16           2HE      LYS  16   0.037  -2.352  11.249
  133    HZ1  LYS  16           3HZ      LYS  16   0.776  -0.819  13.659
  134    HZ2  LYS  16           1HZ      LYS  16  -0.305  -2.064  13.608
  135    HZ3  LYS  16           2HZ      LYS  16   1.291  -2.345  13.300
  136    H    ILE  17           H        ILE  17  -0.048   0.003   6.541
  137    HA   ILE  17           HA       ILE  17  -1.042   2.806   7.006
  138    HB   ILE  17           HB       ILE  17  -1.842   0.824   4.824
  139   HG12  ILE  17          1HG1      ILE  17  -0.357   3.424   4.560
  140   HG13  ILE  17          2HG1      ILE  17   0.405   1.815   4.573
  141   HG21  ILE  17          1HG2      ILE  17  -3.166   2.715   3.942
  142   HG22  ILE  17          2HG2      ILE  17  -3.700   2.270   5.579
  143   HG23  ILE  17          3HG2      ILE  17  -2.679   3.708   5.336
  144   HD11  ILE  17          3HD1      ILE  17  -1.632   2.805   2.546
  145   HD12  ILE  17          1HD1      ILE  17   0.118   2.647   2.272
  146   HD13  ILE  17          2HD1      ILE  17  -0.872   1.197   2.558
  147    H    THR  18           H        THR  18  -2.422   3.024   8.514
  148    HA   THR  18           HA       THR  18  -4.036   0.692   9.380
  149    HB   THR  18           HB       THR  18  -3.862   3.530  10.480
  150    HG1  THR  18           HG1      THR  18  -2.678   2.433  12.155
  151   HG21  THR  18          3HG2      THR  18  -5.183   1.024  11.598
  152   HG22  THR  18          1HG2      THR  18  -5.053   2.591  12.430
  153   HG23  THR  18          2HG2      THR  18  -6.034   2.448  10.951
  154    H    LEU  19           H        LEU  19  -6.045   0.304   8.893
  155    HA   LEU  19           HA       LEU  19  -7.457   2.348   7.227
  156    HB2  LEU  19           1HB      LEU  19  -7.860  -0.546   7.613
  157    HB3  LEU  19           2HB      LEU  19  -8.813   0.366   6.420
  158    HG   LEU  19           HG       LEU  19  -5.822  -0.189   6.334
  159   HD11  LEU  19          1HD1      LEU  19  -6.404  -1.470   4.257
  160   HD12  LEU  19          2HD1      LEU  19  -7.249  -2.126   5.678
  161   HD13  LEU  19          3HD1      LEU  19  -8.122  -1.091   4.523
  162   HD21  LEU  19          3HD2      LEU  19  -6.301   2.034   5.495
  163   HD22  LEU  19          1HD2      LEU  19  -5.856   0.961   4.148
  164   HD23  LEU  19          2HD2      LEU  19  -7.562   1.390   4.419
  165    H    SER  20           H        SER  20  -9.594   2.856   7.529
  166    HA   SER  20           HA       SER  20 -10.551   2.591  10.367
  167    HB2  SER  20           1HB      SER  20 -11.995   4.318   9.917
  168    HB3  SER  20           2HB      SER  20 -10.334   4.758   9.456
  169    HG   SER  20           HG       SER  20 -11.887   5.397   7.899
  170    H    GLU  21           H        GLU  21 -11.352   1.733   7.015
  171    HA   GLU  21           HA       GLU  21 -14.091   0.905   7.759
  172    HB2  GLU  21           1HB      GLU  21 -12.547   0.834   5.164
  173    HB3  GLU  21           2HB      GLU  21 -14.229   0.286   5.357
  174    HG2  GLU  21           1HG      GLU  21 -13.251   3.178   5.759
  175    HG3  GLU  21           2HG      GLU  21 -14.109   2.454   4.381
  176    H    SER  22           H        SER  22 -14.918  -1.107   7.775
  177    HA   SER  22           HA       SER  22 -13.010  -3.358   8.199
  178    HB2  SER  22           1HB      SER  22 -14.711  -3.079   9.749
  179    HB3  SER  22           2HB      SER  22 -15.948  -3.171   8.477
  180    HG   SER  22           HG       SER  22 -15.047  -5.289   8.006
  181    H    ARG  23           H        ARG  23 -12.182  -4.011   6.227
  182    HA   ARG  23           HA       ARG  23 -13.758  -4.432   3.851
  183    HB2  ARG  23           1HB      ARG  23 -11.361  -4.233   3.819
  184    HB3  ARG  23           2HB      ARG  23 -11.228  -5.784   4.680
  185    HG2  ARG  23           1HG      ARG  23 -12.303  -6.930   2.795
  186    HG3  ARG  23           2HG      ARG  23 -12.458  -5.379   1.935
  187    HD2  ARG  23           1HD      ARG  23 -10.067  -5.188   1.809
  188    HD3  ARG  23           2HD      ARG  23  -9.883  -6.707   2.718
  189    HE   ARG  23           HE       ARG  23 -11.325  -7.223   0.225
  190   HH11  ARG  23          1HH1      ARG  23  -8.122  -6.498   1.397
  191   HH12  ARG  23          2HH1      ARG  23  -7.423  -7.359   0.041
  192   HH21  ARG  23          2HH2      ARG  23  -8.802  -8.334  -1.521
  193   HH22  ARG  23          1HH2      ARG  23 -10.541  -8.206  -1.338
  194    H    GLU  24           H        GLU  24 -14.638  -6.251   2.954
  195    HA   GLU  24           HA       GLU  24 -16.267  -7.869   4.497
  196    HB2  GLU  24           1HB      GLU  24 -16.294  -7.730   2.040
  197    HB3  GLU  24           2HB      GLU  24 -14.807  -8.708   1.987
  198    HG2  GLU  24           1HG      GLU  24 -16.082 -10.643   3.018
  199    HG3  GLU  24           2HG      GLU  24 -17.461  -9.522   3.096
  200    H    GLY  25           H        GLY  25 -12.919  -8.639   3.542
  201    HA2  GLY  25           1HA      GLY  25 -12.945 -10.727   5.687
  202    HA3  GLY  25           2HA      GLY  25 -11.935 -10.803   4.225
  203    H    MET  26           H        MET  26 -11.720 -10.367   7.419
  204    HA   MET  26           HA       MET  26  -9.540  -8.346   7.295
  205    HB2  MET  26           1HB      MET  26 -10.733  -9.986   9.528
  206    HB3  MET  26           2HB      MET  26  -9.334  -8.901   9.719
  207    HG2  MET  26           1HG      MET  26 -12.014  -7.950   8.690
  208    HG3  MET  26           2HG      MET  26 -11.615  -7.988  10.424
  209    HE1  MET  26           3HE      MET  26 -12.016  -5.720   7.624
  210    HE2  MET  26           1HE      MET  26 -10.500  -4.817   7.394
  211    HE3  MET  26           2HE      MET  26 -10.603  -6.523   6.897
  212    H    THR  27           H        THR  27  -9.714 -11.284   6.151
  213    HA   THR  27           HA       THR  27  -7.481 -12.590   7.529
  214    HB   THR  27           HB       THR  27  -7.662 -14.291   5.778
  215    HG1  THR  27           HG1      THR  27  -9.541 -12.498   4.575
  216   HG21  THR  27          3HG2      THR  27 -10.402 -13.330   6.689
  217   HG22  THR  27          1HG2      THR  27 -10.014 -14.966   6.106
  218   HG23  THR  27          2HG2      THR  27  -9.301 -14.369   7.624
  219    H    SER  28           H        SER  28  -5.581 -13.372   6.331
  220    HA   SER  28           HA       SER  28  -4.061 -11.074   5.322
  221    HB2  SER  28           1HB      SER  28  -2.253 -12.462   5.241
  222    HB3  SER  28           2HB      SER  28  -3.137 -12.729   6.760
  223    HG   SER  28           HG       SER  28  -2.469 -14.681   5.765
  224    H    ASP  29           H        ASP  29  -3.297 -10.712   3.275
  225    HA   ASP  29           HA       ASP  29  -3.574 -12.716   1.162
  226    HB2  ASP  29           1HB      ASP  29  -5.883 -11.294   1.365
  227    HB3  ASP  29           2HB      ASP  29  -4.770 -10.109   0.638
  228    H    THR  30           H        THR  30  -2.529 -12.149  -0.795
  229    HA   THR  30           HA       THR  30  -0.508  -9.967  -0.390
  230    HB   THR  30           HB       THR  30  -0.075 -12.700  -1.670
  231    HG1  THR  30           HG1      THR  30   1.336 -12.957   0.161
  232   HG21  THR  30          3HG2      THR  30   1.840 -10.390  -1.154
  233   HG22  THR  30          1HG2      THR  30   2.285 -11.983  -1.811
  234   HG23  THR  30          2HG2      THR  30   1.228 -10.896  -2.746
  235    H    TYR  31           H        TYR  31  -0.206  -8.564  -1.944
  236    HA   TYR  31           HA       TYR  31  -1.505  -9.118  -4.590
  237    HB2  TYR  31           1HB      TYR  31  -1.547  -6.512  -3.056
  238    HB3  TYR  31           2HB      TYR  31  -2.253  -6.817  -4.663
  239    HD1  TYR  31           HD1      TYR  31  -4.032  -8.770  -4.736
  240    HD2  TYR  31           HD2      TYR  31  -2.936  -6.665  -1.194
  241    HE1  TYR  31           HE1      TYR  31  -6.161  -9.461  -3.675
  242    HE2  TYR  31           HE2      TYR  31  -5.056  -7.347  -0.119
  243    HH   TYR  31           HH       TYR  31  -6.943  -9.765  -1.037
  244    H    THR  32           H        THR  32  -0.007  -9.241  -6.054
  245    HA   THR  32           HA       THR  32   2.290  -7.314  -5.886
  246    HB   THR  32           HB       THR  32   3.699  -9.032  -6.939
  247    HG1  THR  32           HG1      THR  32   2.821 -11.177  -7.130
  248   HG21  THR  32          3HG2      THR  32   2.253 -10.079  -4.474
  249   HG22  THR  32          1HG2      THR  32   3.853 -10.606  -5.042
  250   HG23  THR  32          2HG2      THR  32   3.615  -8.937  -4.471
  251    H    LYS  33           H        LYS  33  -0.058  -8.970  -7.902
  252    HA   LYS  33           HA       LYS  33   0.780  -7.193 -10.172
  253    HB2  LYS  33           1HB      LYS  33  -0.232 -10.039 -10.239
  254    HB3  LYS  33           2HB      LYS  33  -0.055  -8.988 -11.664
  255    HG2  LYS  33           1HG      LYS  33   2.377  -8.832 -11.222
  256    HG3  LYS  33           2HG      LYS  33   2.181  -9.936  -9.839
  257    HD2  LYS  33           1HD      LYS  33   1.323 -11.679 -11.364
  258    HD3  LYS  33           2HD      LYS  33   1.552 -10.576 -12.741
  259    HE2  LYS  33           1HE      LYS  33   3.962 -10.483 -12.264
  260    HE3  LYS  33           2HE      LYS  33   3.732 -11.591 -10.891
  261    HZ1  LYS  33           3HZ      LYS  33   3.182 -12.228 -13.719
  262    HZ2  LYS  33           1HZ      LYS  33   4.486 -12.752 -12.854
  263    HZ3  LYS  33           2HZ      LYS  33   2.969 -13.257 -12.445
  264    H    VAL  34           H        VAL  34  -0.727  -6.131 -11.283
  265    HA   VAL  34           HA       VAL  34  -3.246  -5.571  -9.999
  266    HB   VAL  34           HB       VAL  34  -2.309  -5.082 -12.856
  267   HG11  VAL  34          1HG1      VAL  34  -4.178  -3.466 -12.970
  268   HG12  VAL  34          2HG1      VAL  34  -4.776  -5.121 -12.702
  269   HG13  VAL  34          3HG1      VAL  34  -4.710  -3.968 -11.347
  270   HG21  VAL  34          3HG2      VAL  34  -0.961  -3.937 -11.202
  271   HG22  VAL  34          1HG2      VAL  34  -1.972  -2.783 -12.102
  272   HG23  VAL  34          2HG2      VAL  34  -2.425  -3.260 -10.449
  273    H    ASP  35           H        ASP  35  -5.194  -6.324 -10.098
  274    HA   ASP  35           HA       ASP  35  -6.063  -8.141 -12.216
  275    HB2  ASP  35           1HB      ASP  35  -4.575  -9.529 -10.419
  276    HB3  ASP  35           2HB      ASP  35  -6.072  -9.216  -9.503
  277    H    ASP  36           H        ASP  36  -8.246  -8.878 -11.956
  278    HA   ASP  36           HA       ASP  36  -9.897  -6.738 -10.847
  279    HB2  ASP  36           1HB      ASP  36 -10.648  -9.385 -12.227
  280    HB3  ASP  36           2HB      ASP  36 -11.710  -8.142 -11.520
  281    H    SER  37           H        SER  37  -8.757  -9.810  -9.737
  282    HA   SER  37           HA       SER  37 -10.772 -10.364  -7.711
  283    HB2  SER  37           1HB      SER  37  -9.304 -11.871  -6.826
  284    HB3  SER  37           2HB      SER  37  -9.293 -11.998  -8.600
  285    HG   SER  37           HG       SER  37  -7.192 -12.073  -7.692
  286    H    GLN  38           H        GLN  38  -8.316  -7.952  -8.016
  287    HA   GLN  38           HA       GLN  38  -8.047  -7.671  -5.056
  288    HB2  GLN  38           1HB      GLN  38  -6.540  -6.183  -7.202
  289    HB3  GLN  38           2HB      GLN  38  -6.127  -6.360  -5.480
  290    HG2  GLN  38           1HG      GLN  38  -5.631  -8.963  -6.049
  291    HG3  GLN  38           2HG      GLN  38  -6.209  -8.318  -7.603
  292   HE21  GLN  38          2HE2      GLN  38  -3.694  -9.644  -7.065
  293   HE22  GLN  38          1HE2      GLN  38  -2.436  -8.511  -7.433
  294    HA   PRO  39           HA       PRO  39 -10.514  -4.017  -4.709
  295    HB2  PRO  39           2HB      PRO  39  -9.787  -2.988  -2.687
  296    HB3  PRO  39           1HB      PRO  39  -8.097  -2.941  -3.208
  297    HG2  PRO  39           1HG      PRO  39  -8.041  -4.714  -1.641
  298    HG3  PRO  39           2HG      PRO  39  -9.672  -5.262  -2.048
  299    HD2  PRO  39           1HD      PRO  39  -7.078  -5.716  -3.575
  300    HD3  PRO  39           2HD      PRO  39  -8.422  -6.834  -3.316
  301    H    ALA  40           H        ALA  40 -10.832  -2.346  -5.927
  302    HA   ALA  40           HA       ALA  40  -9.182  -1.558  -8.031
  303    HB1  ALA  40           3HB      ALA  40 -11.079   0.182  -6.423
  304    HB2  ALA  40           1HB      ALA  40 -10.448   0.555  -8.043
  305    HB3  ALA  40           2HB      ALA  40 -11.518  -0.846  -7.805
  306    H    PHE  41           H        PHE  41  -9.263  -0.208  -4.730
  307    HA   PHE  41           HA       PHE  41  -7.249   1.761  -5.060
  308    HB2  PHE  41           1HB      PHE  41  -8.040   0.047  -2.672
  309    HB3  PHE  41           2HB      PHE  41  -6.823   1.340  -2.578
  310    HD1  PHE  41           HD1      PHE  41  -8.836   2.677  -4.897
  311    HD2  PHE  41           HD2      PHE  41  -8.978   1.522  -0.786
  312    HE1  PHE  41           HE1      PHE  41 -10.626   4.334  -4.495
  313    HE2  PHE  41           HE2      PHE  41 -10.770   3.176  -0.381
  314    HZ   PHE  41           HZ       PHE  41 -11.593   4.583  -2.237
  315    H    ILE  42           H        ILE  42  -6.909  -1.688  -4.222
  316    HA   ILE  42           HA       ILE  42  -4.037  -1.617  -3.966
  317    HB   ILE  42           HB       ILE  42  -5.961  -3.879  -4.671
  318   HG12  ILE  42          1HG1      ILE  42  -6.272  -2.944  -2.476
  319   HG13  ILE  42          2HG1      ILE  42  -5.637  -4.604  -2.416
  320   HG21  ILE  42          1HG2      ILE  42  -4.074  -5.396  -4.169
  321   HG22  ILE  42          2HG2      ILE  42  -3.701  -4.346  -5.555
  322   HG23  ILE  42          3HG2      ILE  42  -3.001  -3.993  -3.959
  323   HD11  ILE  42          3HD1      ILE  42  -4.021  -2.065  -1.999
  324   HD12  ILE  42          1HD1      ILE  42  -4.559  -3.178  -0.722
  325   HD13  ILE  42          2HD1      ILE  42  -3.385  -3.725  -1.941
  326    H    ASN  43           H        ASN  43  -6.145  -2.103  -6.750
  327    HA   ASN  43           HA       ASN  43  -4.027  -2.834  -8.565
  328    HB2  ASN  43           1HB      ASN  43  -6.809  -1.636  -9.285
  329    HB3  ASN  43           2HB      ASN  43  -5.358  -2.107 -10.203
  330   HD21  ASN  43          2HD2      ASN  43  -8.207  -3.132  -9.968
  331   HD22  ASN  43          1HD2      ASN  43  -8.019  -4.839  -9.739
  332    H    ASP  44           H        ASP  44  -5.610   0.301  -7.913
  333    HA   ASP  44           HA       ASP  44  -4.008   1.861  -9.668
  334    HB2  ASP  44           1HB      ASP  44  -5.329   2.639  -6.999
  335    HB3  ASP  44           2HB      ASP  44  -4.413   3.655  -8.139
  336    H    ILE  45           H        ILE  45  -3.445   0.972  -6.263
  337    HA   ILE  45           HA       ILE  45  -1.027   2.518  -5.985
  338    HB   ILE  45           HB       ILE  45  -2.034   0.035  -4.524
  339   HG12  ILE  45          1HG1      ILE  45  -1.896   2.881  -3.577
  340   HG13  ILE  45          2HG1      ILE  45  -3.319   2.172  -4.373
  341   HG21  ILE  45          1HG2      ILE  45  -0.313   0.556  -2.827
  342   HG22  ILE  45          2HG2      ILE  45   0.431   0.182  -4.399
  343   HG23  ILE  45          3HG2      ILE  45   0.304   1.872  -3.855
  344   HD11  ILE  45          3HD1      ILE  45  -2.058   1.194  -1.787
  345   HD12  ILE  45          1HD1      ILE  45  -3.562   2.136  -1.922
  346   HD13  ILE  45          2HD1      ILE  45  -3.482   0.486  -2.584
  347    H    LEU  46           H        LEU  46  -1.534  -0.885  -6.866
  348    HA   LEU  46           HA       LEU  46   1.212  -1.533  -7.241
  349    HB2  LEU  46           1HB      LEU  46  -1.305  -2.348  -8.519
  350    HB3  LEU  46           2HB      LEU  46   0.183  -3.200  -8.999
  351    HG   LEU  46           HG       LEU  46  -1.003  -3.107  -6.196
  352   HD11  LEU  46          1HD1      LEU  46  -1.445  -5.547  -6.572
  353   HD12  LEU  46          2HD1      LEU  46  -2.309  -4.543  -7.760
  354   HD13  LEU  46          3HD1      LEU  46  -0.814  -5.391  -8.228
  355   HD21  LEU  46          3HD2      LEU  46   1.419  -3.211  -6.154
  356   HD22  LEU  46          1HD2      LEU  46   0.735  -4.771  -5.637
  357   HD23  LEU  46          2HD2      LEU  46   1.408  -4.592  -7.278
  358    H    LYS  47           H        LYS  47  -1.067   0.163  -9.330
  359    HA   LYS  47           HA       LYS  47   0.700   0.118 -11.648
  360    HB2  LYS  47           1HB      LYS  47  -1.744   1.731 -10.919
  361    HB3  LYS  47           2HB      LYS  47  -0.861   1.920 -12.452
  362    HG2  LYS  47           1HG      LYS  47  -1.337  -0.409 -13.036
  363    HG3  LYS  47           2HG      LYS  47  -2.178  -0.639 -11.485
  364    HD2  LYS  47           1HD      LYS  47  -3.827   1.072 -12.123
  365    HD3  LYS  47           2HD      LYS  47  -2.988   1.301 -13.676
  366    HE2  LYS  47           1HE      LYS  47  -3.424  -1.056 -14.249
  367    HE3  LYS  47           2HE      LYS  47  -4.288  -1.264 -12.708
  368    HZ1  LYS  47           3HZ      LYS  47  -5.070   0.575 -14.878
  369    HZ2  LYS  47           1HZ      LYS  47  -5.801  -0.862 -14.529
  370    HZ3  LYS  47           2HZ      LYS  47  -5.871   0.383 -13.450
  371    H    VAL  48           H        VAL  48   0.362   2.138  -8.838
  372    HA   VAL  48           HA       VAL  48   1.814   4.445  -9.797
  373    HB   VAL  48           HB       VAL  48   1.619   3.224  -7.012
  374   HG11  VAL  48          1HG1      VAL  48   2.409   5.432  -6.226
  375   HG12  VAL  48          2HG1      VAL  48   3.627   4.645  -7.257
  376   HG13  VAL  48          3HG1      VAL  48   2.618   5.957  -7.913
  377   HG21  VAL  48          3HG2      VAL  48  -0.531   3.918  -7.888
  378   HG22  VAL  48          1HG2      VAL  48   0.006   5.012  -6.591
  379   HG23  VAL  48          2HG2      VAL  48   0.130   5.522  -8.291
  380    H    GLU  49           H        GLU  49   3.726   4.667 -10.524
  381    HA   GLU  49           HA       GLU  49   5.643   2.548 -10.577
  382    HB2  GLU  49           1HB      GLU  49   5.551   4.445 -12.155
  383    HB3  GLU  49           2HB      GLU  49   6.093   5.525 -10.847
  384    HG2  GLU  49           1HG      GLU  49   8.273   4.214 -10.732
  385    HG3  GLU  49           2HG      GLU  49   7.565   3.195 -12.007
  386    H    GLY  50           H        GLY  50   6.947   1.750  -9.146
  387    HA2  GLY  50           1HA      GLY  50   8.885   2.322  -7.691
  388    HA3  GLY  50           2HA      GLY  50   7.842   3.539  -6.916
  389    H    VAL  51           H        VAL  51   5.501   1.674  -7.087
  390    HA   VAL  51           HA       VAL  51   5.878   0.344  -4.503
  391    HB   VAL  51           HB       VAL  51   3.624   0.180  -6.547
  392   HG11  VAL  51          1HG1      VAL  51   2.316  -0.778  -4.681
  393   HG12  VAL  51          2HG1      VAL  51   3.715  -1.804  -5.076
  394   HG13  VAL  51          3HG1      VAL  51   3.764  -0.742  -3.647
  395   HG21  VAL  51          3HG2      VAL  51   3.898   2.418  -5.662
  396   HG22  VAL  51          1HG2      VAL  51   2.421   1.661  -5.021
  397   HG23  VAL  51          2HG2      VAL  51   3.873   1.785  -3.999
  398    H    LYS  52           H        LYS  52   6.502  -1.566  -3.998
  399    HA   LYS  52           HA       LYS  52   7.334  -3.343  -6.235
  400    HB2  LYS  52           1HB      LYS  52   8.958  -2.735  -4.499
  401    HB3  LYS  52           2HB      LYS  52   7.897  -3.455  -3.266
  402    HG2  LYS  52           1HG      LYS  52   8.176  -5.662  -4.281
  403    HG3  LYS  52           2HG      LYS  52   9.183  -4.960  -5.568
  404    HD2  LYS  52           1HD      LYS  52  10.827  -4.235  -3.870
  405    HD3  LYS  52           2HD      LYS  52   9.827  -4.978  -2.600
  406    HE2  LYS  52           1HE      LYS  52  10.123  -7.175  -3.602
  407    HE3  LYS  52           2HE      LYS  52  11.034  -6.463  -4.954
  408    HZ1  LYS  52           3HZ      LYS  52  11.869  -6.442  -2.124
  409    HZ2  LYS  52           1HZ      LYS  52  12.493  -7.414  -3.302
  410    HZ3  LYS  52           2HZ      LYS  52  12.715  -5.782  -3.378
  411    H    SER  53           H        SER  53   5.731  -3.734  -3.056
  412    HA   SER  53           HA       SER  53   3.792  -5.675  -4.262
  413    HB2  SER  53           1HB      SER  53   4.285  -7.441  -2.889
  414    HB3  SER  53           2HB      SER  53   5.704  -7.013  -3.870
  415    HG   SER  53           HG       SER  53   5.605  -5.791  -1.415
  416    H    ILE  54           H        ILE  54   2.059  -6.152  -2.850
  417    HA   ILE  54           HA       ILE  54   1.883  -4.440  -0.383
  418    HB   ILE  54           HB       ILE  54  -0.355  -5.037  -2.373
  419   HG12  ILE  54          1HG1      ILE  54   0.904  -2.378  -1.778
  420   HG13  ILE  54          2HG1      ILE  54   1.411  -3.429  -3.121
  421   HG21  ILE  54          1HG2      ILE  54  -1.662  -3.473  -0.975
  422   HG22  ILE  54          2HG2      ILE  54  -1.110  -4.873  -0.026
  423   HG23  ILE  54          3HG2      ILE  54  -0.280  -3.307   0.133
  424   HD11  ILE  54          3HD1      ILE  54  -1.370  -2.273  -2.721
  425   HD12  ILE  54          1HD1      ILE  54  -0.163  -1.698  -3.893
  426   HD13  ILE  54          2HD1      ILE  54  -0.864  -3.324  -4.062
  427    H    PHE  55           H        PHE  55   1.166  -5.283   1.407
  428    HA   PHE  55           HA       PHE  55  -0.138  -7.979   1.236
  429    HB2  PHE  55           1HB      PHE  55   2.175  -8.268   2.064
  430    HB3  PHE  55           2HB      PHE  55   1.879  -7.052   3.327
  431    HD1  PHE  55           HD1      PHE  55   0.633 -10.327   2.064
  432    HD2  PHE  55           HD2      PHE  55   1.132  -7.695   5.392
  433    HE1  PHE  55           HE1      PHE  55  -0.163 -12.105   3.587
  434    HE2  PHE  55           HE2      PHE  55   0.340  -9.471   6.918
  435    HZ   PHE  55           HZ       PHE  55  -0.309 -11.676   6.014
  436    H    HIS  56           H        HIS  56  -2.006  -8.180   2.183
  437    HA   HIS  56           HA       HIS  56  -2.816  -6.045   4.131
  438    HB2  HIS  56           1HB      HIS  56  -4.018  -5.861   1.933
  439    HB3  HIS  56           2HB      HIS  56  -4.620  -7.521   2.161
  440    HD2  HIS  56           HD2      HIS  56  -4.924  -5.767   5.580
  441    HE1  HIS  56           HE1      HIS  56  -8.551  -5.134   3.458
  442    HE2  HIS  56           HE2      HIS  56  -7.297  -4.998   5.765
  443    H    VAL  57           H        VAL  57  -3.026  -6.743   6.096
  444    HA   VAL  57           HA       VAL  57  -4.624  -9.240   6.525
  445    HB   VAL  57           HB       VAL  57  -2.181  -9.806   6.848
  446   HG11  VAL  57          1HG1      VAL  57  -1.052  -8.867   8.837
  447   HG12  VAL  57          2HG1      VAL  57  -1.431  -7.593   7.653
  448   HG13  VAL  57          3HG1      VAL  57  -2.436  -7.783   9.110
  449   HG21  VAL  57          3HG2      VAL  57  -3.926 -11.038   7.991
  450   HG22  VAL  57          1HG2      VAL  57  -2.494 -10.859   9.031
  451   HG23  VAL  57          2HG2      VAL  57  -3.930  -9.846   9.311
  452    H    MET  58           H        MET  58  -5.977  -9.257   8.193
  453    HA   MET  58           HA       MET  58  -7.635  -8.135   9.395
  454    HB2  MET  58           1HB      MET  58  -5.169  -6.859  10.580
  455    HB3  MET  58           2HB      MET  58  -6.802  -6.829  11.287
  456    HG2  MET  58           1HG      MET  58  -5.069  -9.279  10.839
  457    HG3  MET  58           2HG      MET  58  -5.405  -8.496  12.402
  458    HE1  MET  58           3HE      MET  58  -8.440  -7.778  12.301
  459    HE2  MET  58           1HE      MET  58  -9.183  -9.250  12.973
  460    HE3  MET  58           2HE      MET  58  -7.678  -8.612  13.677
  461    H    ASP  59           H        ASP  59  -6.472  -5.309  10.436
  462    HA   ASP  59           HA       ASP  59  -8.005  -3.915   8.266
  463    HB2  ASP  59           1HB      ASP  59  -8.823  -2.372  10.029
  464    HB3  ASP  59           2HB      ASP  59  -9.064  -4.104  10.360
  465    H    PHE  60           H        PHE  60  -5.116  -4.424   8.294
  466    HA   PHE  60           HA       PHE  60  -4.379  -1.617   7.698
  467    HB2  PHE  60           1HB      PHE  60  -2.287  -1.714   8.950
  468    HB3  PHE  60           2HB      PHE  60  -3.633  -2.018  10.071
  469    HD1  PHE  60           HD1      PHE  60  -0.691  -3.402   8.432
  470    HD2  PHE  60           HD2      PHE  60  -4.004  -4.220  11.002
  471    HE1  PHE  60           HE1      PHE  60   0.405  -5.488   9.178
  472    HE2  PHE  60           HE2      PHE  60  -2.911  -6.307  11.752
  473    HZ   PHE  60           HZ       PHE  60  -0.706  -6.941  10.839
  474    H    ILE  61           H        ILE  61  -2.550  -1.390   6.354
  475    HA   ILE  61           HA       ILE  61  -1.914  -3.896   4.815
  476    HB   ILE  61           HB       ILE  61  -2.540  -1.112   3.724
  477   HG12  ILE  61          1HG1      ILE  61  -3.947  -3.736   3.303
  478   HG13  ILE  61          2HG1      ILE  61  -4.483  -2.435   4.391
  479   HG21  ILE  61          1HG2      ILE  61  -2.144  -2.129   1.507
  480   HG22  ILE  61          2HG2      ILE  61  -0.678  -2.193   2.511
  481   HG23  ILE  61          3HG2      ILE  61  -1.669  -3.653   2.290
  482   HD11  ILE  61          3HD1      ILE  61  -4.176  -2.216   1.375
  483   HD12  ILE  61          1HD1      ILE  61  -5.713  -2.371   2.258
  484   HD13  ILE  61          2HD1      ILE  61  -4.711  -0.914   2.464
  485    H    SER  62           H        SER  62   0.078  -4.332   4.392
  486    HA   SER  62           HA       SER  62   2.211  -2.320   5.072
  487    HB2  SER  62           1HB      SER  62   2.431  -4.373   6.111
  488    HB3  SER  62           2HB      SER  62   2.339  -5.230   4.554
  489    HG   SER  62           HG       SER  62   4.492  -4.894   5.258
  490    H    VAL  63           H        VAL  63   2.796  -1.025   3.435
  491    HA   VAL  63           HA       VAL  63   2.985  -2.207   0.664
  492    HB   VAL  63           HB       VAL  63   2.501   0.692   1.465
  493   HG11  VAL  63          1HG1      VAL  63   2.184   1.029  -0.963
  494   HG12  VAL  63          2HG1      VAL  63   3.818   0.424  -0.609
  495   HG13  VAL  63          3HG1      VAL  63   2.580  -0.679  -1.252
  496   HG21  VAL  63          3HG2      VAL  63   0.530  -0.649   1.888
  497   HG22  VAL  63          1HG2      VAL  63   0.283   0.409   0.479
  498   HG23  VAL  63          2HG2      VAL  63   0.612  -1.323   0.243
  499    H    ASP  64           H        ASP  64   4.855  -2.432  -0.177
  500    HA   ASP  64           HA       ASP  64   7.105  -0.786   0.934
  501    HB2  ASP  64           1HB      ASP  64   8.544  -2.774   0.968
  502    HB3  ASP  64           2HB      ASP  64   6.982  -3.017   1.788
  503    H    LYS  65           H        LYS  65   8.781  -0.255  -0.424
  504    HA   LYS  65           HA       LYS  65   7.875  -0.206  -3.280
  505    HB2  LYS  65           1HB      LYS  65   9.084   1.844  -3.496
  506    HB3  LYS  65           2HB      LYS  65   7.961   1.954  -2.120
  507    HG2  LYS  65           1HG      LYS  65   9.812   1.605  -0.556
  508    HG3  LYS  65           2HG      LYS  65  10.946   1.432  -1.916
  509    HD2  LYS  65           1HD      LYS  65  10.575   3.722  -2.594
  510    HD3  LYS  65           2HD      LYS  65   9.284   3.914  -1.387
  511    HE2  LYS  65           1HE      LYS  65  11.249   4.959  -0.509
  512    HE3  LYS  65           2HE      LYS  65  10.982   3.453   0.397
  513    HZ1  LYS  65           3HZ      LYS  65  12.904   3.806  -1.814
  514    HZ2  LYS  65           1HZ      LYS  65  13.290   3.728  -0.213
  515    HZ3  LYS  65           2HZ      LYS  65  12.657   2.409  -0.975
  516    H    GLU  66           H        GLU  66   9.810   0.312  -4.792
  517    HA   GLU  66           HA       GLU  66  11.855  -1.782  -4.403
  518    HB2  GLU  66           1HB      GLU  66  11.407   0.257  -6.586
  519    HB3  GLU  66           2HB      GLU  66  12.675  -0.993  -6.593
  520    HG2  GLU  66           1HG      GLU  66  10.778  -2.752  -6.522
  521    HG3  GLU  66           2HG      GLU  66   9.708  -1.335  -6.648
  522    H    ASN  67           H        ASN  67  14.134  -1.335  -4.708
  523    HA   ASN  67           HA       ASN  67  14.997   0.476  -2.658
  524    HB2  ASN  67           1HB      ASN  67  16.791  -0.972  -4.749
  525    HB3  ASN  67           2HB      ASN  67  17.066   0.169  -3.412
  526   HD21  ASN  67          2HD2      ASN  67  17.884  -2.648  -3.850
  527   HD22  ASN  67          1HD2      ASN  67  17.342  -3.501  -2.442
  528    H    ASP  68           H        ASP  68  14.911   0.756  -6.186
  529    HA   ASP  68           HA       ASP  68  16.363   3.263  -6.263
  530    HB2  ASP  68           1HB      ASP  68  14.482   1.951  -8.316
  531    HB3  ASP  68           2HB      ASP  68  15.350   3.503  -8.415
  532    H    ALA  69           H        ALA  69  12.933   2.410  -6.057
  533    HA   ALA  69           HA       ALA  69  11.969   5.069  -6.530
  534    HB1  ALA  69           3HB      ALA  69  10.677   2.761  -5.035
  535    HB2  ALA  69           1HB      ALA  69   9.846   4.227  -5.604
  536    HB3  ALA  69           2HB      ALA  69  10.543   3.089  -6.779
  537    H    ASN  70           H        ASN  70  10.912   6.496  -5.039
  538    HA   ASN  70           HA       ASN  70  11.882   6.236  -2.210
  539    HB2  ASN  70           1HB      ASN  70  11.742   8.992  -3.638
  540    HB3  ASN  70           2HB      ASN  70  12.020   8.363  -1.996
  541   HD21  ASN  70          2HD2      ASN  70  13.333   8.879  -5.145
  542   HD22  ASN  70          1HD2      ASN  70  14.959   8.403  -4.788
  543    H    TRP  71           H        TRP  71  10.568   7.020  -0.591
  544    HA   TRP  71           HA       TRP  71   7.727   6.716  -1.103
  545    HB2  TRP  71           1HB      TRP  71   9.371   7.521   1.319
  546    HB3  TRP  71           2HB      TRP  71   7.592   7.547   1.337
  547    HD1  TRP  71           HD1      TRP  71  10.125   5.584   2.473
  548    HE1  TRP  71           HE1      TRP  71   9.490   2.961   2.640
  549    HE3  TRP  71           HE3      TRP  71   6.050   5.622  -0.565
  550    HZ2  TRP  71           HZ2      TRP  71   7.521   1.344   1.573
  551    HZ3  TRP  71           HZ3      TRP  71   4.826   3.579  -0.980
  552    HH2  TRP  71           HH2      TRP  71   5.495   1.448   0.044
  553    H    GLU  72           H        GLU  72   9.914   9.411  -1.074
  554    HA   GLU  72           HA       GLU  72   8.147  11.554  -0.550
  555    HB2  GLU  72           1HB      GLU  72  10.573  11.762  -0.857
  556    HB3  GLU  72           2HB      GLU  72  10.371  11.410  -2.589
  557    HG2  GLU  72           1HG      GLU  72   9.022  13.549  -2.828
  558    HG3  GLU  72           2HG      GLU  72   9.246  13.725  -1.074
  559    H    THR  73           H        THR  73   8.665   9.768  -3.576
  560    HA   THR  73           HA       THR  73   6.507  11.307  -4.894
  561    HB   THR  73           HB       THR  73   8.129   8.910  -5.849
  562    HG1  THR  73           HG1      THR  73   9.155  10.558  -7.132
  563   HG21  THR  73          3HG2      THR  73   6.242  10.777  -7.341
  564   HG22  THR  73          1HG2      THR  73   7.228   9.489  -8.074
  565   HG23  THR  73          2HG2      THR  73   5.919   9.072  -6.942
  566    H    VAL  74           H        VAL  74   7.058   7.989  -3.700
  567    HA   VAL  74           HA       VAL  74   4.618   6.997  -4.964
  568    HB   VAL  74           HB       VAL  74   6.444   5.796  -2.840
  569   HG11  VAL  74          1HG1      VAL  74   5.300   3.667  -3.363
  570   HG12  VAL  74          2HG1      VAL  74   4.158   4.865  -2.709
  571   HG13  VAL  74          3HG1      VAL  74   4.193   4.530  -4.457
  572   HG21  VAL  74          3HG2      VAL  74   7.551   6.124  -4.971
  573   HG22  VAL  74          1HG2      VAL  74   7.261   4.396  -4.670
  574   HG23  VAL  74          2HG2      VAL  74   6.225   5.285  -5.812
  575    H    LEU  75           H        LEU  75   5.440   7.946  -1.628
  576    HA   LEU  75           HA       LEU  75   3.223   6.484  -0.531
  577    HB2  LEU  75           1HB      LEU  75   5.190   7.023   0.603
  578    HB3  LEU  75           2HB      LEU  75   4.877   8.773   0.671
  579    HG   LEU  75           HG       LEU  75   2.791   8.275   1.980
  580   HD11  LEU  75          1HD1      LEU  75   2.625   6.015   3.055
  581   HD12  LEU  75          2HD1      LEU  75   2.530   5.896   1.283
  582   HD13  LEU  75          3HD1      LEU  75   4.045   5.484   2.123
  583   HD21  LEU  75          3HD2      LEU  75   4.813   9.023   3.090
  584   HD22  LEU  75          1HD2      LEU  75   3.963   7.838   4.110
  585   HD23  LEU  75          2HD2      LEU  75   5.409   7.349   3.193
  586    HA   PRO  76           HA       PRO  76   1.106  10.930  -0.374
  587    HB2  PRO  76           2HB      PRO  76   1.854  12.792  -1.677
  588    HB3  PRO  76           1HB      PRO  76   2.336  11.772  -3.040
  589    HG2  PRO  76           1HG      PRO  76   4.434  12.311  -2.059
  590    HG3  PRO  76           2HG      PRO  76   3.793  12.248  -0.412
  591    HD2  PRO  76           1HD      PRO  76   4.506   9.938  -2.265
  592    HD3  PRO  76           2HD      PRO  76   4.772  10.086  -0.523
  593    H    LYS  77           H        LYS  77   1.950   9.253  -3.399
  594    HA   LYS  77           HA       LYS  77  -0.700   9.555  -4.524
  595    HB2  LYS  77           1HB      LYS  77   1.559   7.634  -5.097
  596    HB3  LYS  77           2HB      LYS  77   0.050   7.720  -6.039
  597    HG2  LYS  77           1HG      LYS  77   0.563  10.040  -6.665
  598    HG3  LYS  77           2HG      LYS  77   2.060   9.974  -5.705
  599    HD2  LYS  77           1HD      LYS  77   2.880   8.135  -7.145
  600    HD3  LYS  77           2HD      LYS  77   1.398   8.255  -8.122
  601    HE2  LYS  77           1HE      LYS  77   1.964  10.576  -8.697
  602    HE3  LYS  77           2HE      LYS  77   3.444  10.459  -7.719
  603    HZ1  LYS  77           3HZ      LYS  77   2.836   8.841 -10.109
  604    HZ2  LYS  77           1HZ      LYS  77   3.890  10.109 -10.052
  605    HZ3  LYS  77           2HZ      LYS  77   4.210   8.731  -9.201
  606    H    VAL  78           H        VAL  78   0.919   6.889  -2.800
  607    HA   VAL  78           HA       VAL  78  -1.274   5.044  -2.846
  608    HB   VAL  78           HB       VAL  78   0.868   5.503  -0.726
  609   HG11  VAL  78          1HG1      VAL  78   0.294   3.223   0.037
  610   HG12  VAL  78          2HG1      VAL  78  -1.098   4.319   0.192
  611   HG13  VAL  78          3HG1      VAL  78  -1.027   3.155  -1.154
  612   HG21  VAL  78          3HG2      VAL  78   1.793   4.921  -2.889
  613   HG22  VAL  78          1HG2      VAL  78   1.965   3.571  -1.744
  614   HG23  VAL  78          2HG2      VAL  78   0.704   3.518  -2.998
  615    H    GLU  79           H        GLU  79  -0.478   7.524  -0.410
  616    HA   GLU  79           HA       GLU  79  -2.729   7.076   1.256
  617    HB2  GLU  79           1HB      GLU  79  -0.831   8.520   1.823
  618    HB3  GLU  79           2HB      GLU  79  -1.351   9.678   0.574
  619    HG2  GLU  79           1HG      GLU  79  -3.499  10.058   1.894
  620    HG3  GLU  79           2HG      GLU  79  -2.846   8.851   3.027
  621    H    ALA  80           H        ALA  80  -2.424   9.105  -1.646
  622    HA   ALA  80           HA       ALA  80  -5.003  10.264  -1.549
  623    HB1  ALA  80           3HB      ALA  80  -3.368   9.456  -3.980
  624    HB2  ALA  80           1HB      ALA  80  -4.748  10.579  -3.981
  625    HB3  ALA  80           2HB      ALA  80  -3.257  11.003  -3.107
  626    H    VAL  81           H        VAL  81  -3.952   7.115  -2.797
  627    HA   VAL  81           HA       VAL  81  -6.286   6.503  -4.332
  628    HB   VAL  81           HB       VAL  81  -4.335   4.694  -2.852
  629   HG11  VAL  81          1HG1      VAL  81  -5.265   2.868  -4.236
  630   HG12  VAL  81          2HG1      VAL  81  -6.508   3.558  -3.165
  631   HG13  VAL  81          3HG1      VAL  81  -6.483   3.986  -4.892
  632   HG21  VAL  81          3HG2      VAL  81  -3.326   5.995  -4.630
  633   HG22  VAL  81          1HG2      VAL  81  -3.426   4.277  -5.082
  634   HG23  VAL  81          2HG2      VAL  81  -4.578   5.446  -5.768
  635    H    PHE  82           H        PHE  82  -5.581   5.756  -0.922
  636    HA   PHE  82           HA       PHE  82  -8.054   4.307  -0.556
  637    HB2  PHE  82           1HB      PHE  82  -6.119   5.586   1.419
  638    HB3  PHE  82           2HB      PHE  82  -7.514   4.588   1.892
  639    HD1  PHE  82           HD1      PHE  82  -4.098   4.623   0.844
  640    HD2  PHE  82           HD2      PHE  82  -7.610   2.205   1.089
  641    HE1  PHE  82           HE1      PHE  82  -2.708   2.589   0.638
  642    HE2  PHE  82           HE2      PHE  82  -6.223   0.167   0.886
  643    HZ   PHE  82           HZ       PHE  82  -3.771   0.361   0.659
  644    H    GLU  83           H        GLU  83  -7.310   7.659  -0.688
  645    HA   GLU  83           HA       GLU  83  -9.759   8.364   0.866
  646    HB2  GLU  83           1HB      GLU  83  -7.539  10.090  -0.243
  647    HB3  GLU  83           2HB      GLU  83  -8.906  10.645   0.752
  648    HG2  GLU  83           1HG      GLU  83  -6.628   8.799   1.689
  649    HG3  GLU  83           2HG      GLU  83  -6.948  10.510   2.053
  650    H    LEU  84           H        LEU  84  -9.170   7.454  -2.162
  651    HA   LEU  84           HA       LEU  84 -10.370   9.572  -3.715
  652    HB2  LEU  84           1HB      LEU  84 -10.050   6.667  -4.028
  653    HB3  LEU  84           2HB      LEU  84 -10.748   7.589  -5.379
  654    HG   LEU  84           HG       LEU  84  -7.952   7.886  -4.214
  655   HD11  LEU  84          1HD1      LEU  84  -7.224   7.107  -6.486
  656   HD12  LEU  84          2HD1      LEU  84  -8.246   5.892  -5.682
  657   HD13  LEU  84          3HD1      LEU  84  -8.932   6.930  -6.955
  658   HD21  LEU  84          3HD2      LEU  84  -8.839  10.043  -4.872
  659   HD22  LEU  84          1HD2      LEU  84  -7.575   9.533  -6.016
  660   HD23  LEU  84          2HD2      LEU  84  -9.291   9.404  -6.470
  661    H    GLU  85           H        GLU  85 -11.669   6.932  -1.817
  662    HA   GLU  85           HA       GLU  85 -14.396   7.354  -2.871
  663    HB2  GLU  85           1HB      GLU  85 -15.050   5.620  -1.384
  664    HB3  GLU  85           2HB      GLU  85 -13.566   5.120  -2.232
  665    HG2  GLU  85           1HG      GLU  85 -12.248   5.751  -0.116
  666    HG3  GLU  85           2HG      GLU  85 -13.846   6.136   0.561
  667    H    HIS  86           H        HIS  86 -12.408   8.861  -0.619
  668    HA   HIS  86           HA       HIS  86 -14.416   9.531   1.368
  669    HB2  HIS  86           1HB      HIS  86 -11.889   9.633   1.714
  670    HB3  HIS  86           2HB      HIS  86 -11.892  11.101   0.708
  671    HD2  HIS  86           HD2      HIS  86 -12.645  10.056   4.436
  672    HE1  HIS  86           HE1      HIS  86 -13.605  14.155   3.873
  673    HE2  HIS  86           HE2      HIS  86 -13.266  12.189   5.584
  674    H    HIS  87           H        HIS  87 -15.453  11.481   1.750
  675    HA   HIS  87           HA       HIS  87 -16.817  12.613  -0.425
  676    HB2  HIS  87           1HB      HIS  87 -17.574  12.907   1.903
  677    HB3  HIS  87           2HB      HIS  87 -16.150  13.917   2.252
  678    HD1  HIS  87           HD1      HIS  87 -19.296  13.925   0.120
  679    HD2  HIS  87           HD2      HIS  87 -16.565  16.672   1.778
  680    HE1  HIS  87           HE1      HIS  87 -20.177  16.145  -0.396
  681    H    HIS  88           H        HIS  88 -13.774  13.666   1.051
  682    HA   HIS  88           HA       HIS  88 -13.547  16.024  -0.641
  683    HB2  HIS  88           1HB      HIS  88 -11.527  14.512   1.073
  684    HB3  HIS  88           2HB      HIS  88 -11.158  16.013   0.189
  685    HD2  HIS  88           HD2      HIS  88 -14.426  17.156   1.359
  686    HE1  HIS  88           HE1      HIS  88 -11.986  17.341   4.831
  687    HE2  HIS  88           HE2      HIS  88 -14.224  18.087   3.671
  688    H    HIS  89           H        HIS  89 -12.686  12.656  -0.953
  689    HA   HIS  89           HA       HIS  89 -11.732  11.482  -2.713
  690    HB2  HIS  89           1HB      HIS  89 -12.217  14.012  -4.347
  691    HB3  HIS  89           2HB      HIS  89 -11.951  12.366  -4.971
  692    HD1  HIS  89           HD1      HIS  89 -13.887  10.597  -3.886
  693    HD2  HIS  89           HD2      HIS  89 -14.942  14.654  -4.325
  694    HE1  HIS  89           HE1      HIS  89 -16.327  10.651  -3.991
  695    H    HIS  90           H        HIS  90 -10.171  12.488  -4.883
  696    HA   HIS  90           HA       HIS  90  -8.052  14.195  -3.937
  697    HB2  HIS  90           1HB      HIS  90  -7.820  11.716  -2.787
  698    HB3  HIS  90           2HB      HIS  90  -6.911  11.474  -4.298
  699    HD2  HIS  90           HD2      HIS  90  -6.227  12.802  -0.749
  700    HE1  HIS  90           HE1      HIS  90  -3.283  14.434  -3.340
  701    HE2  HIS  90           HE2      HIS  90  -4.041  14.011  -0.859
  702    H    HIS  91           H        HIS  91  -5.964  13.655  -5.374
  703    HA   HIS  91           HA       HIS  91  -5.112  13.773  -7.530
  704    HB2  HIS  91           1HB      HIS  91  -7.536  12.029  -8.154
  705    HB3  HIS  91           2HB      HIS  91  -6.227  12.392  -9.304
  706    HD1  HIS  91           HD1      HIS  91  -6.525   9.557  -8.941
  707    HD2  HIS  91           HD2      HIS  91  -4.232  11.769  -6.182
  708    HE1  HIS  91           HE1      HIS  91  -5.104   7.935  -7.791
  Start of MODEL    4
    1    H1   MET   1           1H       MET   1 -13.165   1.130   2.019
    2    H2   MET   1           2H       MET   1 -13.137   1.066   3.518
    3    H3   MET   1           3H       MET   1 -13.263   2.392   2.825
    4    HA   MET   1           HA       MET   1 -10.809   1.219   3.636
    5    HB2  MET   1           1HB      MET   1 -11.237   1.406   0.660
    6    HB3  MET   1           2HB      MET   1  -9.630   1.346   1.423
    7    HG2  MET   1           1HG      MET   1 -10.115  -0.848   2.348
    8    HG3  MET   1           2HG      MET   1 -11.769  -0.785   1.696
    9    HE1  MET   1           3HE      MET   1  -8.040  -1.547   1.047
   10    HE2  MET   1           1HE      MET   1  -7.883  -1.430  -0.722
   11    HE3  MET   1           2HE      MET   1  -8.150   0.039   0.248
   12    H    LYS   2           H        LYS   2 -10.174   2.920   4.716
   13    HA   LYS   2           HA       LYS   2  -9.156   5.185   3.166
   14    HB2  LYS   2           1HB      LYS   2 -10.353   6.909   4.250
   15    HB3  LYS   2           2HB      LYS   2 -11.537   5.784   3.545
   16    HG2  LYS   2           1HG      LYS   2 -11.970   4.807   5.734
   17    HG3  LYS   2           2HG      LYS   2 -10.713   5.832   6.467
   18    HD2  LYS   2           1HD      LYS   2 -11.992   7.844   5.861
   19    HD3  LYS   2           2HD      LYS   2 -13.248   6.823   5.121
   20    HE2  LYS   2           1HE      LYS   2 -13.662   5.761   7.306
   21    HE3  LYS   2           2HE      LYS   2 -12.424   6.802   8.040
   22    HZ1  LYS   2           3HZ      LYS   2 -14.915   7.737   6.767
   23    HZ2  LYS   2           1HZ      LYS   2 -14.636   7.668   8.391
   24    HZ3  LYS   2           2HZ      LYS   2 -13.765   8.705   7.448
   25    H    ILE   3           H        ILE   3  -7.790   6.583   4.360
   26    HA   ILE   3           HA       ILE   3  -6.260   4.949   6.286
   27    HB   ILE   3           HB       ILE   3  -5.744   7.698   5.062
   28   HG12  ILE   3          1HG1      ILE   3  -4.391   5.077   4.495
   29   HG13  ILE   3          2HG1      ILE   3  -5.743   5.733   3.542
   30   HG21  ILE   3          1HG2      ILE   3  -3.458   7.438   5.968
   31   HG22  ILE   3          2HG2      ILE   3  -4.665   7.455   7.274
   32   HG23  ILE   3          3HG2      ILE   3  -3.941   5.915   6.751
   33   HD11  ILE   3          3HD1      ILE   3  -3.038   7.060   3.941
   34   HD12  ILE   3          1HD1      ILE   3  -3.579   6.221   2.469
   35   HD13  ILE   3          2HD1      ILE   3  -4.390   7.717   2.989
   36    H    ILE   4           H        ILE   4  -6.286   5.014   8.366
   37    HA   ILE   4           HA       ILE   4  -7.284   7.499   9.710
   38    HB   ILE   4           HB       ILE   4  -6.632   4.715  10.777
   39   HG12  ILE   4          1HG1      ILE   4  -9.237   6.208  10.616
   40   HG13  ILE   4          2HG1      ILE   4  -8.708   4.918   9.514
   41   HG21  ILE   4          1HG2      ILE   4  -7.437   5.571  12.952
   42   HG22  ILE   4          2HG2      ILE   4  -6.002   6.467  12.403
   43   HG23  ILE   4          3HG2      ILE   4  -7.617   7.194  12.246
   44   HD11  ILE   4          3HD1      ILE   4  -9.177   4.623  12.502
   45   HD12  ILE   4          1HD1      ILE   4 -10.265   4.052  11.216
   46   HD13  ILE   4          2HD1      ILE   4  -8.649   3.332  11.400
   47    H    SER   5           H        SER   5  -4.445   5.378   9.554
   48    HA   SER   5           HA       SER   5  -2.666   7.698  10.099
   49    HB2  SER   5           1HB      SER   5  -3.378   7.314  12.275
   50    HB3  SER   5           2HB      SER   5  -2.960   5.590  12.154
   51    HG   SER   5           HG       SER   5  -1.312   6.836  13.139
   52    H    ILE   6           H        ILE   6  -0.723   7.347   9.193
   53    HA   ILE   6           HA       ILE   6   0.018   4.526   8.452
   54    HB   ILE   6           HB       ILE   6   0.875   7.186   7.221
   55   HG12  ILE   6          1HG1      ILE   6  -0.743   4.924   6.075
   56   HG13  ILE   6          2HG1      ILE   6  -1.385   6.478   6.654
   57   HG21  ILE   6          1HG2      ILE   6   2.118   5.788   5.605
   58   HG22  ILE   6          2HG2      ILE   6   2.715   5.537   7.262
   59   HG23  ILE   6          3HG2      ILE   6   1.651   4.327   6.509
   60   HD11  ILE   6          3HD1      ILE   6   0.560   6.104   4.349
   61   HD12  ILE   6          1HD1      ILE   6  -1.176   6.461   4.199
   62   HD13  ILE   6          2HD1      ILE   6  -0.080   7.660   4.929
   63    H    SER   7           H        SER   7   1.679   3.584   9.262
   64    HA   SER   7           HA       SER   7   3.537   5.222  11.014
   65    HB2  SER   7           1HB      SER   7   2.606   2.437  11.373
   66    HB3  SER   7           2HB      SER   7   3.829   3.302  12.332
   67    HG   SER   7           HG       SER   7   1.743   3.387  13.269
   68    H    GLU   8           H        GLU   8   5.717   4.604  11.054
   69    HA   GLU   8           HA       GLU   8   6.689   3.240   8.601
   70    HB2  GLU   8           1HB      GLU   8   8.123   4.651  10.857
   71    HB3  GLU   8           2HB      GLU   8   8.908   3.925   9.434
   72    HG2  GLU   8           1HG      GLU   8   7.649   5.586   7.962
   73    HG3  GLU   8           2HG      GLU   8   6.935   6.171   9.482
   74    H    THR   9           H        THR   9   8.580   1.769   8.842
   75    HA   THR   9           HA       THR   9   8.192  -0.074  11.168
   76    HB   THR   9           HB       THR   9   8.088  -2.002   9.766
   77    HG1  THR   9           HG1      THR   9   8.145  -0.605   7.347
   78   HG21  THR   9          3HG2      THR   9   6.345   0.150   8.502
   79   HG22  THR   9          1HG2      THR   9   6.081  -1.605   8.381
   80   HG23  THR   9          2HG2      THR   9   5.943  -0.789   9.957
   81    HA   PRO  10           HA       PRO  10  12.499  -0.585  11.496
   82    HB2  PRO  10           2HB      PRO  10  12.947  -2.788  12.293
   83    HB3  PRO  10           1HB      PRO  10  12.124  -3.556  10.927
   84    HG2  PRO  10           1HG      PRO  10  10.531  -3.860  12.655
   85    HG3  PRO  10           2HG      PRO  10  10.919  -2.314  13.425
   86    HD2  PRO  10           1HD      PRO  10   9.233  -2.837  10.945
   87    HD3  PRO  10           2HD      PRO  10   8.975  -1.654  12.234
   88    H    ASN  11           H        ASN  11  10.972  -2.255   8.771
   89    HA   ASN  11           HA       ASN  11  13.395  -1.643   7.139
   90    HB2  ASN  11           1HB      ASN  11  12.069  -3.984   6.829
   91    HB3  ASN  11           2HB      ASN  11  10.881  -2.742   6.370
   92   HD21  ASN  11          2HD2      ASN  11  12.024  -4.949   4.829
   93   HD22  ASN  11          1HD2      ASN  11  12.742  -4.229   3.425
   94    H    HIS  12           H        HIS  12  13.585   0.280   6.313
   95    HA   HIS  12           HA       HIS  12  11.352   2.129   6.426
   96    HB2  HIS  12           1HB      HIS  12  12.935   3.790   5.643
   97    HB3  HIS  12           2HB      HIS  12  13.795   2.744   6.799
   98    HD2  HIS  12           HD2      HIS  12  14.082   3.869   3.030
   99    HE1  HIS  12           HE1      HIS  12  17.007   0.905   3.870
  100    HE2  HIS  12           HE2      HIS  12  16.120   2.701   2.168
  101    H    ASN  13           H        ASN  13  12.204  -0.196   4.174
  102    HA   ASN  13           HA       ASN  13  11.320   1.375   1.818
  103    HB2  ASN  13           1HB      ASN  13  12.305  -1.577   1.858
  104    HB3  ASN  13           2HB      ASN  13  11.613  -0.464   0.652
  105   HD21  ASN  13          2HD2      ASN  13  14.407  -1.528   2.237
  106   HD22  ASN  13          1HD2      ASN  13  15.517  -0.361   1.601
  107    H    THR  14           H        THR  14   9.781  -0.131   4.295
  108    HA   THR  14           HA       THR  14   7.327  -0.287   2.619
  109    HB   THR  14           HB       THR  14   8.094  -2.633   2.856
  110    HG1  THR  14           HG1      THR  14   5.858  -2.034   4.538
  111   HG21  THR  14          3HG2      THR  14   7.853  -2.078   5.840
  112   HG22  THR  14          1HG2      THR  14   8.154  -3.667   5.099
  113   HG23  THR  14          2HG2      THR  14   9.369  -2.374   4.957
  114    H    MET  15           H        MET  15   5.466   0.304   3.587
  115    HA   MET  15           HA       MET  15   5.748   1.374   6.376
  116    HB2  MET  15           1HB      MET  15   4.486   2.679   3.965
  117    HB3  MET  15           2HB      MET  15   4.327   3.261   5.641
  118    HG2  MET  15           1HG      MET  15   6.719   3.675   5.760
  119    HG3  MET  15           2HG      MET  15   6.944   2.994   4.131
  120    HE1  MET  15           3HE      MET  15   5.986   6.062   6.272
  121    HE2  MET  15           1HE      MET  15   5.046   7.084   5.157
  122    HE3  MET  15           2HE      MET  15   4.359   5.554   5.759
  123    H    LYS  16           H        LYS  16   3.847   1.597   7.585
  124    HA   LYS  16           HA       LYS  16   1.842  -0.482   6.801
  125    HB2  LYS  16           1HB      LYS  16   3.066  -0.940   8.842
  126    HB3  LYS  16           2HB      LYS  16   2.621   0.655   9.490
  127    HG2  LYS  16           1HG      LYS  16   0.228  -0.032   9.430
  128    HG3  LYS  16           2HG      LYS  16   0.738  -1.651   8.898
  129    HD2  LYS  16           1HD      LYS  16   1.967  -2.000  10.957
  130    HD3  LYS  16           2HD      LYS  16   1.645  -0.330  11.476
  131    HE2  LYS  16           1HE      LYS  16  -0.766  -0.810  11.536
  132    HE3  LYS  16           2HE      LYS  16  -0.444  -2.482  11.021
  133    HZ1  LYS  16           3HZ      LYS  16   0.505  -1.248  13.527
  134    HZ2  LYS  16           1HZ      LYS  16  -0.737  -2.326  13.399
  135    HZ3  LYS  16           2HZ      LYS  16   0.805  -2.799  13.050
  136    H    ILE  17           H        ILE  17  -0.175  -0.013   6.408
  137    HA   ILE  17           HA       ILE  17  -1.060   2.814   6.934
  138    HB   ILE  17           HB       ILE  17  -1.856   0.958   4.644
  139   HG12  ILE  17          1HG1      ILE  17  -0.203   3.463   4.517
  140   HG13  ILE  17          2HG1      ILE  17   0.470   1.819   4.567
  141   HG21  ILE  17          1HG2      ILE  17  -2.998   2.964   3.759
  142   HG22  ILE  17          2HG2      ILE  17  -3.646   2.509   5.352
  143   HG23  ILE  17          3HG2      ILE  17  -2.518   3.877   5.210
  144   HD11  ILE  17          3HD1      ILE  17  -1.380   2.918   2.422
  145   HD12  ILE  17          1HD1      ILE  17   0.374   2.670   2.257
  146   HD13  ILE  17          2HD1      ILE  17  -0.706   1.271   2.472
  147    H    THR  18           H        THR  18  -2.204   2.763   8.693
  148    HA   THR  18           HA       THR  18  -4.081   0.568   9.228
  149    HB   THR  18           HB       THR  18  -3.706   3.249  10.630
  150    HG1  THR  18           HG1      THR  18  -2.577   1.905  12.156
  151   HG21  THR  18          3HG2      THR  18  -5.169   0.720  11.484
  152   HG22  THR  18          1HG2      THR  18  -4.937   2.176  12.481
  153   HG23  THR  18          2HG2      THR  18  -5.935   2.255  11.010
  154    H    LEU  19           H        LEU  19  -6.067   0.365   8.593
  155    HA   LEU  19           HA       LEU  19  -7.340   2.748   7.294
  156    HB2  LEU  19           1HB      LEU  19  -7.688  -0.155   6.921
  157    HB3  LEU  19           2HB      LEU  19  -8.622   1.006   5.950
  158    HG   LEU  19           HG       LEU  19  -5.613   0.565   5.880
  159   HD11  LEU  19          1HD1      LEU  19  -6.056  -0.155   3.518
  160   HD12  LEU  19          2HD1      LEU  19  -6.937  -1.171   4.680
  161   HD13  LEU  19          3HD1      LEU  19  -7.796   0.102   3.782
  162   HD21  LEU  19          3HD2      LEU  19  -6.133   2.917   5.613
  163   HD22  LEU  19          1HD2      LEU  19  -5.589   2.235   4.061
  164   HD23  LEU  19          2HD2      LEU  19  -7.321   2.540   4.343
  165    H    SER  20           H        SER  20  -9.617   2.975   7.402
  166    HA   SER  20           HA       SER  20 -10.778   2.416  10.053
  167    HB2  SER  20           1HB      SER  20 -11.172   4.457   8.997
  168    HB3  SER  20           2HB      SER  20 -11.948   3.635   7.625
  169    HG   SER  20           HG       SER  20 -12.795   3.535  10.330
  170    H    GLU  21           H        GLU  21 -11.719   1.584   6.684
  171    HA   GLU  21           HA       GLU  21 -12.705  -1.056   7.679
  172    HB2  GLU  21           1HB      GLU  21 -14.192   0.883   5.904
  173    HB3  GLU  21           2HB      GLU  21 -14.646  -0.821   6.156
  174    HG2  GLU  21           1HG      GLU  21 -15.039  -0.321   8.611
  175    HG3  GLU  21           2HG      GLU  21 -14.473   1.322   8.233
  176    H    SER  22           H        SER  22 -11.148  -2.269   6.819
  177    HA   SER  22           HA       SER  22 -10.311  -1.934   3.972
  178    HB2  SER  22           1HB      SER  22  -8.744  -2.348   5.770
  179    HB3  SER  22           2HB      SER  22  -9.436  -3.981   5.910
  180    HG   SER  22           HG       SER  22  -8.049  -2.809   3.757
  181    H    ARG  23           H        ARG  23  -9.835  -4.545   3.325
  182    HA   ARG  23           HA       ARG  23 -12.130  -5.511   2.097
  183    HB2  ARG  23           1HB      ARG  23  -9.977  -6.359   1.599
  184    HB3  ARG  23           2HB      ARG  23  -9.873  -7.125   3.201
  185    HG2  ARG  23           1HG      ARG  23 -11.805  -8.558   2.618
  186    HG3  ARG  23           2HG      ARG  23 -11.841  -7.820   0.997
  187    HD2  ARG  23           1HD      ARG  23  -9.481  -9.294   2.108
  188    HD3  ARG  23           2HD      ARG  23 -10.778 -10.059   1.161
  189    HE   ARG  23           HE       ARG  23  -8.631  -8.376  -0.016
  190   HH11  ARG  23          1HH1      ARG  23 -11.791  -9.768  -0.501
  191   HH12  ARG  23          2HH1      ARG  23 -11.617  -9.574  -2.234
  192   HH21  ARG  23          2HH2      ARG  23  -9.691  -8.655  -3.090
  193   HH22  ARG  23          1HH2      ARG  23  -8.414  -8.154  -1.999
  194    H    GLU  24           H        GLU  24 -13.866  -6.684   2.537
  195    HA   GLU  24           HA       GLU  24 -15.086  -6.733   5.023
  196    HB2  GLU  24           1HB      GLU  24 -16.123  -7.391   2.882
  197    HB3  GLU  24           2HB      GLU  24 -15.222  -8.925   2.948
  198    HG2  GLU  24           1HG      GLU  24 -16.489  -9.555   5.044
  199    HG3  GLU  24           2HG      GLU  24 -17.225  -7.939   4.936
  200    H    GLY  25           H        GLY  25 -13.327  -9.563   3.698
  201    HA2  GLY  25           1HA      GLY  25 -12.925 -10.663   6.369
  202    HA3  GLY  25           2HA      GLY  25 -12.204 -11.249   4.852
  203    H    MET  26           H        MET  26 -11.354 -10.223   7.764
  204    HA   MET  26           HA       MET  26  -9.209  -8.335   6.915
  205    HB2  MET  26           1HB      MET  26 -10.096  -9.298   9.635
  206    HB3  MET  26           2HB      MET  26  -8.810  -8.108   9.322
  207    HG2  MET  26           1HG      MET  26 -11.744  -7.781   8.619
  208    HG3  MET  26           2HG      MET  26 -10.927  -7.041  10.015
  209    HE1  MET  26           3HE      MET  26 -12.120  -4.759   8.943
  210    HE2  MET  26           1HE      MET  26 -11.703  -4.138   7.329
  211    HE3  MET  26           2HE      MET  26 -12.634  -5.648   7.489
  212    H    THR  27           H        THR  27  -9.452 -11.439   6.567
  213    HA   THR  27           HA       THR  27  -7.080 -12.445   7.904
  214    HB   THR  27           HB       THR  27  -7.237 -14.330   6.349
  215    HG1  THR  27           HG1      THR  27  -8.866 -14.241   4.689
  216   HG21  THR  27          3HG2      THR  27  -9.989 -13.394   7.258
  217   HG22  THR  27          1HG2      THR  27  -9.546 -15.066   6.836
  218   HG23  THR  27          2HG2      THR  27  -8.810 -14.280   8.254
  219    H    SER  28           H        SER  28  -5.218 -13.331   6.644
  220    HA   SER  28           HA       SER  28  -3.769 -11.043   5.535
  221    HB2  SER  28           1HB      SER  28  -1.942 -12.400   5.435
  222    HB3  SER  28           2HB      SER  28  -2.788 -12.667   6.977
  223    HG   SER  28           HG       SER  28  -2.107 -14.616   5.987
  224    H    ASP  29           H        ASP  29  -2.866 -10.863   3.472
  225    HA   ASP  29           HA       ASP  29  -3.421 -12.795   1.364
  226    HB2  ASP  29           1HB      ASP  29  -5.623 -11.229   1.710
  227    HB3  ASP  29           2HB      ASP  29  -4.482 -10.119   0.908
  228    H    THR  30           H        THR  30  -2.498 -12.226  -0.674
  229    HA   THR  30           HA       THR  30  -0.291 -10.216  -0.347
  230    HB   THR  30           HB       THR  30  -0.188 -12.903  -1.783
  231    HG1  THR  30           HG1      THR  30   1.352 -13.356  -0.099
  232   HG21  THR  30          3HG2      THR  30   1.943 -10.773  -1.347
  233   HG22  THR  30          1HG2      THR  30   2.200 -12.360  -2.108
  234   HG23  THR  30          2HG2      THR  30   1.155 -11.154  -2.895
  235    H    TYR  31           H        TYR  31  -0.140  -8.688  -1.776
  236    HA   TYR  31           HA       TYR  31  -1.575  -9.054  -4.388
  237    HB2  TYR  31           1HB      TYR  31  -1.445  -6.560  -2.682
  238    HB3  TYR  31           2HB      TYR  31  -2.202  -6.704  -4.287
  239    HD1  TYR  31           HD1      TYR  31  -3.978  -8.747  -4.399
  240    HD2  TYR  31           HD2      TYR  31  -2.889  -6.620  -0.868
  241    HE1  TYR  31           HE1      TYR  31  -6.111  -9.428  -3.340
  242    HE2  TYR  31           HE2      TYR  31  -5.012  -7.290   0.203
  243    HH   TYR  31           HH       TYR  31  -6.915  -9.719  -0.736
  244    H    THR  32           H        THR  32  -0.007  -9.336  -5.794
  245    HA   THR  32           HA       THR  32   2.131  -7.230  -5.868
  246    HB   THR  32           HB       THR  32   3.634  -8.893  -6.876
  247    HG1  THR  32           HG1      THR  32   2.933 -11.112  -6.888
  248   HG21  THR  32          3HG2      THR  32   2.391  -9.890  -4.281
  249   HG22  THR  32          1HG2      THR  32   4.004 -10.321  -4.894
  250   HG23  THR  32          2HG2      THR  32   3.651  -8.642  -4.418
  251    H    LYS  33           H        LYS  33  -0.323  -9.007  -7.550
  252    HA   LYS  33           HA       LYS  33   0.430  -7.564 -10.074
  253    HB2  LYS  33           1HB      LYS  33  -0.985 -10.205  -9.677
  254    HB3  LYS  33           2HB      LYS  33  -0.817  -9.360 -11.236
  255    HG2  LYS  33           1HG      LYS  33   1.656  -9.537 -11.022
  256    HG3  LYS  33           2HG      LYS  33   1.434 -10.472  -9.526
  257    HD2  LYS  33           1HD      LYS  33   0.196 -12.191 -10.770
  258    HD3  LYS  33           2HD      LYS  33   0.391 -11.252 -12.270
  259    HE2  LYS  33           1HE      LYS  33   2.840 -11.462 -12.070
  260    HE3  LYS  33           2HE      LYS  33   2.630 -12.424 -10.590
  261    HZ1  LYS  33           3HZ      LYS  33   1.660 -13.175 -13.273
  262    HZ2  LYS  33           1HZ      LYS  33   2.975 -13.818 -12.514
  263    HZ3  LYS  33           2HZ      LYS  33   1.466 -14.067 -11.899
  264    H    VAL  34           H        VAL  34  -1.241  -6.824 -11.425
  265    HA   VAL  34           HA       VAL  34  -3.633  -5.908  -9.888
  266    HB   VAL  34           HB       VAL  34  -2.616  -5.208 -12.674
  267   HG11  VAL  34          1HG1      VAL  34  -4.329  -3.428 -12.596
  268   HG12  VAL  34          2HG1      VAL  34  -5.076  -5.040 -12.489
  269   HG13  VAL  34          3HG1      VAL  34  -4.897  -4.042 -11.026
  270   HG21  VAL  34          3HG2      VAL  34  -1.160  -4.363 -10.932
  271   HG22  VAL  34          1HG2      VAL  34  -2.066  -3.037 -11.697
  272   HG23  VAL  34          2HG2      VAL  34  -2.553  -3.638 -10.094
  273    H    ASP  35           H        ASP  35  -5.464  -6.850  -9.894
  274    HA   ASP  35           HA       ASP  35  -6.612  -7.917 -12.350
  275    HB2  ASP  35           1HB      ASP  35  -5.014  -9.811 -11.130
  276    HB3  ASP  35           2HB      ASP  35  -6.520  -9.830 -10.180
  277    H    ASP  36           H        ASP  36  -8.685  -9.287 -11.635
  278    HA   ASP  36           HA       ASP  36 -10.374  -7.178 -10.644
  279    HB2  ASP  36           1HB      ASP  36 -10.980 -10.143 -11.209
  280    HB3  ASP  36           2HB      ASP  36 -12.072  -8.869 -10.614
  281    H    SER  37           H        SER  37  -8.956 -10.022  -9.120
  282    HA   SER  37           HA       SER  37 -10.789 -10.117  -6.842
  283    HB2  SER  37           1HB      SER  37  -9.485 -11.758  -5.996
  284    HB3  SER  37           2HB      SER  37  -9.627 -12.012  -7.751
  285    HG   SER  37           HG       SER  37  -7.497 -10.620  -7.535
  286    H    GLN  38           H        GLN  38  -7.906  -8.303  -7.653
  287    HA   GLN  38           HA       GLN  38  -7.351  -7.541  -4.865
  288    HB2  GLN  38           1HB      GLN  38  -6.357  -6.441  -7.503
  289    HB3  GLN  38           2HB      GLN  38  -5.763  -5.968  -5.894
  290    HG2  GLN  38           1HG      GLN  38  -4.072  -7.762  -6.438
  291    HG3  GLN  38           2HG      GLN  38  -5.517  -8.402  -5.621
  292   HE21  GLN  38          2HE2      GLN  38  -3.384  -9.082  -7.966
  293   HE22  GLN  38          1HE2      GLN  38  -4.382  -9.973  -9.067
  294    HA   PRO  39           HA       PRO  39 -10.129  -4.103  -4.463
  295    HB2  PRO  39           2HB      PRO  39  -9.385  -3.051  -2.463
  296    HB3  PRO  39           1HB      PRO  39  -7.720  -2.912  -3.044
  297    HG2  PRO  39           1HG      PRO  39  -7.507  -4.683  -1.488
  298    HG3  PRO  39           2HG      PRO  39  -9.123  -5.316  -1.832
  299    HD2  PRO  39           1HD      PRO  39  -6.571  -5.625  -3.466
  300    HD3  PRO  39           2HD      PRO  39  -7.837  -6.819  -3.150
  301    H    ALA  40           H        ALA  40 -10.567  -2.513  -5.734
  302    HA   ALA  40           HA       ALA  40  -8.995  -1.650  -7.866
  303    HB1  ALA  40           3HB      ALA  40 -10.992  -0.013  -6.265
  304    HB2  ALA  40           1HB      ALA  40 -10.404   0.373  -7.898
  305    HB3  ALA  40           2HB      ALA  40 -11.374  -1.093  -7.625
  306    H    PHE  41           H        PHE  41  -9.113  -0.280  -4.578
  307    HA   PHE  41           HA       PHE  41  -7.188   1.783  -4.966
  308    HB2  PHE  41           1HB      PHE  41  -7.952   0.108  -2.546
  309    HB3  PHE  41           2HB      PHE  41  -6.736   1.403  -2.468
  310    HD1  PHE  41           HD1      PHE  41  -8.971   2.463  -4.861
  311    HD2  PHE  41           HD2      PHE  41  -8.668   1.850  -0.643
  312    HE1  PHE  41           HE1      PHE  41 -10.762   4.126  -4.493
  313    HE2  PHE  41           HE2      PHE  41 -10.462   3.511  -0.272
  314    HZ   PHE  41           HZ       PHE  41 -11.508   4.649  -2.198
  315    H    ILE  42           H        ILE  42  -6.706  -1.611  -3.971
  316    HA   ILE  42           HA       ILE  42  -3.838  -1.503  -3.895
  317    HB   ILE  42           HB       ILE  42  -5.788  -3.771  -4.480
  318   HG12  ILE  42          1HG1      ILE  42  -5.856  -2.864  -2.245
  319   HG13  ILE  42          2HG1      ILE  42  -5.248  -4.535  -2.288
  320   HG21  ILE  42          1HG2      ILE  42  -3.860  -5.295  -4.208
  321   HG22  ILE  42          2HG2      ILE  42  -3.632  -4.219  -5.606
  322   HG23  ILE  42          3HG2      ILE  42  -2.769  -3.895  -4.085
  323   HD11  ILE  42          3HD1      ILE  42  -3.549  -2.032  -1.993
  324   HD12  ILE  42          1HD1      ILE  42  -3.970  -3.165  -0.687
  325   HD13  ILE  42          2HD1      ILE  42  -2.942  -3.704  -2.037
  326    H    ASN  43           H        ASN  43  -6.074  -1.901  -6.578
  327    HA   ASN  43           HA       ASN  43  -4.071  -2.642  -8.514
  328    HB2  ASN  43           1HB      ASN  43  -6.824  -1.312  -9.101
  329    HB3  ASN  43           2HB      ASN  43  -5.445  -1.890 -10.068
  330   HD21  ASN  43          2HD2      ASN  43  -8.283  -2.753  -9.872
  331   HD22  ASN  43          1HD2      ASN  43  -8.217  -4.454  -9.552
  332    H    ASP  44           H        ASP  44  -5.548   0.522  -7.751
  333    HA   ASP  44           HA       ASP  44  -3.900   2.074  -9.480
  334    HB2  ASP  44           1HB      ASP  44  -5.200   2.831  -6.794
  335    HB3  ASP  44           2HB      ASP  44  -4.252   3.843  -7.913
  336    H    ILE  45           H        ILE  45  -3.376   1.100  -6.091
  337    HA   ILE  45           HA       ILE  45  -0.936   2.588  -5.757
  338    HB   ILE  45           HB       ILE  45  -1.977   0.072  -4.382
  339   HG12  ILE  45          1HG1      ILE  45  -1.825   2.889  -3.354
  340   HG13  ILE  45          2HG1      ILE  45  -3.251   2.205  -4.168
  341   HG21  ILE  45          1HG2      ILE  45  -0.265   0.522  -2.658
  342   HG22  ILE  45          2HG2      ILE  45   0.487   0.191  -4.236
  343   HG23  ILE  45          3HG2      ILE  45   0.370   1.864  -3.639
  344   HD11  ILE  45          3HD1      ILE  45  -1.995   1.159  -1.607
  345   HD12  ILE  45          1HD1      ILE  45  -3.495   2.108  -1.719
  346   HD13  ILE  45          2HD1      ILE  45  -3.420   0.475  -2.421
  347    H    LEU  46           H        LEU  46  -1.471  -0.790  -6.723
  348    HA   LEU  46           HA       LEU  46   1.268  -1.448  -7.118
  349    HB2  LEU  46           1HB      LEU  46  -1.258  -2.215  -8.400
  350    HB3  LEU  46           2HB      LEU  46   0.219  -3.058  -8.921
  351    HG   LEU  46           HG       LEU  46  -0.921  -3.038  -6.100
  352   HD11  LEU  46          1HD1      LEU  46  -1.411  -5.458  -6.541
  353   HD12  LEU  46          2HD1      LEU  46  -2.282  -4.405  -7.680
  354   HD13  LEU  46          3HD1      LEU  46  -0.812  -5.261  -8.203
  355   HD21  LEU  46          3HD2      LEU  46   1.499  -3.181  -6.112
  356   HD22  LEU  46          1HD2      LEU  46   0.800  -4.746  -5.628
  357   HD23  LEU  46          2HD2      LEU  46   1.443  -4.528  -7.275
  358    H    LYS  47           H        LYS  47  -1.002   0.303  -9.174
  359    HA   LYS  47           HA       LYS  47   0.785   0.280 -11.484
  360    HB2  LYS  47           1HB      LYS  47  -1.700   1.841 -10.782
  361    HB3  LYS  47           2HB      LYS  47  -0.805   2.045 -12.307
  362    HG2  LYS  47           1HG      LYS  47  -1.243  -0.274 -12.914
  363    HG3  LYS  47           2HG      LYS  47  -2.050  -0.555 -11.354
  364    HD2  LYS  47           1HD      LYS  47  -3.763   1.118 -11.943
  365    HD3  LYS  47           2HD      LYS  47  -2.958   1.385 -13.508
  366    HE2  LYS  47           1HE      LYS  47  -3.327  -0.989 -14.084
  367    HE3  LYS  47           2HE      LYS  47  -4.177  -1.218 -12.537
  368    HZ1  LYS  47           3HZ      LYS  47  -5.016   0.602 -14.702
  369    HZ2  LYS  47           1HZ      LYS  47  -5.709  -0.852 -14.349
  370    HZ3  LYS  47           2HZ      LYS  47  -5.804   0.390 -13.268
  371    H    VAL  48           H        VAL  48   0.425   2.245  -8.653
  372    HA   VAL  48           HA       VAL  48   1.819   4.602  -9.568
  373    HB   VAL  48           HB       VAL  48   1.690   3.285  -6.825
  374   HG11  VAL  48          1HG1      VAL  48   2.504   5.458  -5.972
  375   HG12  VAL  48          2HG1      VAL  48   3.700   4.705  -7.052
  376   HG13  VAL  48          3HG1      VAL  48   2.687   6.046  -7.641
  377   HG21  VAL  48          3HG2      VAL  48  -0.471   4.021  -7.637
  378   HG22  VAL  48          1HG2      VAL  48   0.094   5.062  -6.310
  379   HG23  VAL  48          2HG2      VAL  48   0.191   5.635  -7.992
  380    H    GLU  49           H        GLU  49   3.727   4.930 -10.269
  381    HA   GLU  49           HA       GLU  49   5.672   2.849 -10.501
  382    HB2  GLU  49           1HB      GLU  49   5.524   4.859 -11.934
  383    HB3  GLU  49           2HB      GLU  49   6.085   5.842 -10.561
  384    HG2  GLU  49           1HG      GLU  49   8.277   4.550 -10.589
  385    HG3  GLU  49           2HG      GLU  49   7.552   3.619 -11.919
  386    H    GLY  50           H        GLY  50   6.984   1.959  -9.135
  387    HA2  GLY  50           1HA      GLY  50   8.940   2.437  -7.675
  388    HA3  GLY  50           2HA      GLY  50   7.912   3.604  -6.812
  389    H    VAL  51           H        VAL  51   5.582   1.700  -7.121
  390    HA   VAL  51           HA       VAL  51   5.989   0.269  -4.584
  391    HB   VAL  51           HB       VAL  51   3.686   0.230  -6.580
  392   HG11  VAL  51          1HG1      VAL  51   2.407  -0.793  -4.728
  393   HG12  VAL  51          2HG1      VAL  51   3.784  -1.818  -5.199
  394   HG13  VAL  51          3HG1      VAL  51   3.879  -0.821  -3.728
  395   HG21  VAL  51          3HG2      VAL  51   4.011   2.424  -5.606
  396   HG22  VAL  51          1HG2      VAL  51   2.540   1.658  -4.963
  397   HG23  VAL  51          2HG2      VAL  51   4.015   1.718  -3.971
  398    H    LYS  52           H        LYS  52   6.680  -1.640  -4.208
  399    HA   LYS  52           HA       LYS  52   7.325  -3.346  -6.564
  400    HB2  LYS  52           1HB      LYS  52   9.107  -2.755  -4.979
  401    HB3  LYS  52           2HB      LYS  52   8.182  -3.531  -3.671
  402    HG2  LYS  52           1HG      LYS  52   8.380  -5.700  -4.801
  403    HG3  LYS  52           2HG      LYS  52   9.272  -4.934  -6.135
  404    HD2  LYS  52           1HD      LYS  52  11.044  -4.260  -4.551
  405    HD3  LYS  52           2HD      LYS  52  10.157  -5.059  -3.233
  406    HE2  LYS  52           1HE      LYS  52  10.373  -7.214  -4.359
  407    HE3  LYS  52           2HE      LYS  52  11.198  -6.434  -5.727
  408    HZ1  LYS  52           3HZ      LYS  52  12.205  -6.543  -2.957
  409    HZ2  LYS  52           1HZ      LYS  52  12.758  -7.456  -4.215
  410    HZ3  LYS  52           2HZ      LYS  52  12.971  -5.821  -4.228
  411    H    SER  53           H        SER  53   6.019  -3.791  -3.261
  412    HA   SER  53           HA       SER  53   4.096  -5.852  -4.311
  413    HB2  SER  53           1HB      SER  53   4.754  -7.535  -2.910
  414    HB3  SER  53           2HB      SER  53   6.109  -7.056  -3.958
  415    HG   SER  53           HG       SER  53   6.743  -7.382  -1.782
  416    H    ILE  54           H        ILE  54   2.373  -6.213  -2.926
  417    HA   ILE  54           HA       ILE  54   2.274  -4.551  -0.422
  418    HB   ILE  54           HB       ILE  54  -0.005  -5.109  -2.376
  419   HG12  ILE  54          1HG1      ILE  54   1.286  -2.477  -1.731
  420   HG13  ILE  54          2HG1      ILE  54   1.716  -3.481  -3.134
  421   HG21  ILE  54          1HG2      ILE  54  -1.294  -3.592  -0.911
  422   HG22  ILE  54          2HG2      ILE  54  -0.721  -5.016  -0.011
  423   HG23  ILE  54          3HG2      ILE  54   0.107  -3.451   0.177
  424   HD11  ILE  54          3HD1      ILE  54  -1.027  -2.305  -2.562
  425   HD12  ILE  54          1HD1      ILE  54   0.135  -1.702  -3.766
  426   HD13  ILE  54          2HD1      ILE  54  -0.597  -3.312  -3.966
  427    H    PHE  55           H        PHE  55   1.721  -5.459   1.376
  428    HA   PHE  55           HA       PHE  55   0.392  -8.147   1.214
  429    HB2  PHE  55           1HB      PHE  55   2.680  -8.399   2.081
  430    HB3  PHE  55           2HB      PHE  55   2.379  -7.136   3.295
  431    HD1  PHE  55           HD1      PHE  55   1.116 -10.452   2.158
  432    HD2  PHE  55           HD2      PHE  55   1.665  -7.711   5.388
  433    HE1  PHE  55           HE1      PHE  55   0.328 -12.172   3.750
  434    HE2  PHE  55           HE2      PHE  55   0.879  -9.427   6.983
  435    HZ   PHE  55           HZ       PHE  55   0.209 -11.659   6.163
  436    H    HIS  56           H        HIS  56  -1.498  -8.360   2.110
  437    HA   HIS  56           HA       HIS  56  -2.432  -6.166   3.926
  438    HB2  HIS  56           1HB      HIS  56  -3.768  -6.310   1.868
  439    HB3  HIS  56           2HB      HIS  56  -4.028  -8.050   2.132
  440    HD2  HIS  56           HD2      HIS  56  -5.642  -4.619   3.193
  441    HE1  HIS  56           HE1      HIS  56  -7.516  -7.791   5.311
  442    HE2  HIS  56           HE2      HIS  56  -7.562  -5.241   4.673
  443    H    VAL  57           H        VAL  57  -3.199  -6.560   5.887
  444    HA   VAL  57           HA       VAL  57  -4.182  -9.198   6.689
  445    HB   VAL  57           HB       VAL  57  -1.663  -9.493   6.865
  446   HG11  VAL  57          1HG1      VAL  57  -0.539  -8.333   8.737
  447   HG12  VAL  57          2HG1      VAL  57  -1.111  -7.171   7.517
  448   HG13  VAL  57          3HG1      VAL  57  -2.014  -7.384   9.036
  449   HG21  VAL  57          3HG2      VAL  57  -3.206 -10.832   8.165
  450   HG22  VAL  57          1HG2      VAL  57  -1.750 -10.449   9.112
  451   HG23  VAL  57          2HG2      VAL  57  -3.270  -9.576   9.425
  452    H    MET  58           H        MET  58  -5.241  -9.245   8.620
  453    HA   MET  58           HA       MET  58  -6.886  -8.247   9.938
  454    HB2  MET  58           1HB      MET  58  -4.666  -6.271  10.458
  455    HB3  MET  58           2HB      MET  58  -6.113  -6.538  11.459
  456    HG2  MET  58           1HG      MET  58  -3.875  -8.527  10.968
  457    HG3  MET  58           2HG      MET  58  -4.133  -7.586  12.457
  458    HE1  MET  58           3HE      MET  58  -7.194  -7.640  12.961
  459    HE2  MET  58           1HE      MET  58  -7.385  -9.118  13.934
  460    HE3  MET  58           2HE      MET  58  -5.992  -8.042  14.212
  461    H    ASP  59           H        ASP  59  -6.412  -5.166  10.410
  462    HA   ASP  59           HA       ASP  59  -8.001  -4.360   7.994
  463    HB2  ASP  59           1HB      ASP  59  -9.248  -4.303  10.278
  464    HB3  ASP  59           2HB      ASP  59  -7.941  -3.165  10.690
  465    H    PHE  60           H        PHE  60  -5.239  -4.382   7.842
  466    HA   PHE  60           HA       PHE  60  -4.905  -1.544   7.121
  467    HB2  PHE  60           1HB      PHE  60  -2.788  -1.248   8.285
  468    HB3  PHE  60           2HB      PHE  60  -4.022  -1.693   9.484
  469    HD1  PHE  60           HD1      PHE  60  -1.030  -2.786   7.675
  470    HD2  PHE  60           HD2      PHE  60  -3.944  -3.780  10.637
  471    HE1  PHE  60           HE1      PHE  60   0.409  -4.633   8.468
  472    HE2  PHE  60           HE2      PHE  60  -2.506  -5.626  11.435
  473    HZ   PHE  60           HZ       PHE  60  -0.329  -6.054  10.347
  474    H    ILE  61           H        ILE  61  -2.981  -1.160   5.826
  475    HA   ILE  61           HA       ILE  61  -2.190  -3.638   4.312
  476    HB   ILE  61           HB       ILE  61  -2.744  -0.827   3.258
  477   HG12  ILE  61          1HG1      ILE  61  -4.093  -3.433   2.609
  478   HG13  ILE  61          2HG1      ILE  61  -4.710  -2.223   3.758
  479   HG21  ILE  61          1HG2      ILE  61  -2.182  -1.775   1.046
  480   HG22  ILE  61          2HG2      ILE  61  -0.791  -1.862   2.151
  481   HG23  ILE  61          3HG2      ILE  61  -1.753  -3.321   1.816
  482   HD11  ILE  61          3HD1      ILE  61  -4.232  -1.779   0.790
  483   HD12  ILE  61          1HD1      ILE  61  -5.816  -2.015   1.565
  484   HD13  ILE  61          2HD1      ILE  61  -4.848  -0.568   1.938
  485    H    SER  62           H        SER  62  -0.174  -4.062   3.984
  486    HA   SER  62           HA       SER  62   1.895  -2.030   4.833
  487    HB2  SER  62           1HB      SER  62   1.982  -4.023   6.021
  488    HB3  SER  62           2HB      SER  62   2.079  -4.964   4.515
  489    HG   SER  62           HG       SER  62   4.131  -4.568   5.442
  490    H    VAL  63           H        VAL  63   2.714  -0.870   3.200
  491    HA   VAL  63           HA       VAL  63   2.844  -2.111   0.457
  492    HB   VAL  63           HB       VAL  63   2.782   0.818   1.290
  493   HG11  VAL  63          1HG1      VAL  63   2.636   1.249  -1.139
  494   HG12  VAL  63          2HG1      VAL  63   4.149   0.408  -0.728
  495   HG13  VAL  63          3HG1      VAL  63   2.800  -0.492  -1.459
  496   HG21  VAL  63          3HG2      VAL  63   0.623  -0.237   1.585
  497   HG22  VAL  63          1HG2      VAL  63   0.598   0.875   0.199
  498   HG23  VAL  63          2HG2      VAL  63   0.689  -0.880  -0.073
  499    H    ASP  64           H        ASP  64   4.658  -2.621  -0.384
  500    HA   ASP  64           HA       ASP  64   7.136  -1.440   0.832
  501    HB2  ASP  64           1HB      ASP  64   6.776  -3.965   1.287
  502    HB3  ASP  64           2HB      ASP  64   6.734  -4.047  -0.491
  503    H    LYS  65           H        LYS  65   8.400  -0.309  -0.398
  504    HA   LYS  65           HA       LYS  65   7.797  -0.247  -3.317
  505    HB2  LYS  65           1HB      LYS  65   8.895   1.848  -3.357
  506    HB3  LYS  65           2HB      LYS  65   7.758   1.842  -1.988
  507    HG2  LYS  65           1HG      LYS  65   9.562   1.544  -0.410
  508    HG3  LYS  65           2HG      LYS  65  10.737   1.326  -1.728
  509    HD2  LYS  65           1HD      LYS  65  10.377   3.628  -2.465
  510    HD3  LYS  65           2HD      LYS  65   9.135   3.854  -1.209
  511    HE2  LYS  65           1HE      LYS  65  11.171   4.849  -0.419
  512    HE3  LYS  65           2HE      LYS  65  10.878   3.363   0.515
  513    HZ1  LYS  65           3HZ      LYS  65  12.738   3.618  -1.762
  514    HZ2  LYS  65           1HZ      LYS  65  13.172   3.543  -0.172
  515    HZ3  LYS  65           2HZ      LYS  65  12.466   2.240  -0.896
  516    H    GLU  66           H        GLU  66   9.804   0.390  -4.667
  517    HA   GLU  66           HA       GLU  66  11.829  -1.722  -4.295
  518    HB2  GLU  66           1HB      GLU  66  11.503   0.459  -6.361
  519    HB3  GLU  66           2HB      GLU  66  12.771  -0.790  -6.379
  520    HG2  GLU  66           1HG      GLU  66  10.870  -2.545  -6.525
  521    HG3  GLU  66           2HG      GLU  66   9.814  -1.117  -6.630
  522    H    ASN  67           H        ASN  67  14.115  -1.286  -4.416
  523    HA   ASN  67           HA       ASN  67  14.891   0.507  -2.301
  524    HB2  ASN  67           1HB      ASN  67  16.773  -0.980  -4.286
  525    HB3  ASN  67           2HB      ASN  67  16.991   0.156  -2.933
  526   HD21  ASN  67          2HD2      ASN  67  17.782  -2.675  -3.325
  527   HD22  ASN  67          1HD2      ASN  67  17.144  -3.518  -1.953
  528    H    ASP  68           H        ASP  68  15.045   0.753  -5.834
  529    HA   ASP  68           HA       ASP  68  16.441   3.298  -5.820
  530    HB2  ASP  68           1HB      ASP  68  14.760   1.922  -8.000
  531    HB3  ASP  68           2HB      ASP  68  15.587   3.499  -8.044
  532    H    ALA  69           H        ALA  69  13.031   2.344  -5.869
  533    HA   ALA  69           HA       ALA  69  11.989   4.943  -6.419
  534    HB1  ALA  69           3HB      ALA  69  10.742   2.645  -4.873
  535    HB2  ALA  69           1HB      ALA  69   9.873   4.055  -5.520
  536    HB3  ALA  69           2HB      ALA  69  10.646   2.901  -6.631
  537    H    ASN  70           H        ASN  70  10.867   6.401  -5.030
  538    HA   ASN  70           HA       ASN  70  11.805   6.325  -2.179
  539    HB2  ASN  70           1HB      ASN  70  11.600   8.990  -3.766
  540    HB3  ASN  70           2HB      ASN  70  11.882   8.464  -2.088
  541   HD21  ASN  70          2HD2      ASN  70  13.209   8.857  -5.244
  542   HD22  ASN  70          1HD2      ASN  70  14.845   8.440  -4.853
  543    H    TRP  71           H        TRP  71  10.464   7.240  -0.625
  544    HA   TRP  71           HA       TRP  71   7.627   6.840  -1.140
  545    HB2  TRP  71           1HB      TRP  71   9.215   7.856   1.246
  546    HB3  TRP  71           2HB      TRP  71   7.438   7.783   1.237
  547    HD1  TRP  71           HD1      TRP  71  10.207   5.978   2.310
  548    HE1  TRP  71           HE1      TRP  71   9.658   3.362   2.715
  549    HE3  TRP  71           HE3      TRP  71   5.817   5.747  -0.241
  550    HZ2  TRP  71           HZ2      TRP  71   7.620   1.644   1.984
  551    HZ3  TRP  71           HZ3      TRP  71   4.603   3.662  -0.383
  552    HH2  TRP  71           HH2      TRP  71   5.434   1.613   0.691
  553    H    GLU  72           H        GLU  72   9.782   9.527  -1.366
  554    HA   GLU  72           HA       GLU  72   8.022  11.711  -1.030
  555    HB2  GLU  72           1HB      GLU  72  10.436  11.889  -1.435
  556    HB3  GLU  72           2HB      GLU  72  10.183  11.342  -3.110
  557    HG2  GLU  72           1HG      GLU  72   8.816  13.439  -3.546
  558    HG3  GLU  72           2HG      GLU  72   9.093  13.813  -1.830
  559    H    THR  73           H        THR  73   8.441   9.586  -3.841
  560    HA   THR  73           HA       THR  73   6.245  10.981  -5.257
  561    HB   THR  73           HB       THR  73   7.869   8.514  -6.007
  562    HG1  THR  73           HG1      THR  73   8.829  10.028  -7.487
  563   HG21  THR  73          3HG2      THR  73   5.907  10.186  -7.627
  564   HG22  THR  73          1HG2      THR  73   6.890   8.841  -8.251
  565   HG23  THR  73          2HG2      THR  73   5.623   8.531  -7.041
  566    H    VAL  74           H        VAL  74   6.866   7.785  -3.796
  567    HA   VAL  74           HA       VAL  74   4.370   6.673  -4.813
  568    HB   VAL  74           HB       VAL  74   6.281   5.724  -2.636
  569   HG11  VAL  74          1HG1      VAL  74   5.110   3.558  -2.840
  570   HG12  VAL  74          2HG1      VAL  74   4.001   4.837  -2.289
  571   HG13  VAL  74          3HG1      VAL  74   3.957   4.288  -3.983
  572   HG21  VAL  74          3HG2      VAL  74   7.291   5.780  -4.839
  573   HG22  VAL  74          1HG2      VAL  74   7.011   4.103  -4.314
  574   HG23  VAL  74          2HG2      VAL  74   5.927   4.854  -5.508
  575    H    LEU  75           H        LEU  75   5.319   8.047  -1.673
  576    HA   LEU  75           HA       LEU  75   3.175   6.790  -0.258
  577    HB2  LEU  75           1HB      LEU  75   5.095   7.529   0.752
  578    HB3  LEU  75           2HB      LEU  75   4.866   9.258   0.409
  579    HG   LEU  75           HG       LEU  75   2.769   9.176   1.798
  580   HD11  LEU  75          1HD1      LEU  75   2.528   7.244   3.382
  581   HD12  LEU  75          2HD1      LEU  75   2.409   6.711   1.689
  582   HD13  LEU  75          3HD1      LEU  75   3.916   6.450   2.600
  583   HD21  LEU  75          3HD2      LEU  75   4.832  10.081   2.694
  584   HD22  LEU  75          1HD2      LEU  75   3.949   9.211   3.969
  585   HD23  LEU  75          2HD2      LEU  75   5.364   8.458   3.193
  586    HA   PRO  76           HA       PRO  76   0.856  10.998  -0.522
  587    HB2  PRO  76           2HB      PRO  76   2.267  12.823  -1.094
  588    HB3  PRO  76           1HB      PRO  76   1.587  12.592  -2.711
  589    HG2  PRO  76           1HG      PRO  76   3.416  11.273  -3.442
  590    HG3  PRO  76           2HG      PRO  76   4.223  12.432  -2.376
  591    HD2  PRO  76           1HD      PRO  76   4.587   9.808  -1.943
  592    HD3  PRO  76           2HD      PRO  76   4.335  10.867  -0.549
  593    H    LYS  77           H        LYS  77   1.952   9.443  -3.505
  594    HA   LYS  77           HA       LYS  77  -0.584   9.711  -4.866
  595    HB2  LYS  77           1HB      LYS  77   1.731   7.800  -5.156
  596    HB3  LYS  77           2HB      LYS  77   0.290   7.761  -6.200
  597    HG2  LYS  77           1HG      LYS  77   0.769  10.090  -6.905
  598    HG3  LYS  77           2HG      LYS  77   2.241  10.071  -5.907
  599    HD2  LYS  77           1HD      LYS  77   3.143   8.224  -7.238
  600    HD3  LYS  77           2HD      LYS  77   1.657   8.186  -8.216
  601    HE2  LYS  77           1HE      LYS  77   2.102  10.512  -8.939
  602    HE3  LYS  77           2HE      LYS  77   3.618  10.492  -8.010
  603    HZ1  LYS  77           3HZ      LYS  77   2.970   8.717 -10.275
  604    HZ2  LYS  77           1HZ      LYS  77   3.990  10.012 -10.333
  605    HZ3  LYS  77           2HZ      LYS  77   4.377   8.697  -9.415
  606    H    VAL  78           H        VAL  78   0.832   7.126  -2.865
  607    HA   VAL  78           HA       VAL  78  -1.439   5.352  -2.970
  608    HB   VAL  78           HB       VAL  78   0.656   5.813  -0.806
  609   HG11  VAL  78          1HG1      VAL  78  -0.094   3.639   0.103
  610   HG12  VAL  78          2HG1      VAL  78  -1.408   4.838   0.143
  611   HG13  VAL  78          3HG1      VAL  78  -1.390   3.577  -1.115
  612   HG21  VAL  78          3HG2      VAL  78   1.583   5.012  -2.896
  613   HG22  VAL  78          1HG2      VAL  78   1.635   3.741  -1.654
  614   HG23  VAL  78          2HG2      VAL  78   0.400   3.682  -2.935
  615    H    GLU  79           H        GLU  79  -0.658   7.997  -0.722
  616    HA   GLU  79           HA       GLU  79  -2.959   7.737   0.923
  617    HB2  GLU  79           1HB      GLU  79  -1.058   9.201   1.408
  618    HB3  GLU  79           2HB      GLU  79  -1.514  10.238   0.035
  619    HG2  GLU  79           1HG      GLU  79  -3.705  10.767   1.241
  620    HG3  GLU  79           2HG      GLU  79  -3.089   9.690   2.515
  621    H    ALA  80           H        ALA  80  -2.546   9.472  -2.152
  622    HA   ALA  80           HA       ALA  80  -5.108  10.669  -2.236
  623    HB1  ALA  80           3HB      ALA  80  -3.422   9.612  -4.533
  624    HB2  ALA  80           1HB      ALA  80  -4.784  10.747  -4.679
  625    HB3  ALA  80           2HB      ALA  80  -3.310  11.233  -3.808
  626    H    VAL  81           H        VAL  81  -4.075   7.394  -3.076
  627    HA   VAL  81           HA       VAL  81  -6.428   6.546  -4.471
  628    HB   VAL  81           HB       VAL  81  -4.499   4.993  -2.698
  629   HG11  VAL  81          1HG1      VAL  81  -5.435   2.978  -3.783
  630   HG12  VAL  81          2HG1      VAL  81  -6.682   3.845  -2.858
  631   HG13  VAL  81          3HG1      VAL  81  -6.628   3.989  -4.632
  632   HG21  VAL  81          3HG2      VAL  81  -3.447   5.978  -4.644
  633   HG22  VAL  81          1HG2      VAL  81  -3.564   4.212  -4.816
  634   HG23  VAL  81          2HG2      VAL  81  -4.691   5.267  -5.701
  635    H    PHE  82           H        PHE  82  -5.701   6.413  -0.987
  636    HA   PHE  82           HA       PHE  82  -8.276   5.152  -0.421
  637    HB2  PHE  82           1HB      PHE  82  -6.174   6.400   1.400
  638    HB3  PHE  82           2HB      PHE  82  -7.605   5.503   1.958
  639    HD1  PHE  82           HD1      PHE  82  -4.237   5.300   0.708
  640    HD2  PHE  82           HD2      PHE  82  -7.829   3.092   1.405
  641    HE1  PHE  82           HE1      PHE  82  -2.962   3.187   0.577
  642    HE2  PHE  82           HE2      PHE  82  -6.556   0.978   1.276
  643    HZ   PHE  82           HZ       PHE  82  -4.122   1.025   0.861
  644    H    GLU  83           H        GLU  83  -7.271   8.342  -1.015
  645    HA   GLU  83           HA       GLU  83  -8.991   9.808   0.728
  646    HB2  GLU  83           1HB      GLU  83  -7.144  10.702  -0.715
  647    HB3  GLU  83           2HB      GLU  83  -8.240  10.517  -2.107
  648    HG2  GLU  83           1HG      GLU  83  -9.824  12.182  -1.058
  649    HG3  GLU  83           2HG      GLU  83  -8.719  12.172   0.336
  650    H    LEU  84           H        LEU  84  -9.667   7.966  -2.147
  651    HA   LEU  84           HA       LEU  84 -12.228   9.144  -2.741
  652    HB2  LEU  84           1HB      LEU  84 -11.019   6.492  -3.143
  653    HB3  LEU  84           2HB      LEU  84 -12.595   6.837  -3.893
  654    HG   LEU  84           HG       LEU  84  -9.968   8.262  -4.473
  655   HD11  LEU  84          1HD1      LEU  84 -10.197   7.208  -6.737
  656   HD12  LEU  84          2HD1      LEU  84 -10.098   5.976  -5.458
  657   HD13  LEU  84          3HD1      LEU  84 -11.671   6.379  -6.187
  658   HD21  LEU  84          3HD2      LEU  84 -11.855   9.779  -4.622
  659   HD22  LEU  84          1HD2      LEU  84 -11.227   9.428  -6.251
  660   HD23  LEU  84          2HD2      LEU  84 -12.722   8.642  -5.683
  661    H    GLU  85           H        GLU  85 -11.160   6.875  -0.332
  662    HA   GLU  85           HA       GLU  85 -12.334   5.806   1.373
  663    HB2  GLU  85           1HB      GLU  85 -14.156   8.183   0.965
  664    HB3  GLU  85           2HB      GLU  85 -14.129   7.112   2.387
  665    HG2  GLU  85           1HG      GLU  85 -11.774   7.914   2.901
  666    HG3  GLU  85           2HG      GLU  85 -11.918   8.868   1.407
  667    H    HIS  86           H        HIS  86 -12.758   4.385  -0.726
  668    HA   HIS  86           HA       HIS  86 -15.580   4.047  -1.359
  669    HB2  HIS  86           1HB      HIS  86 -13.111   2.311  -1.756
  670    HB3  HIS  86           2HB      HIS  86 -14.746   1.776  -2.217
  671    HD1  HIS  86           HD1      HIS  86 -13.190   1.740  -4.551
  672    HD2  HIS  86           HD2      HIS  86 -14.689   5.449  -3.227
  673    HE1  HIS  86           HE1      HIS  86 -13.058   3.243  -6.471
  674    H    HIS  87           H        HIS  87 -16.844   3.852   0.391
  675    HA   HIS  87           HA       HIS  87 -16.369   1.412   2.065
  676    HB2  HIS  87           1HB      HIS  87 -18.105   3.873   2.557
  677    HB3  HIS  87           2HB      HIS  87 -18.095   2.426   3.591
  678    HD1  HIS  87           HD1      HIS  87 -15.879   1.939   4.924
  679    HD2  HIS  87           HD2      HIS  87 -15.935   5.697   3.018
  680    HE1  HIS  87           HE1      HIS  87 -14.141   3.270   6.009
  681    H    HIS  88           H        HIS  88 -18.375   2.817  -0.367
  682    HA   HIS  88           HA       HIS  88 -19.922   0.261  -0.399
  683    HB2  HIS  88           1HB      HIS  88 -21.126   3.041  -0.792
  684    HB3  HIS  88           2HB      HIS  88 -21.983   1.491  -0.971
  685    HD2  HIS  88           HD2      HIS  88 -21.164   4.087   1.838
  686    HE1  HIS  88           HE1      HIS  88 -22.700   0.549   3.618
  687    HE2  HIS  88           HE2      HIS  88 -22.035   3.070   3.952
  688    H    HIS  89           H        HIS  89 -18.051  -0.045  -1.927
  689    HA   HIS  89           HA       HIS  89 -18.976   0.613  -4.659
  690    HB2  HIS  89           1HB      HIS  89 -17.420   2.505  -3.899
  691    HB3  HIS  89           2HB      HIS  89 -16.126   1.286  -3.838
  692    HD2  HIS  89           HD2      HIS  89 -17.934   3.552  -6.495
  693    HE1  HIS  89           HE1      HIS  89 -15.344   0.832  -8.478
  694    HE2  HIS  89           HE2      HIS  89 -16.869   2.963  -8.680
  695    H    HIS  90           H        HIS  90 -18.709  -0.981  -6.015
  696    HA   HIS  90           HA       HIS  90 -17.622  -3.486  -5.010
  697    HB2  HIS  90           1HB      HIS  90 -19.607  -3.278  -6.595
  698    HB3  HIS  90           2HB      HIS  90 -18.447  -2.839  -7.870
  699    HD2  HIS  90           HD2      HIS  90 -19.986  -6.062  -6.312
  700    HE1  HIS  90           HE1      HIS  90 -16.594  -7.148  -8.630
  701    HE2  HIS  90           HE2      HIS  90 -18.730  -7.970  -7.335
  702    H    HIS  91           H        HIS  91 -15.632  -4.128  -4.980
  703    HA   HIS  91           HA       HIS  91 -13.743  -3.012  -7.017
  704    HB2  HIS  91           1HB      HIS  91 -13.279  -4.264  -4.278
  705    HB3  HIS  91           2HB      HIS  91 -11.972  -3.944  -5.443
  706    HD1  HIS  91           HD1      HIS  91 -11.332  -2.523  -3.116
  707    HD2  HIS  91           HD2      HIS  91 -14.208  -0.866  -5.713
  708    HE1  HIS  91           HE1      HIS  91 -11.492  -0.160  -2.524
  Start of MODEL    5
    1    H1   MET   1           1H       MET   1 -13.436   1.097   1.484
    2    H2   MET   1           2H       MET   1 -13.818   1.031   2.934
    3    H3   MET   1           3H       MET   1 -13.880   2.338   2.201
    4    HA   MET   1           HA       MET   1 -11.643   1.423   3.688
    5    HB2  MET   1           1HB      MET   1 -11.377   1.350   0.712
    6    HB3  MET   1           2HB      MET   1  -9.992   1.859   1.706
    7    HG2  MET   1           1HG      MET   1  -9.893  -0.248   2.811
    8    HG3  MET   1           2HG      MET   1 -11.465  -0.745   2.144
    9    HE1  MET   1           3HE      MET   1 -11.758  -0.766  -0.670
   10    HE2  MET   1           1HE      MET   1 -10.751  -2.096  -1.290
   11    HE3  MET   1           2HE      MET   1 -11.661  -2.302   0.226
   12    H    LYS   2           H        LYS   2 -11.231   3.143   4.820
   13    HA   LYS   2           HA       LYS   2 -10.411   5.573   3.301
   14    HB2  LYS   2           1HB      LYS   2 -12.715   5.919   4.136
   15    HB3  LYS   2           2HB      LYS   2 -12.127   5.610   5.788
   16    HG2  LYS   2           1HG      LYS   2 -10.758   7.586   5.750
   17    HG3  LYS   2           2HG      LYS   2 -11.082   7.840   4.019
   18    HD2  LYS   2           1HD      LYS   2 -13.416   8.304   4.468
   19    HD3  LYS   2           2HD      LYS   2 -13.208   7.886   6.186
   20    HE2  LYS   2           1HE      LYS   2 -11.731   9.772   6.520
   21    HE3  LYS   2           2HE      LYS   2 -11.758  10.149   4.783
   22    HZ1  LYS   2           3HZ      LYS   2 -14.079  10.275   6.600
   23    HZ2  LYS   2           1HZ      LYS   2 -13.240  11.573   6.023
   24    HZ3  LYS   2           2HZ      LYS   2 -14.103  10.624   4.987
   25    H    ILE   3           H        ILE   3  -8.502   6.279   3.837
   26    HA   ILE   3           HA       ILE   3  -6.964   4.736   5.778
   27    HB   ILE   3           HB       ILE   3  -6.069   5.771   3.590
   28   HG12  ILE   3          1HG1      ILE   3  -4.542   6.479   6.077
   29   HG13  ILE   3          2HG1      ILE   3  -4.746   4.817   5.474
   30   HG21  ILE   3          1HG2      ILE   3  -5.281   8.108   3.768
   31   HG22  ILE   3          2HG2      ILE   3  -7.054   8.017   3.902
   32   HG23  ILE   3          3HG2      ILE   3  -6.063   8.250   5.360
   33   HD11  ILE   3          3HD1      ILE   3  -3.427   7.106   3.971
   34   HD12  ILE   3          1HD1      ILE   3  -2.582   5.760   4.770
   35   HD13  ILE   3          2HD1      ILE   3  -3.632   5.445   3.368
   36    H    ILE   4           H        ILE   4  -6.060   5.251   7.664
   37    HA   ILE   4           HA       ILE   4  -7.096   7.750   8.972
   38    HB   ILE   4           HB       ILE   4  -5.937   5.195  10.176
   39   HG12  ILE   4          1HG1      ILE   4  -8.722   6.314  10.342
   40   HG13  ILE   4          2HG1      ILE   4  -8.204   5.015   9.242
   41   HG21  ILE   4          1HG2      ILE   4  -6.521   6.219  12.349
   42   HG22  ILE   4          2HG2      ILE   4  -5.329   7.209  11.474
   43   HG23  ILE   4          3HG2      ILE   4  -7.038   7.702  11.512
   44   HD11  ILE   4          3HD1      ILE   4  -8.117   4.915  12.278
   45   HD12  ILE   4          1HD1      ILE   4  -9.310   4.098  11.245
   46   HD13  ILE   4          2HD1      ILE   4  -7.598   3.616  11.178
   47    H    SER   5           H        SER   5  -4.131   5.776   8.777
   48    HA   SER   5           HA       SER   5  -2.473   8.239   8.548
   49    HB2  SER   5           1HB      SER   5  -1.270   8.047  10.473
   50    HB3  SER   5           2HB      SER   5  -2.994   8.225  10.872
   51    HG   SER   5           HG       SER   5  -1.950   6.623  12.133
   52    H    ILE   6           H        ILE   6  -0.220   7.714   8.259
   53    HA   ILE   6           HA       ILE   6   0.351   4.811   7.717
   54    HB   ILE   6           HB       ILE   6   1.425   7.244   6.214
   55   HG12  ILE   6          1HG1      ILE   6  -0.401   5.045   5.277
   56   HG13  ILE   6          2HG1      ILE   6  -0.893   6.705   5.683
   57   HG21  ILE   6          1HG2      ILE   6   2.532   5.562   4.781
   58   HG22  ILE   6          2HG2      ILE   6   3.088   5.434   6.465
   59   HG23  ILE   6          3HG2      ILE   6   1.912   4.262   5.825
   60   HD11  ILE   6          3HD1      ILE   6   1.027   5.910   3.466
   61   HD12  ILE   6          1HD1      ILE   6  -0.664   6.415   3.247
   62   HD13  ILE   6          2HD1      ILE   6   0.536   7.571   3.872
   63    H    SER   7           H        SER   7   1.779   3.933   8.910
   64    HA   SER   7           HA       SER   7   3.652   5.709  10.492
   65    HB2  SER   7           1HB      SER   7   3.760   4.047  12.078
   66    HB3  SER   7           2HB      SER   7   2.075   4.525  11.779
   67    HG   SER   7           HG       SER   7   2.339   2.255  11.941
   68    H    GLU   8           H        GLU   8   5.752   4.761  10.977
   69    HA   GLU   8           HA       GLU   8   6.930   3.504   8.558
   70    HB2  GLU   8           1HB      GLU   8   8.159   4.659  11.065
   71    HB3  GLU   8           2HB      GLU   8   9.069   3.976   9.695
   72    HG2  GLU   8           1HG      GLU   8   8.136   5.811   8.208
   73    HG3  GLU   8           2HG      GLU   8   7.224   6.329   9.647
   74    H    THR   9           H        THR   9   8.692   1.898   8.908
   75    HA   THR   9           HA       THR   9   8.033   0.001  11.123
   76    HB   THR   9           HB       THR   9   7.983  -1.887   9.664
   77    HG1  THR   9           HG1      THR   9   8.264  -0.445   7.292
   78   HG21  THR   9          3HG2      THR   9   6.413   0.355   8.331
   79   HG22  THR   9          1HG2      THR   9   6.106  -1.386   8.139
   80   HG23  THR   9          2HG2      THR   9   5.868  -0.609   9.723
   81    HA   PRO  10           HA       PRO  10  12.285  -0.658  11.783
   82    HB2  PRO  10           2HB      PRO  10  12.584  -2.885  12.586
   83    HB3  PRO  10           1HB      PRO  10  11.841  -3.607  11.151
   84    HG2  PRO  10           1HG      PRO  10  10.109  -3.864  12.749
   85    HG3  PRO  10           2HG      PRO  10  10.495  -2.343  13.564
   86    HD2  PRO  10           1HD      PRO  10   8.989  -2.774  10.955
   87    HD3  PRO  10           2HD      PRO  10   8.675  -1.599  12.237
   88    H    ASN  11           H        ASN  11  10.901  -2.241   8.935
   89    HA   ASN  11           HA       ASN  11  13.475  -1.696   7.510
   90    HB2  ASN  11           1HB      ASN  11  12.249  -4.090   7.193
   91    HB3  ASN  11           2HB      ASN  11  11.072  -2.907   6.573
   92   HD21  ASN  11          2HD2      ASN  11  12.372  -5.131   5.223
   93   HD22  ASN  11          1HD2      ASN  11  13.204  -4.455   3.863
   94    H    HIS  12           H        HIS  12  13.687   0.195   6.621
   95    HA   HIS  12           HA       HIS  12  11.404   1.976   6.430
   96    HB2  HIS  12           1HB      HIS  12  13.000   3.648   5.730
   97    HB3  HIS  12           2HB      HIS  12  13.799   2.670   6.983
   98    HD2  HIS  12           HD2      HIS  12  14.349   3.690   3.218
   99    HE1  HIS  12           HE1      HIS  12  17.271   0.826   4.365
  100    HE2  HIS  12           HE2      HIS  12  16.476   2.553   2.549
  101    H    ASN  13           H        ASN  13  12.580  -0.407   4.371
  102    HA   ASN  13           HA       ASN  13  11.904   0.937   1.851
  103    HB2  ASN  13           1HB      ASN  13  12.586  -2.067   2.300
  104    HB3  ASN  13           2HB      ASN  13  12.031  -1.081   0.926
  105   HD21  ASN  13          2HD2      ASN  13  14.493  -2.578   1.252
  106   HD22  ASN  13          1HD2      ASN  13  15.785  -1.438   1.074
  107    H    THR  14           H        THR  14  10.107  -0.433   4.340
  108    HA   THR  14           HA       THR  14   7.726  -0.451   2.532
  109    HB   THR  14           HB       THR  14   8.314  -2.820   2.953
  110    HG1  THR  14           HG1      THR  14   6.124  -2.464   4.646
  111   HG21  THR  14          3HG2      THR  14   7.982  -2.064   5.883
  112   HG22  THR  14          1HG2      THR  14   8.208  -3.712   5.255
  113   HG23  THR  14          2HG2      THR  14   9.512  -2.511   5.092
  114    H    MET  15           H        MET  15   5.807   0.201   3.403
  115    HA   MET  15           HA       MET  15   6.063   1.550   6.076
  116    HB2  MET  15           1HB      MET  15   4.539   2.411   3.617
  117    HB3  MET  15           2HB      MET  15   4.475   3.208   5.208
  118    HG2  MET  15           1HG      MET  15   7.002   2.899   3.565
  119    HG3  MET  15           2HG      MET  15   5.951   4.333   3.501
  120    HE1  MET  15           3HE      MET  15   5.015   4.865   6.392
  121    HE2  MET  15           1HE      MET  15   6.318   5.894   7.031
  122    HE3  MET  15           2HE      MET  15   5.744   6.120   5.361
  123    H    LYS  16           H        LYS  16   4.203   1.750   7.349
  124    HA   LYS  16           HA       LYS  16   2.229  -0.443   6.832
  125    HB2  LYS  16           1HB      LYS  16   3.570  -0.645   8.875
  126    HB3  LYS  16           2HB      LYS  16   2.996   0.956   9.398
  127    HG2  LYS  16           1HG      LYS  16   0.673   0.078   9.434
  128    HG3  LYS  16           2HG      LYS  16   1.299  -1.531   9.003
  129    HD2  LYS  16           1HD      LYS  16   2.646  -1.562  11.062
  130    HD3  LYS  16           2HD      LYS  16   2.025   0.047  11.494
  131    HE2  LYS  16           1HE      LYS  16  -0.259  -0.848  11.574
  132    HE3  LYS  16           2HE      LYS  16   0.354  -2.458  11.130
  133    HZ1  LYS  16           3HZ      LYS  16   1.047  -0.975  13.584
  134    HZ2  LYS  16           1HZ      LYS  16   0.012  -2.256  13.499
  135    HZ3  LYS  16           2HZ      LYS  16   1.616  -2.468  13.174
  136    H    ILE  17           H        ILE  17   0.206  -0.031   6.433
  137    HA   ILE  17           HA       ILE  17  -0.736   2.804   6.798
  138    HB   ILE  17           HB       ILE  17  -1.565   0.749   4.697
  139   HG12  ILE  17          1HG1      ILE  17  -0.072   3.325   4.300
  140   HG13  ILE  17          2HG1      ILE  17   0.705   1.731   4.444
  141   HG21  ILE  17          1HG2      ILE  17  -2.860   2.622   3.735
  142   HG22  ILE  17          2HG2      ILE  17  -3.403   2.251   5.388
  143   HG23  ILE  17          3HG2      ILE  17  -2.363   3.661   5.090
  144   HD11  ILE  17          3HD1      ILE  17  -1.304   2.542   2.314
  145   HD12  ILE  17          1HD1      ILE  17   0.451   2.386   2.083
  146   HD13  ILE  17          2HD1      ILE  17  -0.528   0.948   2.460
  147    H    THR  18           H        THR  18  -2.245   3.181   8.144
  148    HA   THR  18           HA       THR  18  -3.899   0.881   9.096
  149    HB   THR  18           HB       THR  18  -3.495   3.661  10.278
  150    HG1  THR  18           HG1      THR  18  -2.363   2.426  11.893
  151   HG21  THR  18          3HG2      THR  18  -4.978   1.227  11.347
  152   HG22  THR  18          1HG2      THR  18  -4.714   2.753  12.225
  153   HG23  THR  18          2HG2      THR  18  -5.731   2.730  10.763
  154    H    LEU  19           H        LEU  19  -5.853   0.594   8.420
  155    HA   LEU  19           HA       LEU  19  -7.277   2.935   7.199
  156    HB2  LEU  19           1HB      LEU  19  -7.638   0.030   6.848
  157    HB3  LEU  19           2HB      LEU  19  -8.538   1.213   5.870
  158    HG   LEU  19           HG       LEU  19  -5.547   0.660   5.784
  159   HD11  LEU  19          1HD1      LEU  19  -6.034  -0.053   3.428
  160   HD12  LEU  19          2HD1      LEU  19  -6.949  -1.027   4.601
  161   HD13  LEU  19          3HD1      LEU  19  -7.761   0.276   3.702
  162   HD21  LEU  19          3HD2      LEU  19  -5.976   3.029   5.509
  163   HD22  LEU  19          1HD2      LEU  19  -5.470   2.321   3.958
  164   HD23  LEU  19          2HD2      LEU  19  -7.187   2.695   4.248
  165    H    SER  20           H        SER  20  -9.393   3.348   7.652
  166    HA   SER  20           HA       SER  20 -10.533   2.334  10.185
  167    HB2  SER  20           1HB      SER  20 -12.288   3.747   9.815
  168    HB3  SER  20           2HB      SER  20 -10.758   4.600   9.505
  169    HG   SER  20           HG       SER  20 -12.514   4.926   7.949
  170    H    GLU  21           H        GLU  21 -11.146   1.979   6.669
  171    HA   GLU  21           HA       GLU  21 -12.583  -0.572   7.321
  172    HB2  GLU  21           1HB      GLU  21 -13.186   1.415   5.125
  173    HB3  GLU  21           2HB      GLU  21 -13.904  -0.208   5.268
  174    HG2  GLU  21           1HG      GLU  21 -14.930   0.525   7.500
  175    HG3  GLU  21           2HG      GLU  21 -14.150   2.088   7.167
  176    H    SER  22           H        SER  22 -12.394  -2.262   5.836
  177    HA   SER  22           HA       SER  22  -9.846  -2.128   4.190
  178    HB2  SER  22           1HB      SER  22  -9.324  -4.237   4.749
  179    HB3  SER  22           2HB      SER  22  -9.697  -3.376   6.259
  180    HG   SER  22           HG       SER  22 -11.554  -5.014   4.886
  181    H    ARG  23           H        ARG  23  -9.889  -4.223   2.708
  182    HA   ARG  23           HA       ARG  23 -12.131  -4.358   0.948
  183    HB2  ARG  23           1HB      ARG  23 -11.278  -6.334   0.102
  184    HB3  ARG  23           2HB      ARG  23  -9.935  -5.214   0.422
  185    HG2  ARG  23           1HG      ARG  23  -9.376  -6.461   2.464
  186    HG3  ARG  23           2HG      ARG  23 -10.728  -7.579   2.151
  187    HD2  ARG  23           1HD      ARG  23  -9.655  -8.339   0.141
  188    HD3  ARG  23           2HD      ARG  23  -8.323  -7.186   0.396
  189    HE   ARG  23           HE       ARG  23  -7.420  -8.778   2.055
  190   HH11  ARG  23          1HH1      ARG  23 -10.660  -9.710   1.169
  191   HH12  ARG  23          2HH1      ARG  23 -10.436 -11.259   1.955
  192   HH21  ARG  23          2HH2      ARG  23  -8.435 -11.737   2.981
  193   HH22  ARG  23          1HH2      ARG  23  -7.150 -10.546   2.968
  194    H    GLU  24           H        GLU  24 -13.391  -6.443   0.621
  195    HA   GLU  24           HA       GLU  24 -15.426  -6.553   2.497
  196    HB2  GLU  24           1HB      GLU  24 -15.469  -7.584   0.260
  197    HB3  GLU  24           2HB      GLU  24 -14.399  -8.875   0.857
  198    HG2  GLU  24           1HG      GLU  24 -16.219  -9.605   2.460
  199    HG3  GLU  24           2HG      GLU  24 -17.139  -8.208   1.852
  200    H    GLY  25           H        GLY  25 -12.617  -8.758   2.404
  201    HA2  GLY  25           1HA      GLY  25 -13.343  -9.601   5.177
  202    HA3  GLY  25           2HA      GLY  25 -12.346 -10.538   4.038
  203    H    MET  26           H        MET  26 -11.932  -9.392   6.850
  204    HA   MET  26           HA       MET  26  -9.431  -7.842   6.323
  205    HB2  MET  26           1HB      MET  26 -11.042  -8.419   8.803
  206    HB3  MET  26           2HB      MET  26  -9.428  -7.670   8.833
  207    HG2  MET  26           1HG      MET  26 -10.247  -5.783   7.530
  208    HG3  MET  26           2HG      MET  26 -11.852  -6.543   7.401
  209    HE1  MET  26           3HE      MET  26 -12.899  -4.214   8.280
  210    HE2  MET  26           1HE      MET  26 -12.418  -3.441   9.809
  211    HE3  MET  26           2HE      MET  26 -11.265  -3.527   8.455
  212    H    THR  27           H        THR  27  -9.478 -10.539   5.506
  213    HA   THR  27           HA       THR  27  -7.611 -11.784   7.480
  214    HB   THR  27           HB       THR  27  -7.779 -13.804   6.138
  215    HG1  THR  27           HG1      THR  27  -9.227 -13.740   4.269
  216   HG21  THR  27          3HG2      THR  27 -10.524 -12.544   6.518
  217   HG22  THR  27          1HG2      THR  27 -10.192 -14.283   6.343
  218   HG23  THR  27          2HG2      THR  27  -9.592 -13.400   7.767
  219    H    SER  28           H        SER  28  -5.790 -13.051   6.338
  220    HA   SER  28           HA       SER  28  -3.959 -11.005   5.314
  221    HB2  SER  28           1HB      SER  28  -2.337 -12.605   5.355
  222    HB3  SER  28           2HB      SER  28  -3.311 -12.711   6.840
  223    HG   SER  28           HG       SER  28  -2.849 -14.763   5.931
  224    H    ASP  29           H        ASP  29  -3.098 -10.796   3.289
  225    HA   ASP  29           HA       ASP  29  -3.457 -12.830   1.234
  226    HB2  ASP  29           1HB      ASP  29  -5.685 -11.260   1.314
  227    HB3  ASP  29           2HB      ASP  29  -4.481 -10.189   0.556
  228    H    THR  30           H        THR  30  -2.378 -12.330  -0.754
  229    HA   THR  30           HA       THR  30  -0.241 -10.260  -0.354
  230    HB   THR  30           HB       THR  30  -0.007 -12.970  -1.728
  231    HG1  THR  30           HG1      THR  30   1.449 -13.360   0.044
  232   HG21  THR  30          3HG2      THR  30   2.055 -10.789  -1.221
  233   HG22  THR  30          1HG2      THR  30   2.384 -12.385  -1.937
  234   HG23  THR  30          2HG2      THR  30   1.360 -11.214  -2.802
  235    H    TYR  31           H        TYR  31   0.085  -8.815  -1.860
  236    HA   TYR  31           HA       TYR  31  -1.248  -9.234  -4.513
  237    HB2  TYR  31           1HB      TYR  31  -1.183  -6.688  -2.881
  238    HB3  TYR  31           2HB      TYR  31  -1.857  -6.877  -4.517
  239    HD1  TYR  31           HD1      TYR  31  -2.608  -6.912  -1.043
  240    HD2  TYR  31           HD2      TYR  31  -3.753  -8.673  -4.754
  241    HE1  TYR  31           HE1      TYR  31  -4.795  -7.537  -0.062
  242    HE2  TYR  31           HE2      TYR  31  -5.941  -9.303  -3.791
  243    HH   TYR  31           HH       TYR  31  -6.797  -8.553  -0.406
  244    H    THR  32           H        THR  32   0.062  -9.114  -6.142
  245    HA   THR  32           HA       THR  32   2.620  -7.585  -5.780
  246    HB   THR  32           HB       THR  32   3.726  -9.251  -7.198
  247    HG1  THR  32           HG1      THR  32   2.579 -11.100  -7.864
  248   HG21  THR  32          3HG2      THR  32   2.191 -10.548  -4.913
  249   HG22  THR  32          1HG2      THR  32   3.681 -11.176  -5.651
  250   HG23  THR  32          2HG2      THR  32   3.710  -9.638  -4.758
  251    H    LYS  33           H        LYS  33   0.112  -8.659  -8.034
  252    HA   LYS  33           HA       LYS  33   0.924  -6.405  -9.833
  253    HB2  LYS  33           1HB      LYS  33   0.148  -9.216 -10.622
  254    HB3  LYS  33           2HB      LYS  33   0.302  -7.845 -11.745
  255    HG2  LYS  33           1HG      LYS  33   2.693  -7.644 -11.149
  256    HG3  LYS  33           2HG      LYS  33   2.530  -9.047 -10.068
  257    HD2  LYS  33           1HD      LYS  33   1.867 -10.443 -11.995
  258    HD3  LYS  33           2HD      LYS  33   2.065  -9.039 -13.070
  259    HE2  LYS  33           1HE      LYS  33   4.441  -8.901 -12.457
  260    HE3  LYS  33           2HE      LYS  33   4.244 -10.304 -11.381
  261    HZ1  LYS  33           3HZ      LYS  33   3.852 -10.317 -14.306
  262    HZ2  LYS  33           1HZ      LYS  33   5.158 -10.935 -13.511
  263    HZ3  LYS  33           2HZ      LYS  33   3.671 -11.619 -13.309
  264    H    VAL  34           H        VAL  34  -0.697  -5.506 -11.122
  265    HA   VAL  34           HA       VAL  34  -3.238  -5.200  -9.773
  266    HB   VAL  34           HB       VAL  34  -2.363  -4.487 -12.603
  267   HG11  VAL  34          1HG1      VAL  34  -4.366  -3.041 -12.636
  268   HG12  VAL  34          2HG1      VAL  34  -4.817  -4.752 -12.454
  269   HG13  VAL  34          3HG1      VAL  34  -4.847  -3.668 -11.042
  270   HG21  VAL  34          3HG2      VAL  34  -1.115  -3.313 -10.890
  271   HG22  VAL  34          1HG2      VAL  34  -2.227  -2.208 -11.733
  272   HG23  VAL  34          2HG2      VAL  34  -2.631  -2.807 -10.106
  273    H    ASP  35           H        ASP  35  -5.105  -6.127  -9.884
  274    HA   ASP  35           HA       ASP  35  -5.818  -7.881 -12.129
  275    HB2  ASP  35           1HB      ASP  35  -4.311  -9.242 -10.322
  276    HB3  ASP  35           2HB      ASP  35  -5.856  -9.054  -9.457
  277    H    ASP  36           H        ASP  36  -7.963  -8.813 -11.906
  278    HA   ASP  36           HA       ASP  36  -9.727  -6.660 -11.047
  279    HB2  ASP  36           1HB      ASP  36 -10.325  -9.412 -12.290
  280    HB3  ASP  36           2HB      ASP  36 -11.463  -8.156 -11.739
  281    H    SER  37           H        SER  37  -8.964  -9.905  -9.873
  282    HA   SER  37           HA       SER  37 -11.096 -10.145  -7.925
  283    HB2  SER  37           1HB      SER  37  -9.928 -11.884  -7.020
  284    HB3  SER  37           2HB      SER  37  -9.865 -11.978  -8.795
  285    HG   SER  37           HG       SER  37  -7.843 -12.411  -7.810
  286    H    GLN  38           H        GLN  38  -8.144  -8.289  -8.031
  287    HA   GLN  38           HA       GLN  38  -7.945  -8.072  -5.091
  288    HB2  GLN  38           1HB      GLN  38  -6.430  -6.583  -7.241
  289    HB3  GLN  38           2HB      GLN  38  -6.011  -6.718  -5.516
  290    HG2  GLN  38           1HG      GLN  38  -5.504  -9.312  -5.976
  291    HG3  GLN  38           2HG      GLN  38  -6.197  -8.785  -7.528
  292   HE21  GLN  38          2HE2      GLN  38  -4.748  -6.207  -7.468
  293   HE22  GLN  38          1HE2      GLN  38  -3.103  -6.582  -7.862
  294    HA   PRO  39           HA       PRO  39 -10.317  -4.414  -4.440
  295    HB2  PRO  39           2HB      PRO  39  -9.563  -3.570  -2.344
  296    HB3  PRO  39           1HB      PRO  39  -7.872  -3.520  -2.863
  297    HG2  PRO  39           1HG      PRO  39  -7.858  -5.421  -1.451
  298    HG3  PRO  39           2HG      PRO  39  -9.502  -5.895  -1.900
  299    HD2  PRO  39           1HD      PRO  39  -6.916  -6.277  -3.462
  300    HD3  PRO  39           2HD      PRO  39  -8.289  -7.381  -3.298
  301    H    ALA  40           H        ALA  40 -10.632  -2.810  -5.706
  302    HA   ALA  40           HA       ALA  40  -8.834  -1.828  -7.619
  303    HB1  ALA  40           3HB      ALA  40 -11.065  -0.326  -6.207
  304    HB2  ALA  40           1HB      ALA  40 -10.290   0.157  -7.733
  305    HB3  ALA  40           2HB      ALA  40 -11.240  -1.346  -7.653
  306    H    PHE  41           H        PHE  41  -9.269  -0.822  -4.254
  307    HA   PHE  41           HA       PHE  41  -7.502   1.438  -4.337
  308    HB2  PHE  41           1HB      PHE  41  -8.254  -0.445  -2.061
  309    HB3  PHE  41           2HB      PHE  41  -7.330   1.059  -1.858
  310    HD1  PHE  41           HD1      PHE  41 -10.563  -0.233  -3.182
  311    HD2  PHE  41           HD2      PHE  41  -8.416   3.030  -1.451
  312    HE1  PHE  41           HE1      PHE  41 -12.674   1.032  -2.954
  313    HE2  PHE  41           HE2      PHE  41 -10.526   4.297  -1.218
  314    HZ   PHE  41           HZ       PHE  41 -12.655   3.298  -1.972
  315    H    ILE  42           H        ILE  42  -6.901  -2.002  -3.636
  316    HA   ILE  42           HA       ILE  42  -4.039  -1.703  -3.308
  317    HB   ILE  42           HB       ILE  42  -5.770  -4.065  -4.167
  318   HG12  ILE  42          1HG1      ILE  42  -6.123  -3.280  -1.907
  319   HG13  ILE  42          2HG1      ILE  42  -5.403  -4.905  -1.973
  320   HG21  ILE  42          1HG2      ILE  42  -3.764  -5.453  -3.774
  321   HG22  ILE  42          2HG2      ILE  42  -3.486  -4.287  -5.086
  322   HG23  ILE  42          3HG2      ILE  42  -2.805  -3.986  -3.470
  323   HD11  ILE  42          3HD1      ILE  42  -3.914  -2.324  -1.381
  324   HD12  ILE  42          1HD1      ILE  42  -4.384  -3.553  -0.184
  325   HD13  ILE  42          2HD1      ILE  42  -3.193  -3.951  -1.448
  326    H    ASN  43           H        ASN  43  -6.087  -2.178  -6.141
  327    HA   ASN  43           HA       ASN  43  -3.911  -2.778  -7.934
  328    HB2  ASN  43           1HB      ASN  43  -6.743  -1.728  -8.688
  329    HB3  ASN  43           2HB      ASN  43  -5.258  -2.129  -9.584
  330   HD21  ASN  43          2HD2      ASN  43  -8.114  -3.278  -9.188
  331   HD22  ASN  43          1HD2      ASN  43  -7.823  -4.979  -9.022
  332    H    ASP  44           H        ASP  44  -5.581   0.261  -7.127
  333    HA   ASP  44           HA       ASP  44  -4.134   1.973  -8.865
  334    HB2  ASP  44           1HB      ASP  44  -5.272   2.530  -6.060
  335    HB3  ASP  44           2HB      ASP  44  -4.450   3.645  -7.179
  336    H    ILE  45           H        ILE  45  -3.321   0.940  -5.548
  337    HA   ILE  45           HA       ILE  45  -0.902   2.517  -5.408
  338    HB   ILE  45           HB       ILE  45  -1.777   0.010  -3.903
  339   HG12  ILE  45          1HG1      ILE  45  -1.678   2.862  -2.968
  340   HG13  ILE  45          2HG1      ILE  45  -3.123   2.091  -3.661
  341   HG21  ILE  45          1HG2      ILE  45   0.019   0.575  -2.302
  342   HG22  ILE  45          2HG2      ILE  45   0.686   0.228  -3.914
  343   HG23  ILE  45          3HG2      ILE  45   0.539   1.912  -3.356
  344   HD11  ILE  45          3HD1      ILE  45  -1.652   1.189  -1.159
  345   HD12  ILE  45          1HD1      ILE  45  -3.197   2.068  -1.198
  346   HD13  ILE  45          2HD1      ILE  45  -3.098   0.415  -1.853
  347    H    LEU  46           H        LEU  46  -1.442  -0.890  -6.256
  348    HA   LEU  46           HA       LEU  46   1.279  -1.533  -6.769
  349    HB2  LEU  46           1HB      LEU  46  -1.291  -2.358  -7.928
  350    HB3  LEU  46           2HB      LEU  46   0.175  -3.213  -8.461
  351    HG   LEU  46           HG       LEU  46  -0.907  -3.099  -5.618
  352   HD11  LEU  46          1HD1      LEU  46  -1.342  -5.547  -5.955
  353   HD12  LEU  46          2HD1      LEU  46  -2.252  -4.562  -7.123
  354   HD13  LEU  46          3HD1      LEU  46  -0.768  -5.401  -7.632
  355   HD21  LEU  46          3HD2      LEU  46   1.516  -3.185  -5.658
  356   HD22  LEU  46          1HD2      LEU  46   0.863  -4.744  -5.103
  357   HD23  LEU  46          2HD2      LEU  46   1.479  -4.577  -6.766
  358    H    LYS  47           H        LYS  47  -1.098   0.152  -8.754
  359    HA   LYS  47           HA       LYS  47   0.546   0.078 -11.159
  360    HB2  LYS  47           1HB      LYS  47  -1.913   0.287 -11.168
  361    HB3  LYS  47           2HB      LYS  47  -1.754   1.889 -10.409
  362    HG2  LYS  47           1HG      LYS  47  -0.596   2.748 -12.368
  363    HG3  LYS  47           2HG      LYS  47  -0.612   1.134 -13.119
  364    HD2  LYS  47           1HD      LYS  47  -3.069   1.174 -13.174
  365    HD3  LYS  47           2HD      LYS  47  -3.063   2.781 -12.408
  366    HE2  LYS  47           1HE      LYS  47  -1.816   3.686 -14.331
  367    HE3  LYS  47           2HE      LYS  47  -1.851   2.083 -15.101
  368    HZ1  LYS  47           3HZ      LYS  47  -4.216   3.716 -14.436
  369    HZ2  LYS  47           1HZ      LYS  47  -3.585   3.512 -15.947
  370    HZ3  LYS  47           2HZ      LYS  47  -4.248   2.229 -15.149
  371    H    VAL  48           H        VAL  48   0.297   2.179  -8.382
  372    HA   VAL  48           HA       VAL  48   1.715   4.457  -9.422
  373    HB   VAL  48           HB       VAL  48   1.661   3.251  -6.625
  374   HG11  VAL  48          1HG1      VAL  48   2.515   5.451  -5.888
  375   HG12  VAL  48          2HG1      VAL  48   3.672   4.645  -6.977
  376   HG13  VAL  48          3HG1      VAL  48   2.647   5.969  -7.585
  377   HG21  VAL  48          3HG2      VAL  48  -0.521   3.970  -7.396
  378   HG22  VAL  48          1HG2      VAL  48   0.094   5.060  -6.131
  379   HG23  VAL  48          2HG2      VAL  48   0.138   5.563  -7.837
  380    H    GLU  49           H        GLU  49   3.610   4.743 -10.177
  381    HA   GLU  49           HA       GLU  49   5.502   2.616 -10.422
  382    HB2  GLU  49           1HB      GLU  49   5.347   4.597 -11.896
  383    HB3  GLU  49           2HB      GLU  49   5.978   5.597 -10.565
  384    HG2  GLU  49           1HG      GLU  49   8.140   4.259 -10.643
  385    HG3  GLU  49           2HG      GLU  49   7.346   3.309 -11.918
  386    H    GLY  50           H        GLY  50   6.860   1.737  -9.093
  387    HA2  GLY  50           1HA      GLY  50   8.877   2.232  -7.716
  388    HA3  GLY  50           2HA      GLY  50   7.882   3.409  -6.828
  389    H    VAL  51           H        VAL  51   5.533   1.531  -7.007
  390    HA   VAL  51           HA       VAL  51   6.050   0.098  -4.490
  391    HB   VAL  51           HB       VAL  51   3.648   0.083  -6.366
  392   HG11  VAL  51          1HG1      VAL  51   2.454  -0.913  -4.445
  393   HG12  VAL  51          2HG1      VAL  51   3.790  -1.959  -4.980
  394   HG13  VAL  51          3HG1      VAL  51   3.973  -0.955  -3.522
  395   HG21  VAL  51          3HG2      VAL  51   4.051   2.277  -5.422
  396   HG22  VAL  51          1HG2      VAL  51   2.604   1.534  -4.701
  397   HG23  VAL  51          2HG2      VAL  51   4.130   1.580  -3.786
  398    H    LYS  52           H        LYS  52   6.745  -1.816  -4.149
  399    HA   LYS  52           HA       LYS  52   7.241  -3.531  -6.536
  400    HB2  LYS  52           1HB      LYS  52   9.119  -2.961  -5.061
  401    HB3  LYS  52           2HB      LYS  52   8.259  -3.709  -3.694
  402    HG2  LYS  52           1HG      LYS  52   8.351  -5.892  -4.827
  403    HG3  LYS  52           2HG      LYS  52   9.207  -5.145  -6.198
  404    HD2  LYS  52           1HD      LYS  52  11.055  -4.508  -4.693
  405    HD3  LYS  52           2HD      LYS  52  10.201  -5.271  -3.330
  406    HE2  LYS  52           1HE      LYS  52  10.317  -7.442  -4.447
  407    HE3  LYS  52           2HE      LYS  52  11.117  -6.694  -5.850
  408    HZ1  LYS  52           3HZ      LYS  52  12.212  -6.810  -3.112
  409    HZ2  LYS  52           1HZ      LYS  52  12.699  -7.746  -4.381
  410    HZ3  LYS  52           2HZ      LYS  52  12.954  -6.117  -4.413
  411    H    SER  53           H        SER  53   6.124  -3.967  -3.161
  412    HA   SER  53           HA       SER  53   4.232  -6.121  -4.107
  413    HB2  SER  53           1HB      SER  53   4.959  -7.682  -2.601
  414    HB3  SER  53           2HB      SER  53   6.293  -7.213  -3.679
  415    HG   SER  53           HG       SER  53   6.939  -7.373  -1.488
  416    H    ILE  54           H        ILE  54   2.524  -6.481  -2.701
  417    HA   ILE  54           HA       ILE  54   2.376  -4.762  -0.243
  418    HB   ILE  54           HB       ILE  54   0.164  -5.262  -2.287
  419   HG12  ILE  54          1HG1      ILE  54   1.516  -2.708  -1.453
  420   HG13  ILE  54          2HG1      ILE  54   1.806  -3.599  -2.965
  421   HG21  ILE  54          1HG2      ILE  54  -1.215  -3.841  -0.808
  422   HG22  ILE  54          2HG2      ILE  54  -0.670  -5.306   0.040
  423   HG23  ILE  54          3HG2      ILE  54   0.127  -3.747   0.355
  424   HD11  ILE  54          3HD1      ILE  54  -0.829  -2.345  -2.120
  425   HD12  ILE  54          1HD1      ILE  54   0.292  -1.691  -3.335
  426   HD13  ILE  54          2HD1      ILE  54  -0.538  -3.237  -3.631
  427    H    PHE  55           H        PHE  55   1.835  -5.688   1.548
  428    HA   PHE  55           HA       PHE  55   0.350  -8.293   1.358
  429    HB2  PHE  55           1HB      PHE  55   2.598  -8.620   2.330
  430    HB3  PHE  55           2HB      PHE  55   2.272  -7.354   3.533
  431    HD1  PHE  55           HD1      PHE  55   0.868 -10.581   2.290
  432    HD2  PHE  55           HD2      PHE  55   1.519  -7.954   5.594
  433    HE1  PHE  55           HE1      PHE  55  -0.065 -12.282   3.823
  434    HE2  PHE  55           HE2      PHE  55   0.589  -9.652   7.131
  435    HZ   PHE  55           HZ       PHE  55  -0.204 -11.816   6.244
  436    H    HIS  56           H        HIS  56  -1.579  -8.411   2.191
  437    HA   HIS  56           HA       HIS  56  -2.480  -6.127   3.915
  438    HB2  HIS  56           1HB      HIS  56  -3.407  -6.065   1.558
  439    HB3  HIS  56           2HB      HIS  56  -4.182  -7.633   1.885
  440    HD1  HIS  56           HD1      HIS  56  -6.239  -5.871   1.191
  441    HD2  HIS  56           HD2      HIS  56  -4.701  -5.658   5.109
  442    HE1  HIS  56           HE1      HIS  56  -7.914  -4.676   2.509
  443    H    VAL  57           H        VAL  57  -2.905  -6.705   5.879
  444    HA   VAL  57           HA       VAL  57  -4.543  -9.161   6.346
  445    HB   VAL  57           HB       VAL  57  -2.151  -9.829   6.714
  446   HG11  VAL  57          1HG1      VAL  57  -0.951  -8.846   8.638
  447   HG12  VAL  57          2HG1      VAL  57  -1.280  -7.617   7.393
  448   HG13  VAL  57          3HG1      VAL  57  -2.275  -7.679   8.868
  449   HG21  VAL  57          3HG2      VAL  57  -3.942 -10.909   7.937
  450   HG22  VAL  57          1HG2      VAL  57  -2.490 -10.747   8.952
  451   HG23  VAL  57          2HG2      VAL  57  -3.870  -9.649   9.193
  452    H    MET  58           H        MET  58  -5.960  -9.070   7.928
  453    HA   MET  58           HA       MET  58  -7.389  -8.042   9.448
  454    HB2  MET  58           1HB      MET  58  -5.092  -7.862  10.623
  455    HB3  MET  58           2HB      MET  58  -5.171  -6.149  10.147
  456    HG2  MET  58           1HG      MET  58  -7.319  -5.938  11.357
  457    HG3  MET  58           2HG      MET  58  -7.174  -7.635  11.875
  458    HE1  MET  58           3HE      MET  58  -4.188  -8.046  12.597
  459    HE2  MET  58           1HE      MET  58  -4.151  -7.576  14.314
  460    HE3  MET  58           2HE      MET  58  -5.526  -8.512  13.677
  461    H    ASP  59           H        ASP  59  -6.441  -5.029  10.012
  462    HA   ASP  59           HA       ASP  59  -7.832  -3.916   7.596
  463    HB2  ASP  59           1HB      ASP  59  -8.895  -2.222   9.064
  464    HB3  ASP  59           2HB      ASP  59  -9.164  -3.919   9.536
  465    H    PHE  60           H        PHE  60  -4.967  -4.358   8.075
  466    HA   PHE  60           HA       PHE  60  -4.180  -1.561   7.416
  467    HB2  PHE  60           1HB      PHE  60  -2.193  -1.666   8.809
  468    HB3  PHE  60           2HB      PHE  60  -3.603  -2.003   9.842
  469    HD1  PHE  60           HD1      PHE  60  -0.594  -3.379   8.286
  470    HD2  PHE  60           HD2      PHE  60  -3.968  -4.178  10.780
  471    HE1  PHE  60           HE1      PHE  60   0.474  -5.471   9.058
  472    HE2  PHE  60           HE2      PHE  60  -2.903  -6.269  11.557
  473    HZ   PHE  60           HZ       PHE  60  -0.680  -6.916  10.693
  474    H    ILE  61           H        ILE  61  -2.218  -1.378   6.228
  475    HA   ILE  61           HA       ILE  61  -1.627  -3.867   4.649
  476    HB   ILE  61           HB       ILE  61  -2.132  -1.050   3.583
  477   HG12  ILE  61          1HG1      ILE  61  -3.636  -3.599   3.053
  478   HG13  ILE  61          2HG1      ILE  61  -4.130  -2.349   4.218
  479   HG21  ILE  61          1HG2      ILE  61  -1.739  -2.062   1.363
  480   HG22  ILE  61          2HG2      ILE  61  -0.294  -2.197   2.393
  481   HG23  ILE  61          3HG2      ILE  61  -1.342  -3.613   2.140
  482   HD11  ILE  61          3HD1      ILE  61  -3.803  -1.958   1.223
  483   HD12  ILE  61          1HD1      ILE  61  -5.348  -2.111   2.089
  484   HD13  ILE  61          2HD1      ILE  61  -4.295  -0.707   2.389
  485    H    SER  62           H        SER  62   0.364  -4.346   4.263
  486    HA   SER  62           HA       SER  62   2.518  -2.362   4.986
  487    HB2  SER  62           1HB      SER  62   2.638  -4.382   6.124
  488    HB3  SER  62           2HB      SER  62   2.622  -5.291   4.595
  489    HG   SER  62           HG       SER  62   4.734  -5.012   5.281
  490    H    VAL  63           H        VAL  63   3.226  -1.170   3.320
  491    HA   VAL  63           HA       VAL  63   3.250  -2.396   0.564
  492    HB   VAL  63           HB       VAL  63   3.148   0.535   1.391
  493   HG11  VAL  63          1HG1      VAL  63   2.845   0.940  -1.029
  494   HG12  VAL  63          2HG1      VAL  63   4.401   0.138  -0.703
  495   HG13  VAL  63          3HG1      VAL  63   3.032  -0.801  -1.343
  496   HG21  VAL  63          3HG2      VAL  63   1.037  -0.568   1.824
  497   HG22  VAL  63          1HG2      VAL  63   0.901   0.530   0.432
  498   HG23  VAL  63          2HG2      VAL  63   1.019  -1.226   0.170
  499    H    ASP  64           H        ASP  64   5.071  -3.020  -0.164
  500    HA   ASP  64           HA       ASP  64   7.542  -1.649   0.845
  501    HB2  ASP  64           1HB      ASP  64   7.315  -4.185   1.331
  502    HB3  ASP  64           2HB      ASP  64   7.194  -4.282  -0.442
  503    H    LYS  65           H        LYS  65   8.773  -0.548  -0.456
  504    HA   LYS  65           HA       LYS  65   7.988  -0.490  -3.338
  505    HB2  LYS  65           1HB      LYS  65   8.982   1.647  -3.437
  506    HB3  LYS  65           2HB      LYS  65   7.945   1.598  -1.990
  507    HG2  LYS  65           1HG      LYS  65   9.858   1.392  -0.542
  508    HG3  LYS  65           2HG      LYS  65  10.951   1.186  -1.932
  509    HD2  LYS  65           1HD      LYS  65  10.511   3.461  -2.670
  510    HD3  LYS  65           2HD      LYS  65   9.305   3.677  -1.379
  511    HE2  LYS  65           1HE      LYS  65  11.290   4.742  -0.622
  512    HE3  LYS  65           2HE      LYS  65  11.152   3.217   0.281
  513    HZ1  LYS  65           3HZ      LYS  65  12.867   3.662  -2.077
  514    HZ2  LYS  65           1HZ      LYS  65  13.388   3.579  -0.514
  515    HZ3  LYS  65           2HZ      LYS  65  12.739   2.248  -1.239
  516    H    GLU  66           H        GLU  66   9.918   0.244  -4.776
  517    HA   GLU  66           HA       GLU  66  12.050  -1.778  -4.487
  518    HB2  GLU  66           1HB      GLU  66  11.537   0.367  -6.553
  519    HB3  GLU  66           2HB      GLU  66  12.849  -0.835  -6.621
  520    HG2  GLU  66           1HG      GLU  66  11.042  -2.668  -6.697
  521    HG3  GLU  66           2HG      GLU  66   9.898  -1.305  -6.691
  522    H    ASN  67           H        ASN  67  14.304  -1.234  -4.707
  523    HA   ASN  67           HA       ASN  67  15.077   0.587  -2.622
  524    HB2  ASN  67           1HB      ASN  67  16.944  -0.788  -4.699
  525    HB3  ASN  67           2HB      ASN  67  17.164   0.356  -3.354
  526   HD21  ASN  67          2HD2      ASN  67  18.079  -2.433  -3.801
  527   HD22  ASN  67          1HD2      ASN  67  17.553  -3.311  -2.402
  528    H    ASP  68           H        ASP  68  15.058   0.872  -6.154
  529    HA   ASP  68           HA       ASP  68  16.360   3.467  -6.176
  530    HB2  ASP  68           1HB      ASP  68  14.642   2.044  -8.298
  531    HB3  ASP  68           2HB      ASP  68  15.409   3.650  -8.362
  532    H    ALA  69           H        ALA  69  12.989   2.388  -6.087
  533    HA   ALA  69           HA       ALA  69  11.805   4.920  -6.606
  534    HB1  ALA  69           3HB      ALA  69  10.761   2.621  -4.920
  535    HB2  ALA  69           1HB      ALA  69   9.791   3.972  -5.547
  536    HB3  ALA  69           2HB      ALA  69  10.542   2.817  -6.674
  537    H    ASN  70           H        ASN  70  10.681   6.349  -5.171
  538    HA   ASN  70           HA       ASN  70  11.821   6.410  -2.395
  539    HB2  ASN  70           1HB      ASN  70  11.367   9.010  -4.037
  540    HB3  ASN  70           2HB      ASN  70  11.779   8.556  -2.365
  541   HD21  ASN  70          2HD2      ASN  70  12.886   8.904  -5.613
  542   HD22  ASN  70          1HD2      ASN  70  14.564   8.593  -5.311
  543    H    TRP  71           H        TRP  71  10.527   7.082  -0.753
  544    HA   TRP  71           HA       TRP  71   7.690   6.586  -1.110
  545    HB2  TRP  71           1HB      TRP  71   9.388   7.563   1.213
  546    HB3  TRP  71           2HB      TRP  71   7.616   7.429   1.317
  547    HD1  TRP  71           HD1      TRP  71  10.344   5.729   2.387
  548    HE1  TRP  71           HE1      TRP  71   9.968   3.061   2.611
  549    HE3  TRP  71           HE3      TRP  71   6.199   5.330  -0.524
  550    HZ2  TRP  71           HZ2      TRP  71   8.129   1.246   1.630
  551    HZ3  TRP  71           HZ3      TRP  71   5.161   3.173  -0.871
  552    HH2  TRP  71           HH2      TRP  71   6.059   1.132   0.162
  553    H    GLU  72           H        GLU  72   9.696   9.421  -1.216
  554    HA   GLU  72           HA       GLU  72   7.805  11.445  -0.648
  555    HB2  GLU  72           1HB      GLU  72  10.204  11.808  -1.039
  556    HB3  GLU  72           2HB      GLU  72   9.965  11.432  -2.763
  557    HG2  GLU  72           1HG      GLU  72   8.467  13.476  -2.960
  558    HG3  GLU  72           2HG      GLU  72   8.739  13.677  -1.215
  559    H    THR  73           H        THR  73   8.304   9.598  -3.631
  560    HA   THR  73           HA       THR  73   6.159  11.070  -5.013
  561    HB   THR  73           HB       THR  73   7.655   8.527  -5.780
  562    HG1  THR  73           HG1      THR  73   8.746  10.010  -7.201
  563   HG21  THR  73          3HG2      THR  73   5.844  10.356  -7.406
  564   HG22  THR  73          1HG2      THR  73   6.758   8.965  -8.039
  565   HG23  THR  73          2HG2      THR  73   5.443   8.707  -6.866
  566    H    VAL  74           H        VAL  74   6.563   7.856  -3.513
  567    HA   VAL  74           HA       VAL  74   4.125   6.836  -4.754
  568    HB   VAL  74           HB       VAL  74   5.856   5.773  -2.482
  569   HG11  VAL  74          1HG1      VAL  74   4.647   3.646  -2.832
  570   HG12  VAL  74          2HG1      VAL  74   3.536   4.938  -2.319
  571   HG13  VAL  74          3HG1      VAL  74   3.596   4.440  -4.027
  572   HG21  VAL  74          3HG2      VAL  74   7.016   5.866  -4.607
  573   HG22  VAL  74          1HG2      VAL  74   6.659   4.182  -4.154
  574   HG23  VAL  74          2HG2      VAL  74   5.678   4.997  -5.397
  575    H    LEU  75           H        LEU  75   4.888   7.990  -1.465
  576    HA   LEU  75           HA       LEU  75   2.557   6.739  -0.353
  577    HB2  LEU  75           1HB      LEU  75   4.431   8.844   0.431
  578    HB3  LEU  75           2HB      LEU  75   3.111   8.496   1.574
  579    HG   LEU  75           HG       LEU  75   5.299   6.595   0.651
  580   HD11  LEU  75          1HD1      LEU  75   5.918   6.590   3.082
  581   HD12  LEU  75          2HD1      LEU  75   5.997   8.231   2.399
  582   HD13  LEU  75          3HD1      LEU  75   4.608   7.750   3.402
  583   HD21  LEU  75          3HD2      LEU  75   3.194   5.408   0.841
  584   HD22  LEU  75          1HD2      LEU  75   4.276   4.943   2.176
  585   HD23  LEU  75          2HD2      LEU  75   2.934   6.074   2.472
  586    HA   PRO  76           HA       PRO  76   0.730  11.332  -0.591
  587    HB2  PRO  76           2HB      PRO  76   1.546  12.970  -2.147
  588    HB3  PRO  76           1HB      PRO  76   1.999  11.751  -3.347
  589    HG2  PRO  76           1HG      PRO  76   4.103  12.329  -2.405
  590    HG3  PRO  76           2HG      PRO  76   3.436  12.517  -0.778
  591    HD2  PRO  76           1HD      PRO  76   4.107   9.959  -2.277
  592    HD3  PRO  76           2HD      PRO  76   4.290  10.318  -0.555
  593    H    LYS  77           H        LYS  77   1.403   9.330  -3.465
  594    HA   LYS  77           HA       LYS  77  -1.313   9.590  -4.464
  595    HB2  LYS  77           1HB      LYS  77   0.909   7.624  -5.032
  596    HB3  LYS  77           2HB      LYS  77  -0.657   7.638  -5.876
  597    HG2  LYS  77           1HG      LYS  77  -0.201   9.897  -6.719
  598    HG3  LYS  77           2HG      LYS  77   1.353   9.914  -5.852
  599    HD2  LYS  77           1HD      LYS  77   2.110   7.979  -7.186
  600    HD3  LYS  77           2HD      LYS  77   0.564   7.992  -8.068
  601    HE2  LYS  77           1HE      LYS  77   1.043  10.261  -8.880
  602    HE3  LYS  77           2HE      LYS  77   2.585  10.254  -7.996
  603    HZ1  LYS  77           3HZ      LYS  77   1.859   8.422 -10.190
  604    HZ2  LYS  77           1HZ      LYS  77   2.886   9.707 -10.314
  605    HZ3  LYS  77           2HZ      LYS  77   3.290   8.414  -9.370
  606    H    VAL  78           H        VAL  78   0.402   7.111  -2.577
  607    HA   VAL  78           HA       VAL  78  -1.694   5.171  -2.486
  608    HB   VAL  78           HB       VAL  78   0.433   5.895  -0.429
  609   HG11  VAL  78          1HG1      VAL  78  -0.069   3.694   0.578
  610   HG12  VAL  78          2HG1      VAL  78  -1.487   4.767   0.644
  611   HG13  VAL  78          3HG1      VAL  78  -1.407   3.472  -0.573
  612   HG21  VAL  78          3HG2      VAL  78   1.337   5.112  -2.537
  613   HG22  VAL  78          1HG2      VAL  78   1.563   3.894  -1.260
  614   HG23  VAL  78          2HG2      VAL  78   0.284   3.679  -2.478
  615    H    GLU  79           H        GLU  79  -1.033   7.812  -0.179
  616    HA   GLU  79           HA       GLU  79  -3.305   7.362   1.463
  617    HB2  GLU  79           1HB      GLU  79  -1.442   8.882   1.990
  618    HB3  GLU  79           2HB      GLU  79  -2.006   9.985   0.712
  619    HG2  GLU  79           1HG      GLU  79  -4.153  10.343   2.014
  620    HG3  GLU  79           2HG      GLU  79  -3.500   9.154   3.164
  621    H    ALA  80           H        ALA  80  -2.994   9.250  -1.527
  622    HA   ALA  80           HA       ALA  80  -5.606  10.347  -1.528
  623    HB1  ALA  80           3HB      ALA  80  -3.894   9.488  -3.885
  624    HB2  ALA  80           1HB      ALA  80  -5.306  10.566  -3.964
  625    HB3  ALA  80           2HB      ALA  80  -3.849  11.074  -3.078
  626    H    VAL  81           H        VAL  81  -4.430   7.184  -2.606
  627    HA   VAL  81           HA       VAL  81  -6.705   6.320  -4.075
  628    HB   VAL  81           HB       VAL  81  -4.791   4.745  -2.306
  629   HG11  VAL  81          1HG1      VAL  81  -5.628   2.751  -3.503
  630   HG12  VAL  81          2HG1      VAL  81  -6.932   3.538  -2.581
  631   HG13  VAL  81          3HG1      VAL  81  -6.828   3.760  -4.344
  632   HG21  VAL  81          3HG2      VAL  81  -3.715   5.844  -4.177
  633   HG22  VAL  81          1HG2      VAL  81  -3.769   4.084  -4.424
  634   HG23  VAL  81          2HG2      VAL  81  -4.904   5.141  -5.299
  635    H    PHE  82           H        PHE  82  -6.112   6.030  -0.578
  636    HA   PHE  82           HA       PHE  82  -8.787   4.874  -0.178
  637    HB2  PHE  82           1HB      PHE  82  -6.770   5.884   1.872
  638    HB3  PHE  82           2HB      PHE  82  -8.181   4.848   2.183
  639    HD1  PHE  82           HD1      PHE  82  -4.716   4.950   1.473
  640    HD2  PHE  82           HD2      PHE  82  -8.236   2.575   0.995
  641    HE1  PHE  82           HE1      PHE  82  -3.314   2.940   1.145
  642    HE2  PHE  82           HE2      PHE  82  -6.837   0.563   0.671
  643    HZ   PHE  82           HZ       PHE  82  -4.376   0.746   0.744
  644    H    GLU  83           H        GLU  83  -7.289   8.032  -0.021
  645    HA   GLU  83           HA       GLU  83  -9.470   9.249   1.495
  646    HB2  GLU  83           1HB      GLU  83  -7.168  10.113   1.508
  647    HB3  GLU  83           2HB      GLU  83  -7.315  10.487  -0.226
  648    HG2  GLU  83           1HG      GLU  83  -8.964  12.256   0.236
  649    HG3  GLU  83           2HG      GLU  83  -9.133  11.575   1.869
  650    H    LEU  84           H        LEU  84  -9.463   7.954  -1.502
  651    HA   LEU  84           HA       LEU  84 -11.013   9.892  -2.968
  652    HB2  LEU  84           1HB      LEU  84 -10.832   6.957  -2.933
  653    HB3  LEU  84           2HB      LEU  84 -11.838   7.728  -4.180
  654    HG   LEU  84           HG       LEU  84  -8.832   8.046  -3.817
  655   HD11  LEU  84          1HD1      LEU  84  -8.714   6.898  -6.045
  656   HD12  LEU  84          2HD1      LEU  84  -9.505   5.869  -4.831
  657   HD13  LEU  84          3HD1      LEU  84 -10.485   6.735  -6.038
  658   HD21  LEU  84          3HD2      LEU  84  -9.843  10.118  -4.564
  659   HD22  LEU  84          1HD2      LEU  84  -8.916   9.382  -5.893
  660   HD23  LEU  84          2HD2      LEU  84 -10.692   9.266  -5.875
  661    H    GLU  85           H        GLU  85 -11.842   7.478  -0.540
  662    HA   GLU  85           HA       GLU  85 -13.846   7.075   0.572
  663    HB2  GLU  85           1HB      GLU  85 -14.391   9.950  -0.178
  664    HB3  GLU  85           2HB      GLU  85 -15.208   9.007   1.090
  665    HG2  GLU  85           1HG      GLU  85 -12.935   8.857   2.301
  666    HG3  GLU  85           2HG      GLU  85 -12.356   9.885   0.971
  667    H    HIS  86           H        HIS  86 -13.768   6.277  -2.118
  668    HA   HIS  86           HA       HIS  86 -16.368   7.003  -3.297
  669    HB2  HIS  86           1HB      HIS  86 -14.178   5.041  -4.099
  670    HB3  HIS  86           2HB      HIS  86 -15.711   5.214  -4.987
  671    HD1  HIS  86           HD1      HIS  86 -13.274   5.734  -6.565
  672    HD2  HIS  86           HD2      HIS  86 -15.142   8.815  -4.379
  673    HE1  HIS  86           HE1      HIS  86 -12.495   7.829  -7.552
  674    H    HIS  87           H        HIS  87 -18.118   5.684  -3.614
  675    HA   HIS  87           HA       HIS  87 -18.558   3.691  -1.505
  676    HB2  HIS  87           1HB      HIS  87 -20.359   5.280  -2.303
  677    HB3  HIS  87           2HB      HIS  87 -20.362   4.410  -3.856
  678    HD2  HIS  87           HD2      HIS  87 -20.104   1.765  -1.043
  679    HE1  HIS  87           HE1      HIS  87 -24.216   2.370  -1.922
  680    HE2  HIS  87           HE2      HIS  87 -22.420   0.884  -0.706
  681    H    HIS  88           H        HIS  88 -18.831   3.538  -5.072
  682    HA   HIS  88           HA       HIS  88 -17.837   0.714  -4.870
  683    HB2  HIS  88           1HB      HIS  88 -19.681   1.938  -6.973
  684    HB3  HIS  88           2HB      HIS  88 -19.083   0.261  -6.955
  685    HD1  HIS  88           HD1      HIS  88 -19.838  -1.142  -4.727
  686    HD2  HIS  88           HD2      HIS  88 -22.141   2.266  -5.634
  687    HE1  HIS  88           HE1      HIS  88 -21.981  -1.458  -3.599
  688    H    HIS  89           H        HIS  89 -15.681   1.444  -4.902
  689    HA   HIS  89           HA       HIS  89 -14.781   3.011  -7.232
  690    HB2  HIS  89           1HB      HIS  89 -13.804   3.397  -4.954
  691    HB3  HIS  89           2HB      HIS  89 -13.149   1.742  -4.990
  692    HD2  HIS  89           HD2      HIS  89 -10.457   1.814  -5.741
  693    HE1  HIS  89           HE1      HIS  89 -10.788   5.239  -8.234
  694    HE2  HIS  89           HE2      HIS  89  -9.209   3.392  -7.229
  695    H    HIS  90           H        HIS  90 -13.945   2.308  -9.033
  696    HA   HIS  90           HA       HIS  90 -13.012  -0.538  -9.133
  697    HB2  HIS  90           1HB      HIS  90 -14.538   0.960 -11.311
  698    HB3  HIS  90           2HB      HIS  90 -13.900  -0.697 -11.427
  699    HD1  HIS  90           HD1      HIS  90 -15.048  -2.506  -9.866
  700    HD2  HIS  90           HD2      HIS  90 -17.103   1.167 -10.067
  701    HE1  HIS  90           HE1      HIS  90 -17.322  -2.964  -9.103
  702    H    HIS  91           H        HIS  91 -11.158  -0.970 -10.119
  703    HA   HIS  91           HA       HIS  91  -9.342   1.251 -10.559
  704    HB2  HIS  91           1HB      HIS  91  -8.534  -0.908  -9.658
  705    HB3  HIS  91           2HB      HIS  91  -9.009  -1.719 -11.169
  706    HD1  HIS  91           HD1      HIS  91  -6.653   1.035  -9.990
  707    HD2  HIS  91           HD2      HIS  91  -6.911  -1.866 -13.034
  708    HE1  HIS  91           HE1      HIS  91  -4.576   1.210 -11.266
  Start of MODEL    6
    1    H1   MET   1           1H       MET   1 -11.662   0.628   1.444
    2    H2   MET   1           2H       MET   1 -12.063   0.465   2.880
    3    H3   MET   1           3H       MET   1 -12.242   1.788   2.196
    4    HA   MET   1           HA       MET   1  -9.953   1.042   3.699
    5    HB2  MET   1           1HB      MET   1  -9.494   1.389   0.738
    6    HB3  MET   1           2HB      MET   1  -8.214   1.512   1.970
    7    HG2  MET   1           1HG      MET   1  -8.589  -0.806   2.624
    8    HG3  MET   1           2HG      MET   1  -9.926  -0.939   1.457
    9    HE1  MET   1           3HE      MET   1  -8.803  -3.138   0.433
   10    HE2  MET   1           1HE      MET   1  -7.117  -3.209  -0.135
   11    HE3  MET   1           2HE      MET   1  -7.464  -2.999   1.600
   12    H    LYS   2           H        LYS   2 -10.238   2.763   4.935
   13    HA   LYS   2           HA       LYS   2  -9.678   5.405   3.640
   14    HB2  LYS   2           1HB      LYS   2 -12.090   5.174   4.136
   15    HB3  LYS   2           2HB      LYS   2 -11.680   4.883   5.843
   16    HG2  LYS   2           1HG      LYS   2 -10.913   7.100   6.153
   17    HG3  LYS   2           2HG      LYS   2 -10.834   7.403   4.401
   18    HD2  LYS   2           1HD      LYS   2 -13.287   7.255   4.263
   19    HD3  LYS   2           2HD      LYS   2 -13.369   6.942   6.013
   20    HE2  LYS   2           1HE      LYS   2 -12.574   9.114   6.542
   21    HE3  LYS   2           2HE      LYS   2 -12.074   9.420   4.864
   22    HZ1  LYS   2           3HZ      LYS   2 -14.857   9.128   5.796
   23    HZ2  LYS   2           1HZ      LYS   2 -14.123  10.552   5.402
   24    HZ3  LYS   2           2HZ      LYS   2 -14.393   9.412   4.239
   25    H    ILE   3           H        ILE   3  -8.270   6.700   4.636
   26    HA   ILE   3           HA       ILE   3  -6.452   5.216   6.387
   27    HB   ILE   3           HB       ILE   3  -6.366   8.078   5.324
   28   HG12  ILE   3          1HG1      ILE   3  -4.797   5.673   4.444
   29   HG13  ILE   3          2HG1      ILE   3  -6.294   6.234   3.664
   30   HG21  ILE   3          1HG2      ILE   3  -3.989   8.030   6.002
   31   HG22  ILE   3          2HG2      ILE   3  -5.061   7.821   7.407
   32   HG23  ILE   3          3HG2      ILE   3  -4.224   6.415   6.708
   33   HD11  ILE   3          3HD1      ILE   3  -3.722   7.829   3.929
   34   HD12  ILE   3          1HD1      ILE   3  -4.306   7.033   2.450
   35   HD13  ILE   3          2HD1      ILE   3  -5.220   8.391   3.150
   36    H    ILE   4           H        ILE   4  -6.322   5.138   8.461
   37    HA   ILE   4           HA       ILE   4  -7.420   7.429  10.051
   38    HB   ILE   4           HB       ILE   4  -6.405   4.672  10.880
   39   HG12  ILE   4          1HG1      ILE   4  -9.157   5.872  11.036
   40   HG13  ILE   4          2HG1      ILE   4  -8.596   4.740   9.785
   41   HG21  ILE   4          1HG2      ILE   4  -7.114   5.317  13.158
   42   HG22  ILE   4          2HG2      ILE   4  -5.831   6.393  12.559
   43   HG23  ILE   4          3HG2      ILE   4  -7.521   6.948  12.570
   44   HD11  ILE   4          3HD1      ILE   4  -8.759   4.163  12.765
   45   HD12  ILE   4          1HD1      ILE   4  -9.890   3.573  11.527
   46   HD13  ILE   4          2HD1      ILE   4  -8.195   3.029  11.513
   47    H    SER   5           H        SER   5  -4.426   5.565   9.599
   48    HA   SER   5           HA       SER   5  -2.808   8.018  10.049
   49    HB2  SER   5           1HB      SER   5  -3.323   7.575  12.264
   50    HB3  SER   5           2HB      SER   5  -2.791   5.888  12.101
   51    HG   SER   5           HG       SER   5  -1.171   7.249  12.977
   52    H    ILE   6           H        ILE   6  -0.965   7.838   8.928
   53    HA   ILE   6           HA       ILE   6   0.005   5.086   8.191
   54    HB   ILE   6           HB       ILE   6   0.463   7.773   6.814
   55   HG12  ILE   6          1HG1      ILE   6  -1.003   5.331   5.851
   56   HG13  ILE   6          2HG1      ILE   6  -1.767   6.795   6.514
   57   HG21  ILE   6          1HG2      ILE   6   1.674   6.446   5.118
   58   HG22  ILE   6          2HG2      ILE   6   2.451   6.310   6.713
   59   HG23  ILE   6          3HG2      ILE   6   1.443   4.979   6.099
   60   HD11  ILE   6          3HD1      ILE   6  -0.042   6.665   4.015
   61   HD12  ILE   6          1HD1      ILE   6  -1.814   6.806   4.051
   62   HD13  ILE   6          2HD1      ILE   6  -0.805   8.129   4.679
   63    H    SER   7           H        SER   7   1.908   4.384   8.720
   64    HA   SER   7           HA       SER   7   3.786   6.264  10.173
   65    HB2  SER   7           1HB      SER   7   4.029   4.841  11.957
   66    HB3  SER   7           2HB      SER   7   2.330   5.342  11.790
   67    HG   SER   7           HG       SER   7   2.559   3.109  12.244
   68    H    GLU   8           H        GLU   8   5.918   5.423  10.378
   69    HA   GLU   8           HA       GLU   8   6.697   3.564   8.208
   70    HB2  GLU   8           1HB      GLU   8   8.301   5.141  10.226
   71    HB3  GLU   8           2HB      GLU   8   8.990   4.109   8.950
   72    HG2  GLU   8           1HG      GLU   8   7.969   5.638   7.205
   73    HG3  GLU   8           2HG      GLU   8   7.258   6.517   8.577
   74    H    THR   9           H        THR   9   8.478   1.983   8.736
   75    HA   THR   9           HA       THR   9   7.736   0.503  11.236
   76    HB   THR   9           HB       THR   9   7.859  -1.595  10.037
   77    HG1  THR   9           HG1      THR   9   8.247  -0.177   7.602
   78   HG21  THR   9          3HG2      THR   9   6.188   0.402   8.458
   79   HG22  THR   9          1HG2      THR   9   5.965  -1.362   8.467
   80   HG23  THR   9          2HG2      THR   9   5.684  -0.422   9.952
   81    HA   PRO  10           HA       PRO  10  11.940  -0.026  12.264
   82    HB2  PRO  10           2HB      PRO  10  12.114  -2.029  13.537
   83    HB3  PRO  10           1HB      PRO  10  11.474  -3.030  12.228
   84    HG2  PRO  10           1HG      PRO  10   9.615  -2.954  13.691
   85    HG3  PRO  10           2HG      PRO  10   9.966  -1.304  14.218
   86    HD2  PRO  10           1HD      PRO  10   8.671  -2.237  11.625
   87    HD3  PRO  10           2HD      PRO  10   8.262  -0.841  12.628
   88    H    ASN  11           H        ASN  11  10.624  -1.980   9.658
   89    HA   ASN  11           HA       ASN  11  13.344  -2.174   8.452
   90    HB2  ASN  11           1HB      ASN  11  10.739  -3.535   7.427
   91    HB3  ASN  11           2HB      ASN  11  12.406  -3.329   6.836
   92   HD21  ASN  11          2HD2      ASN  11  10.706  -5.670   7.745
   93   HD22  ASN  11          1HD2      ASN  11  11.722  -6.518   8.863
   94    H    HIS  12           H        HIS  12  13.964  -1.238   6.600
   95    HA   HIS  12           HA       HIS  12  12.426   1.198   5.914
   96    HB2  HIS  12           1HB      HIS  12  14.931   1.249   6.369
   97    HB3  HIS  12           2HB      HIS  12  15.149   0.326   4.863
   98    HD1  HIS  12           HD1      HIS  12  15.062   1.572   2.689
   99    HD2  HIS  12           HD2      HIS  12  13.911   4.018   5.921
  100    HE1  HIS  12           HE1      HIS  12  15.025   3.856   1.825
  101    H    ASN  13           H        ASN  13  11.997   1.860   3.783
  102    HA   ASN  13           HA       ASN  13  11.268   1.523   1.588
  103    HB2  ASN  13           1HB      ASN  13  12.614  -1.282   1.649
  104    HB3  ASN  13           2HB      ASN  13  11.660  -0.332   0.485
  105   HD21  ASN  13          2HD2      ASN  13  14.584  -1.322   0.847
  106   HD22  ASN  13          1HD2      ASN  13  15.516   0.059   0.376
  107    H    THR  14           H        THR  14  10.046   0.390   4.266
  108    HA   THR  14           HA       THR  14   7.561  -0.382   2.858
  109    HB   THR  14           HB       THR  14   8.603  -2.574   3.315
  110    HG1  THR  14           HG1      THR  14   6.318  -2.322   3.588
  111   HG21  THR  14          3HG2      THR  14   8.603  -1.642   6.214
  112   HG22  THR  14          1HG2      THR  14   9.019  -3.277   5.646
  113   HG23  THR  14          2HG2      THR  14  10.045  -1.891   5.203
  114    H    MET  15           H        MET  15   5.757   0.275   3.809
  115    HA   MET  15           HA       MET  15   6.009   1.489   6.539
  116    HB2  MET  15           1HB      MET  15   4.765   2.686   4.065
  117    HB3  MET  15           2HB      MET  15   4.524   3.304   5.717
  118    HG2  MET  15           1HG      MET  15   6.962   3.699   5.894
  119    HG3  MET  15           2HG      MET  15   7.154   3.155   4.210
  120    HE1  MET  15           3HE      MET  15   5.848   5.948   6.620
  121    HE2  MET  15           1HE      MET  15   4.946   7.014   5.516
  122    HE3  MET  15           2HE      MET  15   4.329   5.384   5.882
  123    H    LYS  16           H        LYS  16   4.008   1.835   7.645
  124    HA   LYS  16           HA       LYS  16   2.014  -0.276   6.887
  125    HB2  LYS  16           1HB      LYS  16   3.276  -0.772   8.919
  126    HB3  LYS  16           2HB      LYS  16   2.790   0.795   9.605
  127    HG2  LYS  16           1HG      LYS  16   0.414   0.058   9.499
  128    HG3  LYS  16           2HG      LYS  16   0.965  -1.535   8.929
  129    HD2  LYS  16           1HD      LYS  16   2.214  -1.876  10.997
  130    HD3  LYS  16           2HD      LYS  16   1.765  -0.250  11.562
  131    HE2  LYS  16           1HE      LYS  16  -0.603  -0.894  11.555
  132    HE3  LYS  16           2HE      LYS  16  -0.163  -2.518  10.975
  133    HZ1  LYS  16           3HZ      LYS  16   0.654  -1.340  13.552
  134    HZ2  LYS  16           1HZ      LYS  16  -0.514  -2.487  13.351
  135    HZ3  LYS  16           2HZ      LYS  16   1.062  -2.844  13.015
  136    H    ILE  17           H        ILE  17   0.030   0.269   6.469
  137    HA   ILE  17           HA       ILE  17  -0.890   3.013   7.298
  138    HB   ILE  17           HB       ILE  17  -1.776   1.281   4.944
  139   HG12  ILE  17          1HG1      ILE  17  -0.941   3.648   3.919
  140   HG13  ILE  17          2HG1      ILE  17   0.208   3.401   5.254
  141   HG21  ILE  17          1HG2      ILE  17  -3.158   3.236   4.328
  142   HG22  ILE  17          2HG2      ILE  17  -3.628   2.597   5.920
  143   HG23  ILE  17          3HG2      ILE  17  -2.638   4.071   5.810
  144   HD11  ILE  17          3HD1      ILE  17  -0.364   1.429   3.015
  145   HD12  ILE  17          1HD1      ILE  17   1.077   2.462   3.149
  146   HD13  ILE  17          2HD1      ILE  17   0.785   1.182   4.351
  147    H    THR  18           H        THR  18  -2.297   3.160   8.791
  148    HA   THR  18           HA       THR  18  -3.971   0.795   9.458
  149    HB   THR  18           HB       THR  18  -3.694   3.502  10.829
  150    HG1  THR  18           HG1      THR  18  -2.562   2.202  12.390
  151   HG21  THR  18          3HG2      THR  18  -5.120   0.956  11.695
  152   HG22  THR  18          1HG2      THR  18  -4.931   2.429  12.677
  153   HG23  THR  18          2HG2      THR  18  -5.908   2.469  11.190
  154    H    LEU  19           H        LEU  19  -5.936   0.503   8.794
  155    HA   LEU  19           HA       LEU  19  -7.350   2.854   7.579
  156    HB2  LEU  19           1HB      LEU  19  -7.418  -0.031   6.974
  157    HB3  LEU  19           2HB      LEU  19  -8.459   1.104   6.085
  158    HG   LEU  19           HG       LEU  19  -5.417   1.017   6.034
  159   HD11  LEU  19          1HD1      LEU  19  -5.739   0.366   3.631
  160   HD12  LEU  19          2HD1      LEU  19  -6.495  -0.812   4.728
  161   HD13  LEU  19          3HD1      LEU  19  -7.502   0.385   3.880
  162   HD21  LEU  19          3HD2      LEU  19  -6.235   3.293   5.873
  163   HD22  LEU  19          1HD2      LEU  19  -5.592   2.767   4.300
  164   HD23  LEU  19          2HD2      LEU  19  -7.351   2.832   4.568
  165    H    SER  20           H        SER  20  -9.610   2.942   7.698
  166    HA   SER  20           HA       SER  20 -10.694   2.091  10.314
  167    HB2  SER  20           1HB      SER  20 -11.120   4.241   9.543
  168    HB3  SER  20           2HB      SER  20 -11.903   3.606   8.080
  169    HG   SER  20           HG       SER  20 -13.399   4.127   9.734
  170    H    GLU  21           H        GLU  21 -11.757   1.696   6.902
  171    HA   GLU  21           HA       GLU  21 -12.724  -1.049   7.608
  172    HB2  GLU  21           1HB      GLU  21 -14.129   1.055   5.958
  173    HB3  GLU  21           2HB      GLU  21 -14.601  -0.657   6.033
  174    HG2  GLU  21           1HG      GLU  21 -15.046  -0.364   8.532
  175    HG3  GLU  21           2HG      GLU  21 -14.532   1.319   8.274
  176    H    SER  22           H        SER  22 -10.712  -1.767   6.773
  177    HA   SER  22           HA       SER  22  -9.924  -1.297   3.986
  178    HB2  SER  22           1HB      SER  22  -8.240  -2.733   4.319
  179    HB3  SER  22           2HB      SER  22  -8.423  -1.805   5.824
  180    HG   SER  22           HG       SER  22  -9.300  -3.566   6.798
  181    H    ARG  23           H        ARG  23  -9.349  -3.627   2.915
  182    HA   ARG  23           HA       ARG  23 -11.530  -4.581   1.551
  183    HB2  ARG  23           1HB      ARG  23  -9.296  -5.236   1.046
  184    HB3  ARG  23           2HB      ARG  23  -9.247  -6.253   2.506
  185    HG2  ARG  23           1HG      ARG  23 -11.145  -7.583   1.560
  186    HG3  ARG  23           2HG      ARG  23 -11.000  -6.635   0.061
  187    HD2  ARG  23           1HD      ARG  23  -8.791  -7.474  -0.293
  188    HD3  ARG  23           2HD      ARG  23  -8.845  -8.348   1.254
  189    HE   ARG  23           HE       ARG  23 -10.940  -9.347  -0.539
  190   HH11  ARG  23          1HH1      ARG  23  -7.493  -9.486  -0.029
  191   HH12  ARG  23          2HH1      ARG  23  -7.442 -11.074  -0.767
  192   HH21  ARG  23          2HH2      ARG  23  -9.382 -12.031  -1.548
  193   HH22  ARG  23          1HH2      ARG  23 -10.896 -11.161  -1.395
  194    H    GLU  24           H        GLU  24 -13.264  -5.778   1.805
  195    HA   GLU  24           HA       GLU  24 -14.509  -6.156   4.250
  196    HB2  GLU  24           1HB      GLU  24 -15.538  -6.480   2.030
  197    HB3  GLU  24           2HB      GLU  24 -14.669  -8.026   1.882
  198    HG2  GLU  24           1HG      GLU  24 -15.967  -8.922   3.857
  199    HG3  GLU  24           2HG      GLU  24 -16.670  -7.293   3.977
  200    H    GLY  25           H        GLY  25 -12.760  -8.779   2.548
  201    HA2  GLY  25           1HA      GLY  25 -12.605 -10.442   4.894
  202    HA3  GLY  25           2HA      GLY  25 -11.637 -10.611   3.410
  203    H    MET  26           H        MET  26 -11.481 -10.055   6.668
  204    HA   MET  26           HA       MET  26  -9.159  -8.205   6.577
  205    HB2  MET  26           1HB      MET  26 -10.538  -9.585   8.880
  206    HB3  MET  26           2HB      MET  26  -9.243  -8.370   9.006
  207    HG2  MET  26           1HG      MET  26 -12.017  -7.918   7.861
  208    HG3  MET  26           2HG      MET  26 -11.456  -7.397   9.468
  209    HE1  MET  26           3HE      MET  26 -12.639  -5.053   8.274
  210    HE2  MET  26           1HE      MET  26 -11.855  -4.225   6.906
  211    HE3  MET  26           2HE      MET  26 -12.659  -5.795   6.657
  212    H    THR  27           H        THR  27  -9.526 -11.346   5.896
  213    HA   THR  27           HA       THR  27  -7.239 -12.454   7.321
  214    HB   THR  27           HB       THR  27  -7.370 -14.287   5.703
  215    HG1  THR  27           HG1      THR  27  -8.940 -14.121   3.993
  216   HG21  THR  27          3HG2      THR  27 -10.135 -13.335   6.552
  217   HG22  THR  27          1HG2      THR  27  -9.704 -14.999   6.091
  218   HG23  THR  27          2HG2      THR  27  -9.004 -14.271   7.556
  219    H    SER  28           H        SER  28  -5.338 -13.321   6.131
  220    HA   SER  28           HA       SER  28  -3.829 -11.020   5.124
  221    HB2  SER  28           1HB      SER  28  -2.002 -12.379   5.100
  222    HB3  SER  28           2HB      SER  28  -2.921 -12.658   6.594
  223    HG   SER  28           HG       SER  28  -2.196 -14.600   5.620
  224    H    ASP  29           H        ASP  29  -3.004 -10.680   3.089
  225    HA   ASP  29           HA       ASP  29  -3.125 -12.736   1.025
  226    HB2  ASP  29           1HB      ASP  29  -5.510 -11.421   1.094
  227    HB3  ASP  29           2HB      ASP  29  -4.425 -10.216   0.358
  228    H    THR  30           H        THR  30  -2.059 -12.147  -0.927
  229    HA   THR  30           HA       THR  30  -0.154  -9.865  -0.500
  230    HB   THR  30           HB       THR  30   0.403 -12.557  -1.817
  231    HG1  THR  30           HG1      THR  30   1.813 -12.784   0.020
  232   HG21  THR  30          3HG2      THR  30   2.214 -10.177  -1.252
  233   HG22  THR  30          1HG2      THR  30   2.729 -11.739  -1.932
  234   HG23  THR  30          2HG2      THR  30   1.633 -10.684  -2.856
  235    H    TYR  31           H        TYR  31   0.198  -8.478  -2.078
  236    HA   TYR  31           HA       TYR  31  -1.190  -9.007  -4.687
  237    HB2  TYR  31           1HB      TYR  31  -0.948  -6.369  -3.231
  238    HB3  TYR  31           2HB      TYR  31  -1.754  -6.661  -4.791
  239    HD1  TYR  31           HD1      TYR  31  -3.846  -8.065  -4.835
  240    HD2  TYR  31           HD2      TYR  31  -2.094  -6.745  -1.179
  241    HE1  TYR  31           HE1      TYR  31  -5.970  -8.545  -3.654
  242    HE2  TYR  31           HE2      TYR  31  -4.207  -7.217   0.016
  243    HH   TYR  31           HH       TYR  31  -7.141  -7.707  -1.463
  244    H    THR  32           H        THR  32   0.304  -9.385  -6.126
  245    HA   THR  32           HA       THR  32   2.614  -7.473  -6.244
  246    HB   THR  32           HB       THR  32   3.914  -9.253  -7.329
  247    HG1  THR  32           HG1      THR  32   2.994 -11.388  -7.374
  248   HG21  THR  32          3HG2      THR  32   2.644 -10.185  -4.723
  249   HG22  THR  32          1HG2      THR  32   4.190 -10.759  -5.392
  250   HG23  THR  32          2HG2      THR  32   4.021  -9.067  -4.867
  251    H    LYS  33           H        LYS  33   0.060  -9.130  -7.972
  252    HA   LYS  33           HA       LYS  33   0.682  -7.384 -10.335
  253    HB2  LYS  33           1HB      LYS  33  -0.571 -10.132 -10.246
  254    HB3  LYS  33           2HB      LYS  33  -0.488  -9.092 -11.687
  255    HG2  LYS  33           1HG      LYS  33   1.966  -9.179 -11.618
  256    HG3  LYS  33           2HG      LYS  33   1.896 -10.198 -10.160
  257    HD2  LYS  33           1HD      LYS  33   0.708 -11.938 -11.426
  258    HD3  LYS  33           2HD      LYS  33   0.762 -10.919 -12.885
  259    HE2  LYS  33           1HE      LYS  33   3.218 -10.973 -12.832
  260    HE3  LYS  33           2HE      LYS  33   3.164 -11.994 -11.377
  261    HZ1  LYS  33           3HZ      LYS  33   2.094 -12.727 -14.027
  262    HZ2  LYS  33           1HZ      LYS  33   3.494 -13.298 -13.367
  263    HZ3  LYS  33           2HZ      LYS  33   2.044 -13.675 -12.678
  264    H    VAL  34           H        VAL  34  -1.183  -6.824 -11.661
  265    HA   VAL  34           HA       VAL  34  -3.442  -5.970  -9.917
  266    HB   VAL  34           HB       VAL  34  -2.816  -5.400 -12.845
  267   HG11  VAL  34          1HG1      VAL  34  -4.575  -3.676 -12.635
  268   HG12  VAL  34          2HG1      VAL  34  -5.234  -5.304 -12.341
  269   HG13  VAL  34          3HG1      VAL  34  -4.904  -4.215 -10.972
  270   HG21  VAL  34          3HG2      VAL  34  -1.178  -4.404 -11.361
  271   HG22  VAL  34          1HG2      VAL  34  -2.232  -3.158 -12.069
  272   HG23  VAL  34          2HG2      VAL  34  -2.477  -3.678 -10.384
  273    H    ASP  35           H        ASP  35  -5.253  -6.927  -9.691
  274    HA   ASP  35           HA       ASP  35  -6.351  -8.537 -11.933
  275    HB2  ASP  35           1HB      ASP  35  -4.942 -10.011 -10.144
  276    HB3  ASP  35           2HB      ASP  35  -6.402  -9.593  -9.212
  277    H    ASP  36           H        ASP  36  -8.579  -9.176 -11.604
  278    HA   ASP  36           HA       ASP  36 -10.052  -6.828 -10.715
  279    HB2  ASP  36           1HB      ASP  36 -11.009  -9.532 -11.827
  280    HB3  ASP  36           2HB      ASP  36 -11.975  -8.151 -11.254
  281    H    SER  37           H        SER  37  -9.392 -10.003  -9.386
  282    HA   SER  37           HA       SER  37 -11.436 -10.074  -7.335
  283    HB2  SER  37           1HB      SER  37 -10.242 -11.748  -6.352
  284    HB3  SER  37           2HB      SER  37 -10.244 -11.977  -8.116
  285    HG   SER  37           HG       SER  37  -8.189 -12.346  -7.173
  286    H    GLN  38           H        GLN  38  -8.588  -8.148  -7.748
  287    HA   GLN  38           HA       GLN  38  -8.177  -7.789  -4.832
  288    HB2  GLN  38           1HB      GLN  38  -6.762  -6.471  -7.153
  289    HB3  GLN  38           2HB      GLN  38  -6.248  -6.507  -5.451
  290    HG2  GLN  38           1HG      GLN  38  -5.695  -9.071  -5.736
  291    HG3  GLN  38           2HG      GLN  38  -6.668  -8.769  -7.194
  292   HE21  GLN  38          2HE2      GLN  38  -3.960  -9.928  -6.869
  293   HE22  GLN  38          1HE2      GLN  38  -2.912  -8.948  -7.841
  294    HA   PRO  39           HA       PRO  39 -10.501  -4.119  -4.277
  295    HB2  PRO  39           2HB      PRO  39  -9.644  -3.132  -2.283
  296    HB3  PRO  39           1HB      PRO  39  -7.986  -3.091  -2.898
  297    HG2  PRO  39           1HG      PRO  39  -7.860  -4.904  -1.382
  298    HG3  PRO  39           2HG      PRO  39  -9.519  -5.424  -1.704
  299    HD2  PRO  39           1HD      PRO  39  -7.025  -5.880  -3.383
  300    HD3  PRO  39           2HD      PRO  39  -8.382  -6.976  -3.089
  301    H    ALA  40           H        ALA  40 -10.906  -2.456  -5.472
  302    HA   ALA  40           HA       ALA  40  -9.313  -1.517  -7.570
  303    HB1  ALA  40           3HB      ALA  40 -11.278   0.062  -5.874
  304    HB2  ALA  40           1HB      ALA  40 -10.675   0.534  -7.481
  305    HB3  ALA  40           2HB      ALA  40 -11.678  -0.923  -7.301
  306    H    PHE  41           H        PHE  41  -9.399  -0.366  -4.200
  307    HA   PHE  41           HA       PHE  41  -7.500   1.719  -4.412
  308    HB2  PHE  41           1HB      PHE  41  -7.960  -0.258  -2.137
  309    HB3  PHE  41           2HB      PHE  41  -7.015   1.242  -2.010
  310    HD1  PHE  41           HD1      PHE  41 -10.292  -0.254  -1.993
  311    HD2  PHE  41           HD2      PHE  41  -8.147   3.428  -2.282
  312    HE1  PHE  41           HE1      PHE  41 -12.349   0.989  -1.410
  313    HE2  PHE  41           HE2      PHE  41 -10.199   4.674  -1.698
  314    HZ   PHE  41           HZ       PHE  41 -12.302   3.452  -1.264
  315    H    ILE  42           H        ILE  42  -6.948  -1.766  -3.936
  316    HA   ILE  42           HA       ILE  42  -4.062  -1.526  -3.797
  317    HB   ILE  42           HB       ILE  42  -5.878  -3.867  -4.525
  318   HG12  ILE  42          1HG1      ILE  42  -6.145  -3.055  -2.271
  319   HG13  ILE  42          2HG1      ILE  42  -5.424  -4.680  -2.328
  320   HG21  ILE  42          1HG2      ILE  42  -3.879  -5.279  -4.180
  321   HG22  ILE  42          2HG2      ILE  42  -3.634  -4.139  -5.525
  322   HG23  ILE  42          3HG2      ILE  42  -2.889  -3.821  -3.940
  323   HD11  ILE  42          3HD1      ILE  42  -3.922  -2.084  -1.842
  324   HD12  ILE  42          1HD1      ILE  42  -4.345  -3.289  -0.605
  325   HD13  ILE  42          2HD1      ILE  42  -3.200  -3.709  -1.901
  326    H    ASN  43           H        ASN  43  -6.311  -1.961  -6.475
  327    HA   ASN  43           HA       ASN  43  -4.296  -2.760  -8.375
  328    HB2  ASN  43           1HB      ASN  43  -7.113  -1.582  -8.987
  329    HB3  ASN  43           2HB      ASN  43  -5.715  -2.096  -9.963
  330   HD21  ASN  43          2HD2      ASN  43  -8.485  -3.127  -9.725
  331   HD22  ASN  43          1HD2      ASN  43  -8.313  -4.812  -9.364
  332    H    ASP  44           H        ASP  44  -5.825   0.402  -7.736
  333    HA   ASP  44           HA       ASP  44  -4.346   1.895  -9.647
  334    HB2  ASP  44           1HB      ASP  44  -5.470   2.767  -6.918
  335    HB3  ASP  44           2HB      ASP  44  -4.632   3.740  -8.152
  336    H    ILE  45           H        ILE  45  -3.547   1.134  -6.258
  337    HA   ILE  45           HA       ILE  45  -1.101   2.689  -6.258
  338    HB   ILE  45           HB       ILE  45  -2.044   0.369  -4.513
  339   HG12  ILE  45          1HG1      ILE  45  -1.853   3.294  -3.869
  340   HG13  ILE  45          2HG1      ILE  45  -3.323   2.504  -4.483
  341   HG21  ILE  45          1HG2      ILE  45  -0.229   1.033  -2.974
  342   HG22  ILE  45          2HG2      ILE  45   0.424   0.506  -4.542
  343   HG23  ILE  45          3HG2      ILE  45   0.333   2.240  -4.154
  344   HD11  ILE  45          3HD1      ILE  45  -1.876   1.811  -1.903
  345   HD12  ILE  45          1HD1      ILE  45  -3.393   2.730  -2.030
  346   HD13  ILE  45          2HD1      ILE  45  -3.346   1.018  -2.517
  347    H    LEU  46           H        LEU  46  -1.766  -0.727  -6.909
  348    HA   LEU  46           HA       LEU  46   0.913  -1.593  -7.202
  349    HB2  LEU  46           1HB      LEU  46  -1.641  -2.236  -8.488
  350    HB3  LEU  46           2HB      LEU  46  -0.226  -3.186  -9.002
  351    HG   LEU  46           HG       LEU  46  -1.342  -3.022  -6.174
  352   HD11  LEU  46          1HD1      LEU  46  -1.962  -5.424  -6.547
  353   HD12  LEU  46          2HD1      LEU  46  -2.779  -4.358  -7.713
  354   HD13  LEU  46          3HD1      LEU  46  -1.359  -5.306  -8.216
  355   HD21  LEU  46          3HD2      LEU  46   1.066  -3.297  -6.187
  356   HD22  LEU  46          1HD2      LEU  46   0.287  -4.807  -5.658
  357   HD23  LEU  46          2HD2      LEU  46   0.934  -4.668  -7.312
  358    H    LYS  47           H        LYS  47  -1.157   0.165  -9.467
  359    HA   LYS  47           HA       LYS  47   0.737  -0.132 -11.676
  360    HB2  LYS  47           1HB      LYS  47  -1.694   1.609 -11.254
  361    HB3  LYS  47           2HB      LYS  47  -0.733   1.578 -12.750
  362    HG2  LYS  47           1HG      LYS  47  -1.259  -0.823 -13.022
  363    HG3  LYS  47           2HG      LYS  47  -2.253  -0.759 -11.547
  364    HD2  LYS  47           1HD      LYS  47  -3.715   0.917 -12.602
  365    HD3  LYS  47           2HD      LYS  47  -2.722   0.855 -14.077
  366    HE2  LYS  47           1HE      LYS  47  -3.266  -1.532 -14.338
  367    HE3  LYS  47           2HE      LYS  47  -4.272  -1.459 -12.873
  368    HZ1  LYS  47           3HZ      LYS  47  -4.742   0.066 -15.354
  369    HZ2  LYS  47           1HZ      LYS  47  -5.591  -1.260 -14.869
  370    HZ3  LYS  47           2HZ      LYS  47  -5.675   0.135 -13.995
  371    H    VAL  48           H        VAL  48   0.417   1.990  -8.991
  372    HA   VAL  48           HA       VAL  48   1.820   4.287 -10.067
  373    HB   VAL  48           HB       VAL  48   1.626   3.198  -7.227
  374   HG11  VAL  48          1HG1      VAL  48   2.399   5.443  -6.541
  375   HG12  VAL  48          2HG1      VAL  48   3.626   4.618  -7.530
  376   HG13  VAL  48          3HG1      VAL  48   2.614   5.891  -8.250
  377   HG21  VAL  48          3HG2      VAL  48  -0.523   3.837  -8.146
  378   HG22  VAL  48          1HG2      VAL  48   0.001   4.991  -6.897
  379   HG23  VAL  48          2HG2      VAL  48   0.131   5.424  -8.619
  380    H    GLU  49           H        GLU  49   3.749   4.559 -10.731
  381    HA   GLU  49           HA       GLU  49   5.732   2.490 -10.670
  382    HB2  GLU  49           1HB      GLU  49   5.629   4.325 -12.317
  383    HB3  GLU  49           2HB      GLU  49   6.088   5.470 -11.034
  384    HG2  GLU  49           1HG      GLU  49   8.309   4.252 -10.801
  385    HG3  GLU  49           2HG      GLU  49   7.682   3.157 -12.052
  386    H    GLY  50           H        GLY  50   7.146   1.849  -9.256
  387    HA2  GLY  50           1HA      GLY  50   8.920   2.491  -7.671
  388    HA3  GLY  50           2HA      GLY  50   7.801   3.695  -6.994
  389    H    VAL  51           H        VAL  51   5.533   1.740  -7.257
  390    HA   VAL  51           HA       VAL  51   5.843   0.419  -4.647
  391    HB   VAL  51           HB       VAL  51   3.644   0.240  -6.750
  392   HG11  VAL  51          1HG1      VAL  51   2.299  -0.726  -4.916
  393   HG12  VAL  51          2HG1      VAL  51   3.719  -1.737  -5.270
  394   HG13  VAL  51          3HG1      VAL  51   3.717  -0.671  -3.845
  395   HG21  VAL  51          3HG2      VAL  51   3.871   2.485  -5.867
  396   HG22  VAL  51          1HG2      VAL  51   2.387   1.714  -5.261
  397   HG23  VAL  51          2HG2      VAL  51   3.810   1.856  -4.202
  398    H    LYS  52           H        LYS  52   6.549  -1.463  -4.162
  399    HA   LYS  52           HA       LYS  52   7.388  -3.223  -6.407
  400    HB2  LYS  52           1HB      LYS  52   9.028  -2.591  -4.704
  401    HB3  LYS  52           2HB      LYS  52   7.992  -3.308  -3.447
  402    HG2  LYS  52           1HG      LYS  52   8.283  -5.524  -4.431
  403    HG3  LYS  52           2HG      LYS  52   9.255  -4.832  -5.750
  404    HD2  LYS  52           1HD      LYS  52  10.922  -4.057  -4.094
  405    HD3  LYS  52           2HD      LYS  52   9.959  -4.800  -2.796
  406    HE2  LYS  52           1HE      LYS  52  10.263  -7.004  -3.787
  407    HE3  LYS  52           2HE      LYS  52  11.149  -6.290  -5.154
  408    HZ1  LYS  52           3HZ      LYS  52  12.016  -6.239  -2.335
  409    HZ2  LYS  52           1HZ      LYS  52  12.640  -7.211  -3.512
  410    HZ3  LYS  52           2HZ      LYS  52  12.839  -5.576  -3.603
  411    H    SER  53           H        SER  53   5.797  -3.617  -3.223
  412    HA   SER  53           HA       SER  53   3.773  -5.444  -4.430
  413    HB2  SER  53           1HB      SER  53   4.232  -7.318  -3.235
  414    HB3  SER  53           2HB      SER  53   5.676  -6.867  -4.171
  415    HG   SER  53           HG       SER  53   6.412  -5.867  -2.157
  416    H    ILE  54           H        ILE  54   2.079  -5.923  -2.969
  417    HA   ILE  54           HA       ILE  54   2.057  -4.290  -0.445
  418    HB   ILE  54           HB       ILE  54  -0.247  -4.689  -2.408
  419   HG12  ILE  54          1HG1      ILE  54   1.164  -2.133  -1.711
  420   HG13  ILE  54          2HG1      ILE  54   1.572  -3.137  -3.122
  421   HG21  ILE  54          1HG2      ILE  54  -1.455  -3.133  -0.916
  422   HG22  ILE  54          2HG2      ILE  54  -0.959  -4.603  -0.043
  423   HG23  ILE  54          3HG2      ILE  54  -0.049  -3.089   0.175
  424   HD11  ILE  54          3HD1      ILE  54  -1.125  -1.848  -2.574
  425   HD12  ILE  54          1HD1      ILE  54   0.079  -1.280  -3.751
  426   HD13  ILE  54          2HD1      ILE  54  -0.718  -2.853  -3.986
  427    H    PHE  55           H        PHE  55   1.455  -5.199   1.333
  428    HA   PHE  55           HA       PHE  55   0.090  -7.867   1.127
  429    HB2  PHE  55           1HB      PHE  55   2.382  -8.166   1.960
  430    HB3  PHE  55           2HB      PHE  55   2.115  -6.921   3.200
  431    HD1  PHE  55           HD1      PHE  55   0.815 -10.208   2.026
  432    HD2  PHE  55           HD2      PHE  55   1.400  -7.515   5.289
  433    HE1  PHE  55           HE1      PHE  55   0.026 -11.945   3.598
  434    HE2  PHE  55           HE2      PHE  55   0.615  -9.251   6.865
  435    HZ   PHE  55           HZ       PHE  55  -0.074 -11.467   6.017
  436    H    HIS  56           H        HIS  56  -1.799  -8.071   2.024
  437    HA   HIS  56           HA       HIS  56  -2.624  -6.005   4.037
  438    HB2  HIS  56           1HB      HIS  56  -4.014  -5.888   2.016
  439    HB3  HIS  56           2HB      HIS  56  -4.329  -7.637   2.102
  440    HD2  HIS  56           HD2      HIS  56  -5.643  -4.274   3.779
  441    HE1  HIS  56           HE1      HIS  56  -7.854  -7.610   5.206
  442    HE2  HIS  56           HE2      HIS  56  -7.633  -4.992   5.116
  443    H    VAL  57           H        VAL  57  -3.319  -6.569   5.981
  444    HA   VAL  57           HA       VAL  57  -4.519  -9.198   6.475
  445    HB   VAL  57           HB       VAL  57  -2.039  -9.700   6.649
  446   HG11  VAL  57          1HG1      VAL  57  -0.856  -8.817   8.633
  447   HG12  VAL  57          2HG1      VAL  57  -1.322  -7.502   7.528
  448   HG13  VAL  57          3HG1      VAL  57  -2.259  -7.792   9.014
  449   HG21  VAL  57          3HG2      VAL  57  -3.696 -11.039   7.802
  450   HG22  VAL  57          1HG2      VAL  57  -2.227 -10.860   8.790
  451   HG23  VAL  57          2HG2      VAL  57  -3.681  -9.909   9.177
  452    H    MET  58           H        MET  58  -5.689  -9.344   8.304
  453    HA   MET  58           HA       MET  58  -7.195  -8.412   9.812
  454    HB2  MET  58           1HB      MET  58  -4.893  -6.550  10.394
  455    HB3  MET  58           2HB      MET  58  -6.326  -6.821  11.414
  456    HG2  MET  58           1HG      MET  58  -4.182  -8.861  10.747
  457    HG3  MET  58           2HG      MET  58  -4.364  -8.003  12.295
  458    HE1  MET  58           3HE      MET  58  -7.410  -7.967  12.884
  459    HE2  MET  58           1HE      MET  58  -7.635  -9.495  13.769
  460    HE3  MET  58           2HE      MET  58  -6.192  -8.495  14.072
  461    H    ASP  59           H        ASP  59  -6.446  -5.338  10.372
  462    HA   ASP  59           HA       ASP  59  -8.043  -4.323   8.041
  463    HB2  ASP  59           1HB      ASP  59  -9.266  -4.380  10.385
  464    HB3  ASP  59           2HB      ASP  59  -7.978  -3.209  10.762
  465    H    PHE  60           H        PHE  60  -5.244  -4.481   8.032
  466    HA   PHE  60           HA       PHE  60  -4.743  -1.614   7.516
  467    HB2  PHE  60           1HB      PHE  60  -2.661  -1.531   8.764
  468    HB3  PHE  60           2HB      PHE  60  -3.949  -2.027   9.885
  469    HD1  PHE  60           HD1      PHE  60  -0.954  -3.083   8.062
  470    HD2  PHE  60           HD2      PHE  60  -4.002  -4.219  10.830
  471    HE1  PHE  60           HE1      PHE  60   0.377  -5.063   8.711
  472    HE2  PHE  60           HE2      PHE  60  -2.674  -6.200  11.484
  473    HZ   PHE  60           HZ       PHE  60  -0.484  -6.620  10.423
  474    H    ILE  61           H        ILE  61  -2.689  -1.263   6.366
  475    HA   ILE  61           HA       ILE  61  -2.016  -3.640   4.651
  476    HB   ILE  61           HB       ILE  61  -2.430  -0.743   3.775
  477   HG12  ILE  61          1HG1      ILE  61  -3.967  -3.249   3.141
  478   HG13  ILE  61          2HG1      ILE  61  -4.503  -1.893   4.160
  479   HG21  ILE  61          1HG2      ILE  61  -1.938  -1.598   1.508
  480   HG22  ILE  61          2HG2      ILE  61  -0.551  -1.835   2.596
  481   HG23  ILE  61          3HG2      ILE  61  -1.605  -3.210   2.187
  482   HD11  ILE  61          3HD1      ILE  61  -3.898  -1.752   1.186
  483   HD12  ILE  61          1HD1      ILE  61  -5.517  -1.778   1.917
  484   HD13  ILE  61          2HD1      ILE  61  -4.433  -0.395   2.205
  485    H    SER  62           H        SER  62  -0.003  -4.089   4.276
  486    HA   SER  62           HA       SER  62   2.111  -2.097   5.135
  487    HB2  SER  62           1HB      SER  62   2.224  -4.079   6.326
  488    HB3  SER  62           2HB      SER  62   2.246  -5.037   4.828
  489    HG   SER  62           HG       SER  62   4.172  -3.104   5.606
  490    H    VAL  63           H        VAL  63   2.887  -0.945   3.474
  491    HA   VAL  63           HA       VAL  63   3.041  -2.241   0.754
  492    HB   VAL  63           HB       VAL  63   2.796   0.710   1.472
  493   HG11  VAL  63          1HG1      VAL  63   2.555   1.014  -0.969
  494   HG12  VAL  63          2HG1      VAL  63   4.127   0.285  -0.566
  495   HG13  VAL  63          3HG1      VAL  63   2.814  -0.729  -1.212
  496   HG21  VAL  63          3HG2      VAL  63   0.713  -0.456   1.883
  497   HG22  VAL  63          1HG2      VAL  63   0.582   0.585   0.447
  498   HG23  VAL  63          2HG2      VAL  63   0.771  -1.174   0.256
  499    H    ASP  64           H        ASP  64   4.863  -2.494  -0.209
  500    HA   ASP  64           HA       ASP  64   7.247  -1.065   0.923
  501    HB2  ASP  64           1HB      ASP  64   8.582  -3.139   0.554
  502    HB3  ASP  64           2HB      ASP  64   7.153  -3.300   1.605
  503    H    LYS  65           H        LYS  65   8.871  -0.459  -0.459
  504    HA   LYS  65           HA       LYS  65   7.887  -0.183  -3.281
  505    HB2  LYS  65           1HB      LYS  65   8.969   1.940  -3.358
  506    HB3  LYS  65           2HB      LYS  65   7.865   1.890  -1.963
  507    HG2  LYS  65           1HG      LYS  65   9.725   1.595  -0.438
  508    HG3  LYS  65           2HG      LYS  65  10.867   1.467  -1.797
  509    HD2  LYS  65           1HD      LYS  65  10.438   3.768  -2.436
  510    HD3  LYS  65           2HD      LYS  65   9.169   3.910  -1.196
  511    HE2  LYS  65           1HE      LYS  65  11.122   4.963  -0.319
  512    HE3  LYS  65           2HE      LYS  65  10.925   3.416   0.534
  513    HZ1  LYS  65           3HZ      LYS  65  12.771   3.912  -1.711
  514    HZ2  LYS  65           1HZ      LYS  65  13.204   3.785  -0.125
  515    HZ3  LYS  65           2HZ      LYS  65  12.589   2.476  -0.919
  516    H    GLU  66           H        GLU  66   9.756   0.517  -4.774
  517    HA   GLU  66           HA       GLU  66  11.840  -1.545  -4.643
  518    HB2  GLU  66           1HB      GLU  66  11.383   0.779  -6.517
  519    HB3  GLU  66           2HB      GLU  66  12.658  -0.448  -6.701
  520    HG2  GLU  66           1HG      GLU  66  10.793  -2.216  -6.899
  521    HG3  GLU  66           2HG      GLU  66   9.695  -0.821  -6.780
  522    H    ASN  67           H        ASN  67  14.110  -1.093  -4.836
  523    HA   ASN  67           HA       ASN  67  14.996   0.577  -2.663
  524    HB2  ASN  67           1HB      ASN  67  16.765  -0.790  -4.827
  525    HB3  ASN  67           2HB      ASN  67  17.060   0.278  -3.436
  526   HD21  ASN  67          2HD2      ASN  67  17.826  -2.531  -4.022
  527   HD22  ASN  67          1HD2      ASN  67  17.276  -3.443  -2.655
  528    H    ASP  68           H        ASP  68  14.969   1.028  -6.178
  529    HA   ASP  68           HA       ASP  68  16.374   3.566  -6.086
  530    HB2  ASP  68           1HB      ASP  68  14.592   2.315  -8.262
  531    HB3  ASP  68           2HB      ASP  68  15.423   3.892  -8.254
  532    H    ALA  69           H        ALA  69  12.960   2.623  -6.041
  533    HA   ALA  69           HA       ALA  69  11.923   5.264  -6.393
  534    HB1  ALA  69           3HB      ALA  69  10.695   2.866  -4.990
  535    HB2  ALA  69           1HB      ALA  69   9.823   4.327  -5.510
  536    HB3  ALA  69           2HB      ALA  69  10.559   3.253  -6.723
  537    H    ASN  70           H        ASN  70  10.871   6.639  -4.879
  538    HA   ASN  70           HA       ASN  70  11.778   6.278  -2.040
  539    HB2  ASN  70           1HB      ASN  70  11.648   9.084  -3.372
  540    HB3  ASN  70           2HB      ASN  70  11.887   8.400  -1.746
  541   HD21  ASN  70          2HD2      ASN  70  13.285   9.073  -4.819
  542   HD22  ASN  70          1HD2      ASN  70  14.904   8.583  -4.443
  543    H    TRP  71           H        TRP  71  10.438   7.108  -0.422
  544    HA   TRP  71           HA       TRP  71   7.609   6.751  -0.966
  545    HB2  TRP  71           1HB      TRP  71   9.176   7.685   1.468
  546    HB3  TRP  71           2HB      TRP  71   7.400   7.574   1.447
  547    HD1  TRP  71           HD1      TRP  71  10.162   5.800   2.523
  548    HE1  TRP  71           HE1      TRP  71   9.686   3.153   2.789
  549    HE3  TRP  71           HE3      TRP  71   5.892   5.546  -0.222
  550    HZ2  TRP  71           HZ2      TRP  71   7.738   1.407   1.897
  551    HZ3  TRP  71           HZ3      TRP  71   4.754   3.431  -0.505
  552    HH2  TRP  71           HH2      TRP  71   5.609   1.365   0.511
  553    H    GLU  72           H        GLU  72   9.755   9.467  -1.020
  554    HA   GLU  72           HA       GLU  72   7.899  11.593  -0.657
  555    HB2  GLU  72           1HB      GLU  72  10.333  11.328  -2.422
  556    HB3  GLU  72           2HB      GLU  72   9.422  12.843  -2.208
  557    HG2  GLU  72           1HG      GLU  72  10.002  12.817   0.254
  558    HG3  GLU  72           2HG      GLU  72  10.771  11.246  -0.070
  559    H    THR  73           H        THR  73   8.585   9.601  -3.504
  560    HA   THR  73           HA       THR  73   6.497  11.026  -5.047
  561    HB   THR  73           HB       THR  73   8.169   8.570  -5.729
  562    HG1  THR  73           HG1      THR  73   9.346  10.566  -5.587
  563   HG21  THR  73          3HG2      THR  73   6.348  10.296  -7.455
  564   HG22  THR  73          1HG2      THR  73   7.371   8.961  -8.033
  565   HG23  THR  73          2HG2      THR  73   6.011   8.628  -6.933
  566    H    VAL  74           H        VAL  74   6.999   7.818  -3.567
  567    HA   VAL  74           HA       VAL  74   4.623   6.714  -4.862
  568    HB   VAL  74           HB       VAL  74   6.366   5.698  -2.579
  569   HG11  VAL  74          1HG1      VAL  74   5.239   3.529  -2.955
  570   HG12  VAL  74          2HG1      VAL  74   4.077   4.775  -2.443
  571   HG13  VAL  74          3HG1      VAL  74   4.170   4.294  -4.154
  572   HG21  VAL  74          3HG2      VAL  74   7.542   5.848  -4.692
  573   HG22  VAL  74          1HG2      VAL  74   7.243   4.150  -4.255
  574   HG23  VAL  74          2HG2      VAL  74   6.244   4.937  -5.501
  575    H    LEU  75           H        LEU  75   5.289   7.908  -1.569
  576    HA   LEU  75           HA       LEU  75   3.003   6.542  -0.485
  577    HB2  LEU  75           1HB      LEU  75   4.879   7.086   0.740
  578    HB3  LEU  75           2HB      LEU  75   4.688   8.852   0.622
  579    HG   LEU  75           HG       LEU  75   2.481   8.597   1.822
  580   HD11  LEU  75          1HD1      LEU  75   2.149   6.483   3.129
  581   HD12  LEU  75          2HD1      LEU  75   2.158   6.165   1.379
  582   HD13  LEU  75          3HD1      LEU  75   3.597   5.796   2.358
  583   HD21  LEU  75          3HD2      LEU  75   4.463   9.389   2.971
  584   HD22  LEU  75          1HD2      LEU  75   3.500   8.363   4.061
  585   HD23  LEU  75          2HD2      LEU  75   4.975   7.717   3.301
  586    HA   PRO  76           HA       PRO  76   0.984  11.033  -0.669
  587    HB2  PRO  76           2HB      PRO  76   1.802  12.793  -2.073
  588    HB3  PRO  76           1HB      PRO  76   2.310  11.676  -3.347
  589    HG2  PRO  76           1HG      PRO  76   4.383  12.243  -2.328
  590    HG3  PRO  76           2HG      PRO  76   3.683  12.304  -0.705
  591    HD2  PRO  76           1HD      PRO  76   4.431   9.864  -2.364
  592    HD3  PRO  76           2HD      PRO  76   4.612  10.121  -0.624
  593    H    LYS  77           H        LYS  77   1.857   9.142  -3.554
  594    HA   LYS  77           HA       LYS  77  -0.771   9.442  -4.751
  595    HB2  LYS  77           1HB      LYS  77   1.494   7.496  -5.200
  596    HB3  LYS  77           2HB      LYS  77  -0.009   7.509  -6.153
  597    HG2  LYS  77           1HG      LYS  77   0.483   9.807  -6.894
  598    HG3  LYS  77           2HG      LYS  77   1.990   9.786  -5.947
  599    HD2  LYS  77           1HD      LYS  77   2.810   7.895  -7.299
  600    HD3  LYS  77           2HD      LYS  77   1.308   7.931  -8.252
  601    HE2  LYS  77           1HE      LYS  77   1.821  10.221  -8.981
  602    HE3  LYS  77           2HE      LYS  77   3.322  10.189  -8.027
  603    HZ1  LYS  77           3HZ      LYS  77   2.697   8.416 -10.301
  604    HZ2  LYS  77           1HZ      LYS  77   3.729   9.701 -10.344
  605    HZ3  LYS  77           2HZ      LYS  77   4.089   8.385  -9.416
  606    H    VAL  78           H        VAL  78   0.787   6.842  -2.871
  607    HA   VAL  78           HA       VAL  78  -1.422   5.052  -2.719
  608    HB   VAL  78           HB       VAL  78   0.661   5.780  -0.622
  609   HG11  VAL  78          1HG1      VAL  78   0.015   3.656   0.465
  610   HG12  VAL  78          2HG1      VAL  78  -1.353   4.794   0.418
  611   HG13  VAL  78          3HG1      VAL  78  -1.282   3.437  -0.731
  612   HG21  VAL  78          3HG2      VAL  78   1.616   4.855  -2.647
  613   HG22  VAL  78          1HG2      VAL  78   1.730   3.693  -1.305
  614   HG23  VAL  78          2HG2      VAL  78   0.494   3.475  -2.567
  615    H    GLU  79           H        GLU  79  -0.675   7.758  -0.514
  616    HA   GLU  79           HA       GLU  79  -3.039   7.605   1.030
  617    HB2  GLU  79           1HB      GLU  79  -1.161   9.056   1.559
  618    HB3  GLU  79           2HB      GLU  79  -1.497  10.038   0.114
  619    HG2  GLU  79           1HG      GLU  79  -3.740  10.687   1.152
  620    HG3  GLU  79           2HG      GLU  79  -3.241   9.653   2.511
  621    H    ALA  80           H        ALA  80  -2.491   9.321  -2.044
  622    HA   ALA  80           HA       ALA  80  -5.032  10.540  -2.223
  623    HB1  ALA  80           3HB      ALA  80  -3.277   9.471  -4.461
  624    HB2  ALA  80           1HB      ALA  80  -4.617  10.627  -4.651
  625    HB3  ALA  80           2HB      ALA  80  -3.169  11.087  -3.724
  626    H    VAL  81           H        VAL  81  -4.005   7.270  -3.125
  627    HA   VAL  81           HA       VAL  81  -6.447   6.572  -4.532
  628    HB   VAL  81           HB       VAL  81  -4.308   4.870  -3.191
  629   HG11  VAL  81          1HG1      VAL  81  -5.300   2.980  -4.438
  630   HG12  VAL  81          2HG1      VAL  81  -6.465   3.665  -3.279
  631   HG13  VAL  81          3HG1      VAL  81  -6.605   4.045  -5.013
  632   HG21  VAL  81          3HG2      VAL  81  -3.498   6.146  -5.083
  633   HG22  VAL  81          1HG2      VAL  81  -3.586   4.415  -5.480
  634   HG23  VAL  81          2HG2      VAL  81  -4.829   5.531  -6.092
  635    H    PHE  82           H        PHE  82  -5.371   5.927  -1.197
  636    HA   PHE  82           HA       PHE  82  -7.801   4.623  -0.404
  637    HB2  PHE  82           1HB      PHE  82  -5.754   6.187   1.227
  638    HB3  PHE  82           2HB      PHE  82  -7.049   5.182   1.914
  639    HD1  PHE  82           HD1      PHE  82  -6.788   3.013  -0.300
  640    HD2  PHE  82           HD2      PHE  82  -4.007   4.975   2.282
  641    HE1  PHE  82           HE1      PHE  82  -5.307   1.035  -0.394
  642    HE2  PHE  82           HE2      PHE  82  -2.523   3.001   2.189
  643    HZ   PHE  82           HZ       PHE  82  -3.175   1.030   0.850
  644    H    GLU  83           H        GLU  83  -6.996   7.974  -0.867
  645    HA   GLU  83           HA       GLU  83  -9.273   8.929   0.743
  646    HB2  GLU  83           1HB      GLU  83  -7.279  10.286  -1.070
  647    HB3  GLU  83           2HB      GLU  83  -8.609  11.135  -0.245
  648    HG2  GLU  83           1HG      GLU  83  -6.327   9.648   1.191
  649    HG3  GLU  83           2HG      GLU  83  -6.500  11.388   0.869
  650    H    LEU  84           H        LEU  84  -8.902   7.626  -2.325
  651    HA   LEU  84           HA       LEU  84 -10.811   9.208  -3.791
  652    HB2  LEU  84           1HB      LEU  84  -9.898   6.413  -3.902
  653    HB3  LEU  84           2HB      LEU  84 -10.985   7.005  -5.181
  654    HG   LEU  84           HG       LEU  84  -8.180   8.014  -4.564
  655   HD11  LEU  84          1HD1      LEU  84  -7.647   7.106  -6.843
  656   HD12  LEU  84          2HD1      LEU  84  -8.233   5.825  -5.756
  657   HD13  LEU  84          3HD1      LEU  84  -9.321   6.519  -6.982
  658   HD21  LEU  84          3HD2      LEU  84  -9.622   9.834  -5.262
  659   HD22  LEU  84          1HD2      LEU  84  -8.463   9.448  -6.557
  660   HD23  LEU  84          2HD2      LEU  84 -10.154   8.905  -6.685
  661    H    GLU  85           H        GLU  85 -11.135   6.527  -1.534
  662    HA   GLU  85           HA       GLU  85 -13.017   5.433  -0.716
  663    HB2  GLU  85           1HB      GLU  85 -14.284   8.100  -1.361
  664    HB3  GLU  85           2HB      GLU  85 -15.007   6.822  -0.356
  665    HG2  GLU  85           1HG      GLU  85 -13.056   7.114   1.284
  666    HG3  GLU  85           2HG      GLU  85 -12.514   8.385   0.165
  667    H    HIS  86           H        HIS  86 -12.403   4.916  -3.394
  668    HA   HIS  86           HA       HIS  86 -15.061   4.739  -4.719
  669    HB2  HIS  86           1HB      HIS  86 -12.247   4.017  -5.649
  670    HB3  HIS  86           2HB      HIS  86 -13.720   3.745  -6.609
  671    HD1  HIS  86           HD1      HIS  86 -11.854   5.399  -8.034
  672    HD2  HIS  86           HD2      HIS  86 -14.443   7.156  -5.211
  673    HE1  HIS  86           HE1      HIS  86 -11.913   7.784  -8.566
  674    H    HIS  87           H        HIS  87 -16.306   3.044  -4.719
  675    HA   HIS  87           HA       HIS  87 -15.138   0.427  -3.855
  676    HB2  HIS  87           1HB      HIS  87 -17.772   1.626  -2.882
  677    HB3  HIS  87           2HB      HIS  87 -17.146   0.009  -2.481
  678    HD1  HIS  87           HD1      HIS  87 -14.749   0.059  -1.161
  679    HD2  HIS  87           HD2      HIS  87 -16.992   3.624  -1.049
  680    HE1  HIS  87           HE1      HIS  87 -13.928   1.310   0.768
  681    H    HIS  88           H        HIS  88 -16.760   2.142  -6.183
  682    HA   HIS  88           HA       HIS  88 -17.842  -0.404  -7.325
  683    HB2  HIS  88           1HB      HIS  88 -19.181   2.336  -7.448
  684    HB3  HIS  88           2HB      HIS  88 -19.744   0.861  -8.270
  685    HD2  HIS  88           HD2      HIS  88 -20.193   2.651  -4.823
  686    HE1  HIS  88           HE1      HIS  88 -21.758  -1.288  -4.555
  687    HE2  HIS  88           HE2      HIS  88 -21.557   1.079  -3.433
  688    H    HIS  89           H        HIS  89 -18.149  -0.341  -9.662
  689    HA   HIS  89           HA       HIS  89 -15.772   0.725 -10.960
  690    HB2  HIS  89           1HB      HIS  89 -16.630  -0.339 -12.968
  691    HB3  HIS  89           2HB      HIS  89 -16.918  -1.446 -11.605
  692    HD1  HIS  89           HD1      HIS  89 -18.707   0.884 -13.971
  693    HD2  HIS  89           HD2      HIS  89 -19.666  -2.114 -11.170
  694    HE1  HIS  89           HE1      HIS  89 -21.106   0.486 -14.204
  695    H    HIS  90           H        HIS  90 -15.912   1.926 -13.031
  696    HA   HIS  90           HA       HIS  90 -17.549   4.356 -12.569
  697    HB2  HIS  90           1HB      HIS  90 -15.247   3.718 -14.462
  698    HB3  HIS  90           2HB      HIS  90 -16.156   5.246 -14.506
  699    HD2  HIS  90           HD2      HIS  90 -13.189   3.621 -12.495
  700    HE1  HIS  90           HE1      HIS  90 -14.244   7.336 -10.724
  701    HE2  HIS  90           HE2      HIS  90 -12.515   5.358 -10.824
  702    H    HIS  91           H        HIS  91 -19.636   4.363 -15.368
  703    HA   HIS  91           HA       HIS  91 -17.853   5.855 -13.511
  704    HB2  HIS  91           1HB      HIS  91 -20.129   6.784 -15.321
  705    HB3  HIS  91           2HB      HIS  91 -19.152   7.846 -14.279
  706    HD2  HIS  91           HD2      HIS  91 -19.003   6.313 -17.881
  707    HE1  HIS  91           HE1      HIS  91 -15.247   8.067 -16.951
  708    HE2  HIS  91           HE2      HIS  91 -16.791   7.021 -18.807
  Start of MODEL    7
    1    H1   MET   1           1H       MET   1 -13.961   1.572   1.919
    2    H2   MET   1           2H       MET   1 -14.094   1.628   3.412
    3    H3   MET   1           3H       MET   1 -14.090   2.896   2.611
    4    HA   MET   1           HA       MET   1 -11.788   1.711   3.773
    5    HB2  MET   1           1HB      MET   1 -11.881   1.681   0.759
    6    HB3  MET   1           2HB      MET   1 -10.374   1.610   1.705
    7    HG2  MET   1           1HG      MET   1 -11.096  -0.481   2.738
    8    HG3  MET   1           2HG      MET   1 -12.638  -0.403   1.852
    9    HE1  MET   1           3HE      MET   1  -8.867  -1.288   1.769
   10    HE2  MET   1           1HE      MET   1  -8.488  -1.333   0.030
   11    HE3  MET   1           2HE      MET   1  -8.842   0.221   0.824
   12    H    LYS   2           H        LYS   2 -11.214   3.478   4.785
   13    HA   LYS   2           HA       LYS   2 -10.171   5.676   3.067
   14    HB2  LYS   2           1HB      LYS   2 -12.426   6.317   3.890
   15    HB3  LYS   2           2HB      LYS   2 -11.827   6.119   5.555
   16    HG2  LYS   2           1HG      LYS   2 -10.285   7.940   5.299
   17    HG3  LYS   2           2HG      LYS   2 -10.606   8.041   3.552
   18    HD2  LYS   2           1HD      LYS   2 -12.913   8.727   3.992
   19    HD3  LYS   2           2HD      LYS   2 -12.643   8.568   5.744
   20    HE2  LYS   2           1HE      LYS   2 -10.979  10.339   5.687
   21    HE3  LYS   2           2HE      LYS   2 -11.125  10.456   3.918
   22    HZ1  LYS   2           3HZ      LYS   2 -13.266  11.047   5.858
   23    HZ2  LYS   2           1HZ      LYS   2 -12.387  12.171   5.030
   24    HZ3  LYS   2           2HZ      LYS   2 -13.403  11.157   4.218
   25    H    ILE   3           H        ILE   3  -8.274   6.460   3.647
   26    HA   ILE   3           HA       ILE   3  -6.756   4.899   5.588
   27    HB   ILE   3           HB       ILE   3  -5.858   5.978   3.410
   28   HG12  ILE   3          1HG1      ILE   3  -4.324   6.567   5.922
   29   HG13  ILE   3          2HG1      ILE   3  -4.546   4.937   5.247
   30   HG21  ILE   3          1HG2      ILE   3  -5.030   8.292   3.661
   31   HG22  ILE   3          2HG2      ILE   3  -6.802   8.230   3.794
   32   HG23  ILE   3          3HG2      ILE   3  -5.806   8.397   5.259
   33   HD11  ILE   3          3HD1      ILE   3  -3.194   7.270   3.848
   34   HD12  ILE   3          1HD1      ILE   3  -2.368   5.880   4.589
   35   HD13  ILE   3          2HD1      ILE   3  -3.419   5.640   3.173
   36    H    ILE   4           H        ILE   4  -5.817   5.430   7.465
   37    HA   ILE   4           HA       ILE   4  -6.919   7.890   8.800
   38    HB   ILE   4           HB       ILE   4  -5.845   5.298  10.007
   39   HG12  ILE   4          1HG1      ILE   4  -8.628   6.435  10.035
   40   HG13  ILE   4          2HG1      ILE   4  -8.057   5.136   8.962
   41   HG21  ILE   4          1HG2      ILE   4  -6.532   6.285  12.165
   42   HG22  ILE   4          2HG2      ILE   4  -5.291   7.283  11.373
   43   HG23  ILE   4          3HG2      ILE   4  -6.998   7.786  11.333
   44   HD11  ILE   4          3HD1      ILE   4  -8.142   5.025  11.997
   45   HD12  ILE   4          1HD1      ILE   4  -9.281   4.219  10.894
   46   HD13  ILE   4          2HD1      ILE   4  -7.571   3.726  10.924
   47    H    SER   5           H        SER   5  -3.978   5.873   8.697
   48    HA   SER   5           HA       SER   5  -2.251   8.281   8.591
   49    HB2  SER   5           1HB      SER   5  -2.856   8.459  10.819
   50    HB3  SER   5           2HB      SER   5  -2.410   6.764  11.124
   51    HG   SER   5           HG       SER   5  -0.748   8.234  11.686
   52    H    ILE   6           H        ILE   6  -0.119   7.757   8.141
   53    HA   ILE   6           HA       ILE   6   0.471   4.833   7.734
   54    HB   ILE   6           HB       ILE   6   1.575   7.268   6.259
   55   HG12  ILE   6          1HG1      ILE   6  -0.181   5.035   5.275
   56   HG13  ILE   6          2HG1      ILE   6  -0.719   6.684   5.671
   57   HG21  ILE   6          1HG2      ILE   6   2.751   5.601   4.862
   58   HG22  ILE   6          2HG2      ILE   6   3.260   5.488   6.563
   59   HG23  ILE   6          3HG2      ILE   6   2.124   4.294   5.895
   60   HD11  ILE   6          3HD1      ILE   6   1.275   5.934   3.504
   61   HD12  ILE   6          1HD1      ILE   6  -0.420   6.404   3.241
   62   HD13  ILE   6          2HD1      ILE   6   0.739   7.584   3.900
   63    H    SER   7           H        SER   7   1.884   3.925   8.924
   64    HA   SER   7           HA       SER   7   3.803   5.655  10.502
   65    HB2  SER   7           1HB      SER   7   3.903   3.977  12.074
   66    HB3  SER   7           2HB      SER   7   2.224   4.494  11.806
   67    HG   SER   7           HG       SER   7   2.441   2.219  11.945
   68    H    GLU   8           H        GLU   8   5.905   4.715  10.914
   69    HA   GLU   8           HA       GLU   8   6.988   3.380   8.487
   70    HB2  GLU   8           1HB      GLU   8   8.326   4.647  10.883
   71    HB3  GLU   8           2HB      GLU   8   9.172   3.923   9.493
   72    HG2  GLU   8           1HG      GLU   8   8.104   5.695   7.995
   73    HG3  GLU   8           2HG      GLU   8   7.324   6.273   9.484
   74    H    THR   9           H        THR   9   8.760   1.794   8.815
   75    HA   THR   9           HA       THR   9   8.199  -0.015  11.131
   76    HB   THR   9           HB       THR   9   8.094  -1.953   9.748
   77    HG1  THR   9           HG1      THR   9   8.450  -0.444   7.379
   78   HG21  THR   9          3HG2      THR   9   6.506   0.240   8.358
   79   HG22  THR   9          1HG2      THR   9   6.184  -1.505   8.247
   80   HG23  THR   9          2HG2      THR   9   5.988  -0.661   9.801
   81    HA   PRO  10           HA       PRO  10  12.442  -0.643  11.716
   82    HB2  PRO  10           2HB      PRO  10  12.804  -2.866  12.512
   83    HB3  PRO  10           1HB      PRO  10  12.050  -3.603  11.092
   84    HG2  PRO  10           1HG      PRO  10  10.352  -3.886  12.723
   85    HG3  PRO  10           2HG      PRO  10  10.724  -2.353  13.523
   86    HD2  PRO  10           1HD      PRO  10   9.174  -2.829  10.949
   87    HD3  PRO  10           2HD      PRO  10   8.873  -1.640  12.224
   88    H    ASN  11           H        ASN  11  11.084  -2.256   8.874
   89    HA   ASN  11           HA       ASN  11  13.634  -1.621   7.438
   90    HB2  ASN  11           1HB      ASN  11  12.521  -4.070   7.134
   91    HB3  ASN  11           2HB      ASN  11  11.284  -2.945   6.520
   92   HD21  ASN  11          2HD2      ASN  11  12.684  -5.113   5.171
   93   HD22  ASN  11          1HD2      ASN  11  13.469  -4.402   3.801
   94    H    HIS  12           H        HIS  12  13.757   0.274   6.539
   95    HA   HIS  12           HA       HIS  12  11.423   1.973   6.381
   96    HB2  HIS  12           1HB      HIS  12  12.931   3.683   5.636
   97    HB3  HIS  12           2HB      HIS  12  13.857   2.704   6.799
   98    HD2  HIS  12           HD2      HIS  12  14.061   3.799   3.015
   99    HE1  HIS  12           HE1      HIS  12  17.164   1.031   3.876
  100    HE2  HIS  12           HE2      HIS  12  16.161   2.748   2.158
  101    H    ASN  13           H        ASN  13  12.713  -0.347   4.257
  102    HA   ASN  13           HA       ASN  13  11.907   0.889   1.756
  103    HB2  ASN  13           1HB      ASN  13  12.511  -2.117   2.288
  104    HB3  ASN  13           2HB      ASN  13  11.940  -1.166   0.897
  105   HD21  ASN  13          2HD2      ASN  13  14.379  -2.724   1.241
  106   HD22  ASN  13          1HD2      ASN  13  15.693  -1.628   0.967
  107    H    THR  14           H        THR  14  10.221  -0.788   4.269
  108    HA   THR  14           HA       THR  14   7.738  -0.544   2.601
  109    HB   THR  14           HB       THR  14   8.218  -2.932   2.910
  110    HG1  THR  14           HG1      THR  14   6.253  -3.430   4.056
  111   HG21  THR  14          3HG2      THR  14   8.221  -2.275   5.883
  112   HG22  THR  14          1HG2      THR  14   8.312  -3.907   5.177
  113   HG23  THR  14          2HG2      THR  14   9.641  -2.749   4.921
  114    H    MET  15           H        MET  15   5.856   0.073   3.616
  115    HA   MET  15           HA       MET  15   6.199   1.199   6.372
  116    HB2  MET  15           1HB      MET  15   5.083   3.193   5.743
  117    HB3  MET  15           2HB      MET  15   6.479   2.956   4.664
  118    HG2  MET  15           1HG      MET  15   4.936   2.070   2.930
  119    HG3  MET  15           2HG      MET  15   3.564   2.428   4.007
  120    HE1  MET  15           3HE      MET  15   2.238   3.999   2.456
  121    HE2  MET  15           1HE      MET  15   2.975   5.262   1.443
  122    HE3  MET  15           2HE      MET  15   3.373   3.550   1.160
  123    H    LYS  16           H        LYS  16   4.218   1.643   7.495
  124    HA   LYS  16           HA       LYS  16   2.190  -0.447   6.795
  125    HB2  LYS  16           1HB      LYS  16   3.323  -0.830   8.889
  126    HB3  LYS  16           2HB      LYS  16   2.954   0.826   9.426
  127    HG2  LYS  16           1HG      LYS  16   0.527   0.262   9.350
  128    HG3  LYS  16           2HG      LYS  16   0.964  -1.415   8.947
  129    HD2  LYS  16           1HD      LYS  16   2.126  -1.677  11.055
  130    HD3  LYS  16           2HD      LYS  16   1.885   0.042  11.444
  131    HE2  LYS  16           1HE      LYS  16  -0.544  -0.303  11.491
  132    HE3  LYS  16           2HE      LYS  16  -0.313  -2.018  11.087
  133    HZ1  LYS  16           3HZ      LYS  16   0.663  -0.685  13.531
  134    HZ2  LYS  16           1HZ      LYS  16  -0.638  -1.695  13.445
  135    HZ3  LYS  16           2HZ      LYS  16   0.879  -2.277  13.158
  136    H    ILE  17           H        ILE  17   0.197   0.050   6.319
  137    HA   ILE  17           HA       ILE  17  -0.611   2.934   6.623
  138    HB   ILE  17           HB       ILE  17  -1.417   0.913   4.479
  139   HG12  ILE  17          1HG1      ILE  17   0.256   3.395   4.203
  140   HG13  ILE  17          2HG1      ILE  17   0.905   1.744   4.337
  141   HG21  ILE  17          1HG2      ILE  17  -2.550   2.846   3.433
  142   HG22  ILE  17          2HG2      ILE  17  -3.213   2.512   5.051
  143   HG23  ILE  17          3HG2      ILE  17  -2.085   3.866   4.815
  144   HD11  ILE  17          3HD1      ILE  17  -0.928   2.762   2.137
  145   HD12  ILE  17          1HD1      ILE  17   0.821   2.479   1.987
  146   HD13  ILE  17          2HD1      ILE  17  -0.280   1.110   2.271
  147    H    THR  18           H        THR  18  -2.025   3.303   8.070
  148    HA   THR  18           HA       THR  18  -3.770   1.083   8.984
  149    HB   THR  18           HB       THR  18  -3.390   3.907  10.064
  150    HG1  THR  18           HG1      THR  18  -2.259   2.743  11.730
  151   HG21  THR  18          3HG2      THR  18  -4.861   1.504  11.215
  152   HG22  THR  18          1HG2      THR  18  -4.615   3.063  12.037
  153   HG23  THR  18          2HG2      THR  18  -5.623   2.977  10.571
  154    H    LEU  19           H        LEU  19  -5.753   0.781   8.390
  155    HA   LEU  19           HA       LEU  19  -7.156   3.051   7.018
  156    HB2  LEU  19           1HB      LEU  19  -7.441   0.135   6.704
  157    HB3  LEU  19           2HB      LEU  19  -8.329   1.282   5.674
  158    HG   LEU  19           HG       LEU  19  -5.323   0.813   5.709
  159   HD11  LEU  19          1HD1      LEU  19  -5.698   0.007   3.364
  160   HD12  LEU  19          2HD1      LEU  19  -6.621  -0.963   4.536
  161   HD13  LEU  19          3HD1      LEU  19  -7.445   0.280   3.566
  162   HD21  LEU  19          3HD2      LEU  19  -5.825   3.155   5.339
  163   HD22  LEU  19          1HD2      LEU  19  -5.239   2.415   3.831
  164   HD23  LEU  19          2HD2      LEU  19  -6.977   2.735   4.050
  165    H    SER  20           H        SER  20  -9.362   3.315   7.299
  166    HA   SER  20           HA       SER  20 -10.534   2.444   9.861
  167    HB2  SER  20           1HB      SER  20 -12.401   3.633   9.256
  168    HB3  SER  20           2HB      SER  20 -10.933   4.594   8.966
  169    HG   SER  20           HG       SER  20 -12.538   4.674   7.270
  170    H    GLU  21           H        GLU  21 -10.941   1.674   6.384
  171    HA   GLU  21           HA       GLU  21 -12.136  -0.935   7.236
  172    HB2  GLU  21           1HB      GLU  21 -13.000   0.803   4.919
  173    HB3  GLU  21           2HB      GLU  21 -13.545  -0.865   5.219
  174    HG2  GLU  21           1HG      GLU  21 -14.647  -0.100   7.360
  175    HG3  GLU  21           2HG      GLU  21 -13.936   1.494   7.012
  176    H    SER  22           H        SER  22 -11.888  -2.663   5.733
  177    HA   SER  22           HA       SER  22  -9.588  -2.305   3.787
  178    HB2  SER  22           1HB      SER  22  -8.900  -3.274   5.913
  179    HB3  SER  22           2HB      SER  22  -9.922  -4.672   5.512
  180    HG   SER  22           HG       SER  22  -7.885  -5.070   4.740
  181    H    ARG  23           H        ARG  23  -9.516  -4.854   2.862
  182    HA   ARG  23           HA       ARG  23 -11.655  -5.049   0.994
  183    HB2  ARG  23           1HB      ARG  23  -9.525  -6.042   0.609
  184    HB3  ARG  23           2HB      ARG  23  -9.801  -7.188   1.942
  185    HG2  ARG  23           1HG      ARG  23 -11.659  -8.194   0.735
  186    HG3  ARG  23           2HG      ARG  23 -11.488  -6.999  -0.571
  187    HD2  ARG  23           1HD      ARG  23  -9.357  -7.900  -1.164
  188    HD3  ARG  23           2HD      ARG  23  -9.423  -9.032   0.207
  189    HE   ARG  23           HE       ARG  23 -11.649  -9.670  -1.509
  190   HH11  ARG  23          1HH1      ARG  23  -8.168  -9.669  -1.722
  191   HH12  ARG  23          2HH1      ARG  23  -8.231 -11.005  -2.856
  192   HH21  ARG  23          2HH2      ARG  23 -10.267 -11.874  -3.479
  193   HH22  ARG  23          1HH2      ARG  23 -11.739 -11.193  -2.812
  194    H    GLU  24           H        GLU  24 -13.365  -6.477   0.766
  195    HA   GLU  24           HA       GLU  24 -15.202  -6.658   2.808
  196    HB2  GLU  24           1HB      GLU  24 -15.601  -7.288   0.461
  197    HB3  GLU  24           2HB      GLU  24 -14.685  -8.792   0.729
  198    HG2  GLU  24           1HG      GLU  24 -16.445  -9.520   2.408
  199    HG3  GLU  24           2HG      GLU  24 -17.202  -7.940   2.102
  200    H    GLY  25           H        GLY  25 -12.756  -9.167   2.095
  201    HA2  GLY  25           1HA      GLY  25 -13.181 -10.210   4.853
  202    HA3  GLY  25           2HA      GLY  25 -12.282 -11.024   3.552
  203    H    MET  26           H        MET  26 -11.798  -9.806   6.449
  204    HA   MET  26           HA       MET  26  -9.390  -8.163   5.809
  205    HB2  MET  26           1HB      MET  26 -10.912  -8.701   8.355
  206    HB3  MET  26           2HB      MET  26  -9.387  -7.786   8.275
  207    HG2  MET  26           1HG      MET  26 -10.454  -6.122   6.826
  208    HG3  MET  26           2HG      MET  26 -11.977  -7.042   6.881
  209    HE1  MET  26           3HE      MET  26 -13.156  -4.700   7.598
  210    HE2  MET  26           1HE      MET  26 -12.664  -3.760   9.026
  211    HE3  MET  26           2HE      MET  26 -11.574  -3.882   7.622
  212    H    THR  27           H        THR  27  -9.830 -11.259   5.721
  213    HA   THR  27           HA       THR  27  -7.676 -12.231   7.412
  214    HB   THR  27           HB       THR  27  -7.702 -14.212   5.971
  215    HG1  THR  27           HG1      THR  27  -9.118 -14.198   4.124
  216   HG21  THR  27          3HG2      THR  27 -10.512 -13.156   6.480
  217   HG22  THR  27          1HG2      THR  27 -10.073 -14.860   6.221
  218   HG23  THR  27          2HG2      THR  27  -9.488 -14.000   7.665
  219    H    SER  28           H        SER  28  -5.683 -13.193   6.519
  220    HA   SER  28           HA       SER  28  -4.027 -11.073   5.415
  221    HB2  SER  28           1HB      SER  28  -2.274 -12.523   5.550
  222    HB3  SER  28           2HB      SER  28  -3.277 -12.669   7.011
  223    HG   SER  28           HG       SER  28  -2.614 -14.698   6.185
  224    H    ASP  29           H        ASP  29  -3.004 -10.948   3.431
  225    HA   ASP  29           HA       ASP  29  -3.474 -12.891   1.307
  226    HB2  ASP  29           1HB      ASP  29  -5.661 -11.281   1.531
  227    HB3  ASP  29           2HB      ASP  29  -4.459 -10.199   0.786
  228    H    THR  30           H        THR  30  -2.460 -12.318  -0.701
  229    HA   THR  30           HA       THR  30  -0.271 -10.303  -0.297
  230    HB   THR  30           HB       THR  30  -0.097 -12.991  -1.726
  231    HG1  THR  30           HG1      THR  30   1.385 -13.434   0.011
  232   HG21  THR  30          3HG2      THR  30   2.001 -10.846  -1.213
  233   HG22  THR  30          1HG2      THR  30   2.296 -12.430  -1.965
  234   HG23  THR  30          2HG2      THR  30   1.271 -11.230  -2.789
  235    H    TYR  31           H        TYR  31   0.008  -8.821  -1.769
  236    HA   TYR  31           HA       TYR  31  -1.420  -9.168  -4.387
  237    HB2  TYR  31           1HB      TYR  31  -1.192  -6.659  -2.710
  238    HB3  TYR  31           2HB      TYR  31  -1.925  -6.782  -4.328
  239    HD1  TYR  31           HD1      TYR  31  -2.396  -7.380  -0.752
  240    HD2  TYR  31           HD2      TYR  31  -4.069  -7.985  -4.626
  241    HE1  TYR  31           HE1      TYR  31  -4.575  -7.942   0.285
  242    HE2  TYR  31           HE2      TYR  31  -6.251  -8.548  -3.608
  243    HH   TYR  31           HH       TYR  31  -6.742  -8.524  -0.070
  244    H    THR  32           H        THR  32  -0.001  -9.363  -5.919
  245    HA   THR  32           HA       THR  32   2.406  -7.569  -5.838
  246    HB   THR  32           HB       THR  32   3.649  -9.323  -7.042
  247    HG1  THR  32           HG1      THR  32   2.646 -11.413  -7.223
  248   HG21  THR  32          3HG2      THR  32   2.325 -10.366  -4.505
  249   HG22  THR  32          1HG2      THR  32   3.852 -10.957  -5.201
  250   HG23  THR  32          2HG2      THR  32   3.744  -9.295  -4.572
  251    H    LYS  33           H        LYS  33  -0.152  -9.031  -7.745
  252    HA   LYS  33           HA       LYS  33   0.623  -7.213 -10.005
  253    HB2  LYS  33           1HB      LYS  33  -0.476 -10.026 -10.122
  254    HB3  LYS  33           2HB      LYS  33  -0.324  -8.928 -11.515
  255    HG2  LYS  33           1HG      LYS  33   2.127  -8.871 -11.182
  256    HG3  LYS  33           2HG      LYS  33   1.957 -10.008  -9.823
  257    HD2  LYS  33           1HD      LYS  33   0.979 -11.680 -11.352
  258    HD3  LYS  33           2HD      LYS  33   1.171 -10.545 -12.708
  259    HE2  LYS  33           1HE      LYS  33   3.604 -10.532 -12.352
  260    HE3  LYS  33           2HE      LYS  33   3.411 -11.672 -11.000
  261    HZ1  LYS  33           3HZ      LYS  33   2.702 -12.212 -13.813
  262    HZ2  LYS  33           1HZ      LYS  33   4.032 -12.796 -13.030
  263    HZ3  LYS  33           2HZ      LYS  33   2.523 -13.268 -12.561
  264    H    VAL  34           H        VAL  34  -0.966  -6.219 -11.144
  265    HA   VAL  34           HA       VAL  34  -3.416  -5.632  -9.688
  266    HB   VAL  34           HB       VAL  34  -2.579  -5.042 -12.557
  267   HG11  VAL  34          1HG1      VAL  34  -4.433  -3.406 -12.536
  268   HG12  VAL  34          2HG1      VAL  34  -5.038  -5.063 -12.306
  269   HG13  VAL  34          3HG1      VAL  34  -4.905  -3.963 -10.914
  270   HG21  VAL  34          3HG2      VAL  34  -1.153  -3.971 -10.917
  271   HG22  VAL  34          1HG2      VAL  34  -2.187  -2.776 -11.734
  272   HG23  VAL  34          2HG2      VAL  34  -2.579  -3.309 -10.081
  273    H    ASP  35           H        ASP  35  -5.384  -6.343  -9.779
  274    HA   ASP  35           HA       ASP  35  -6.298  -8.091 -11.947
  275    HB2  ASP  35           1HB      ASP  35  -4.879  -9.592 -10.255
  276    HB3  ASP  35           2HB      ASP  35  -6.255  -9.154  -9.212
  277    H    ASP  36           H        ASP  36  -8.482  -8.449 -11.975
  278    HA   ASP  36           HA       ASP  36  -9.995  -6.276 -10.831
  279    HB2  ASP  36           1HB      ASP  36 -10.915  -8.818 -12.303
  280    HB3  ASP  36           2HB      ASP  36 -11.898  -7.498 -11.625
  281    H    SER  37           H        SER  37  -9.465  -9.610  -9.866
  282    HA   SER  37           HA       SER  37 -11.628  -9.818  -7.926
  283    HB2  SER  37           1HB      SER  37 -10.585 -11.703  -7.149
  284    HB3  SER  37           2HB      SER  37 -10.577 -11.690  -8.928
  285    HG   SER  37           HG       SER  37  -8.413 -11.144  -8.877
  286    H    GLN  38           H        GLN  38  -8.596  -8.127  -7.980
  287    HA   GLN  38           HA       GLN  38  -8.408  -8.037  -5.020
  288    HB2  GLN  38           1HB      GLN  38  -6.732  -6.701  -7.154
  289    HB3  GLN  38           2HB      GLN  38  -6.383  -6.752  -5.410
  290    HG2  GLN  38           1HG      GLN  38  -5.978  -9.374  -5.672
  291    HG3  GLN  38           2HG      GLN  38  -6.663  -8.957  -7.260
  292   HE21  GLN  38          2HE2      GLN  38  -5.043  -6.425  -7.323
  293   HE22  GLN  38          1HE2      GLN  38  -3.441  -6.931  -7.743
  294    HA   PRO  39           HA       PRO  39 -10.462  -4.220  -4.297
  295    HB2  PRO  39           2HB      PRO  39  -9.561  -3.378  -2.256
  296    HB3  PRO  39           1HB      PRO  39  -7.897  -3.438  -2.852
  297    HG2  PRO  39           1HG      PRO  39  -7.930  -5.312  -1.405
  298    HG3  PRO  39           2HG      PRO  39  -9.618  -5.696  -1.774
  299    HD2  PRO  39           1HD      PRO  39  -7.132  -6.257  -3.436
  300    HD3  PRO  39           2HD      PRO  39  -8.559  -7.273  -3.198
  301    H    ALA  40           H        ALA  40 -10.769  -2.701  -5.658
  302    HA   ALA  40           HA       ALA  40  -9.002  -1.784  -7.617
  303    HB1  ALA  40           3HB      ALA  40 -11.146  -0.197  -6.167
  304    HB2  ALA  40           1HB      ALA  40 -10.404   0.238  -7.723
  305    HB3  ALA  40           2HB      ALA  40 -11.391  -1.236  -7.590
  306    H    PHE  41           H        PHE  41  -9.378  -0.610  -4.285
  307    HA   PHE  41           HA       PHE  41  -7.548   1.554  -4.390
  308    HB2  PHE  41           1HB      PHE  41  -8.128  -0.400  -2.122
  309    HB3  PHE  41           2HB      PHE  41  -7.240   1.131  -1.948
  310    HD1  PHE  41           HD1      PHE  41 -10.518  -0.308  -2.930
  311    HD2  PHE  41           HD2      PHE  41  -8.353   3.121  -1.584
  312    HE1  PHE  41           HE1      PHE  41 -12.649   0.882  -2.538
  313    HE2  PHE  41           HE2      PHE  41 -10.483   4.313  -1.189
  314    HZ   PHE  41           HZ       PHE  41 -12.631   3.193  -1.668
  315    H    ILE  42           H        ILE  42  -6.903  -1.885  -3.686
  316    HA   ILE  42           HA       ILE  42  -4.036  -1.478  -3.409
  317    HB   ILE  42           HB       ILE  42  -5.685  -3.986  -3.965
  318   HG12  ILE  42          1HG1      ILE  42  -6.224  -3.024  -1.862
  319   HG13  ILE  42          2HG1      ILE  42  -5.274  -4.512  -1.638
  320   HG21  ILE  42          1HG2      ILE  42  -3.649  -5.223  -3.307
  321   HG22  ILE  42          2HG2      ILE  42  -3.355  -4.231  -4.753
  322   HG23  ILE  42          3HG2      ILE  42  -2.761  -3.687  -3.168
  323   HD11  ILE  42          3HD1      ILE  42  -4.213  -1.673  -1.413
  324   HD12  ILE  42          1HD1      ILE  42  -4.572  -2.761  -0.052
  325   HD13  ILE  42          2HD1      ILE  42  -3.263  -3.160  -1.190
  326    H    ASN  43           H        ASN  43  -6.140  -2.203  -6.119
  327    HA   ASN  43           HA       ASN  43  -4.028  -2.908  -7.953
  328    HB2  ASN  43           1HB      ASN  43  -6.861  -1.830  -8.662
  329    HB3  ASN  43           2HB      ASN  43  -5.411  -2.294  -9.585
  330   HD21  ASN  43          2HD2      ASN  43  -8.267  -3.374  -9.104
  331   HD22  ASN  43          1HD2      ASN  43  -8.008  -5.072  -8.869
  332    H    ASP  44           H        ASP  44  -5.674   0.186  -7.289
  333    HA   ASP  44           HA       ASP  44  -4.142   1.794  -9.065
  334    HB2  ASP  44           1HB      ASP  44  -5.386   2.513  -6.343
  335    HB3  ASP  44           2HB      ASP  44  -4.520   3.557  -7.496
  336    H    ILE  45           H        ILE  45  -3.479   0.883  -5.682
  337    HA   ILE  45           HA       ILE  45  -1.052   2.411  -5.449
  338    HB   ILE  45           HB       ILE  45  -1.964  -0.138  -4.041
  339   HG12  ILE  45          1HG1      ILE  45  -1.896   2.681  -3.013
  340   HG13  ILE  45          2HG1      ILE  45  -3.318   1.943  -3.784
  341   HG21  ILE  45          1HG2      ILE  45  -0.216   0.385  -2.376
  342   HG22  ILE  45          2HG2      ILE  45   0.496   0.086  -3.978
  343   HG23  ILE  45          3HG2      ILE  45   0.330   1.751  -3.376
  344   HD11  ILE  45          3HD1      ILE  45  -1.941   0.943  -1.267
  345   HD12  ILE  45          1HD1      ILE  45  -3.480   1.832  -1.329
  346   HD13  ILE  45          2HD1      ILE  45  -3.363   0.203  -2.039
  347    H    LEU  46           H        LEU  46  -1.589  -0.945  -6.469
  348    HA   LEU  46           HA       LEU  46   1.139  -1.599  -6.928
  349    HB2  LEU  46           1HB      LEU  46  -1.404  -2.309  -8.213
  350    HB3  LEU  46           2HB      LEU  46   0.065  -3.149  -8.764
  351    HG   LEU  46           HG       LEU  46  -1.043  -3.195  -5.930
  352   HD11  LEU  46          1HD1      LEU  46  -1.599  -5.588  -6.436
  353   HD12  LEU  46          2HD1      LEU  46  -2.465  -4.480  -7.525
  354   HD13  LEU  46          3HD1      LEU  46  -1.026  -5.353  -8.103
  355   HD21  LEU  46          3HD2      LEU  46   1.373  -3.396  -5.993
  356   HD22  LEU  46          1HD2      LEU  46   0.646  -4.957  -5.544
  357   HD23  LEU  46          2HD2      LEU  46   1.262  -4.703  -7.196
  358    H    LYS  47           H        LYS  47  -1.151   0.222  -8.901
  359    HA   LYS  47           HA       LYS  47   0.614   0.266 -11.230
  360    HB2  LYS  47           1HB      LYS  47  -1.866   1.810 -10.466
  361    HB3  LYS  47           2HB      LYS  47  -0.991   2.035 -11.999
  362    HG2  LYS  47           1HG      LYS  47  -1.415  -0.312 -12.594
  363    HG3  LYS  47           2HG      LYS  47  -2.283  -0.546 -11.058
  364    HD2  LYS  47           1HD      LYS  47  -3.933   1.153 -11.728
  365    HD3  LYS  47           2HD      LYS  47  -3.066   1.389 -13.264
  366    HE2  LYS  47           1HE      LYS  47  -3.473  -0.969 -13.850
  367    HE3  LYS  47           2HE      LYS  47  -4.361  -1.188 -12.324
  368    HZ1  LYS  47           3HZ      LYS  47  -5.124   0.650 -14.502
  369    HZ2  LYS  47           1HZ      LYS  47  -5.848  -0.794 -14.169
  370    HZ3  LYS  47           2HZ      LYS  47  -5.948   0.447 -13.087
  371    H    VAL  48           H        VAL  48   0.285   2.138  -8.337
  372    HA   VAL  48           HA       VAL  48   1.627   4.544  -9.207
  373    HB   VAL  48           HB       VAL  48   1.581   3.155  -6.494
  374   HG11  VAL  48          1HG1      VAL  48   2.324   5.341  -5.608
  375   HG12  VAL  48          2HG1      VAL  48   3.527   4.661  -6.729
  376   HG13  VAL  48          3HG1      VAL  48   2.448   5.972  -7.267
  377   HG21  VAL  48          3HG2      VAL  48  -0.624   3.819  -7.247
  378   HG22  VAL  48          1HG2      VAL  48  -0.075   4.853  -5.907
  379   HG23  VAL  48          2HG2      VAL  48  -0.036   5.468  -7.578
  380    H    GLU  49           H        GLU  49   3.512   4.903  -9.950
  381    HA   GLU  49           HA       GLU  49   5.480   2.849 -10.246
  382    HB2  GLU  49           1HB      GLU  49   5.276   4.865 -11.660
  383    HB3  GLU  49           2HB      GLU  49   5.844   5.850 -10.290
  384    HG2  GLU  49           1HG      GLU  49   8.057   4.594 -10.369
  385    HG3  GLU  49           2HG      GLU  49   7.324   3.662 -11.692
  386    H    GLY  50           H        GLY  50   6.840   1.968  -8.923
  387    HA2  GLY  50           1HA      GLY  50   8.818   2.473  -7.495
  388    HA3  GLY  50           2HA      GLY  50   7.778   3.597  -6.590
  389    H    VAL  51           H        VAL  51   5.492   1.629  -6.908
  390    HA   VAL  51           HA       VAL  51   5.978   0.162  -4.404
  391    HB   VAL  51           HB       VAL  51   3.647   0.096  -6.367
  392   HG11  VAL  51          1HG1      VAL  51   2.427  -0.999  -4.516
  393   HG12  VAL  51          2HG1      VAL  51   3.824  -1.974  -5.027
  394   HG13  VAL  51          3HG1      VAL  51   3.914  -1.003  -3.539
  395   HG21  VAL  51          3HG2      VAL  51   3.925   2.279  -5.353
  396   HG22  VAL  51          1HG2      VAL  51   2.485   1.459  -4.705
  397   HG23  VAL  51          2HG2      VAL  51   3.974   1.543  -3.734
  398    H    LYS  52           H        LYS  52   6.756  -1.723  -4.085
  399    HA   LYS  52           HA       LYS  52   7.350  -3.395  -6.479
  400    HB2  LYS  52           1HB      LYS  52   9.178  -2.798  -4.957
  401    HB3  LYS  52           2HB      LYS  52   8.305  -3.580  -3.616
  402    HG2  LYS  52           1HG      LYS  52   8.478  -5.750  -4.758
  403    HG3  LYS  52           2HG      LYS  52   9.332  -4.974  -6.113
  404    HD2  LYS  52           1HD      LYS  52  11.138  -4.291  -4.568
  405    HD3  LYS  52           2HD      LYS  52  10.289  -5.106  -3.232
  406    HE2  LYS  52           1HE      LYS  52  10.497  -7.251  -4.377
  407    HE3  LYS  52           2HE      LYS  52  11.280  -6.457  -5.762
  408    HZ1  LYS  52           3HZ      LYS  52  12.358  -6.572  -3.017
  409    HZ2  LYS  52           1HZ      LYS  52  12.887  -7.474  -4.295
  410    HZ3  LYS  52           2HZ      LYS  52  13.085  -5.837  -4.303
  411    H    SER  53           H        SER  53   6.127  -3.867  -3.147
  412    HA   SER  53           HA       SER  53   4.282  -6.023  -4.168
  413    HB2  SER  53           1HB      SER  53   4.962  -7.602  -2.662
  414    HB3  SER  53           2HB      SER  53   6.329  -7.118  -3.691
  415    HG   SER  53           HG       SER  53   6.903  -7.308  -1.481
  416    H    ILE  54           H        ILE  54   2.533  -6.401  -2.817
  417    HA   ILE  54           HA       ILE  54   2.291  -4.657  -0.381
  418    HB   ILE  54           HB       ILE  54   0.124  -5.288  -2.437
  419   HG12  ILE  54          1HG1      ILE  54   1.361  -2.647  -1.708
  420   HG13  ILE  54          2HG1      ILE  54   1.782  -3.616  -3.140
  421   HG21  ILE  54          1HG2      ILE  54  -1.296  -3.826  -1.041
  422   HG22  ILE  54          2HG2      ILE  54  -0.729  -5.237  -0.119
  423   HG23  ILE  54          3HG2      ILE  54   0.034  -3.649   0.127
  424   HD11  ILE  54          3HD1      ILE  54  -0.954  -2.443  -2.528
  425   HD12  ILE  54          1HD1      ILE  54   0.207  -1.812  -3.718
  426   HD13  ILE  54          2HD1      ILE  54  -0.534  -3.413  -3.959
  427    H    PHE  55           H        PHE  55   1.649  -5.517   1.412
  428    HA   PHE  55           HA       PHE  55   0.473  -8.276   1.276
  429    HB2  PHE  55           1HB      PHE  55   2.782  -8.379   2.159
  430    HB3  PHE  55           2HB      PHE  55   2.372  -7.158   3.384
  431    HD1  PHE  55           HD1      PHE  55   1.207 -10.489   2.157
  432    HD2  PHE  55           HD2      PHE  55   1.810  -7.859   5.469
  433    HE1  PHE  55           HE1      PHE  55   0.504 -12.283   3.707
  434    HE2  PHE  55           HE2      PHE  55   1.110  -9.650   7.023
  435    HZ   PHE  55           HZ       PHE  55   0.456 -11.863   6.139
  436    H    HIS  56           H        HIS  56  -1.441  -8.521   2.096
  437    HA   HIS  56           HA       HIS  56  -2.512  -6.352   3.854
  438    HB2  HIS  56           1HB      HIS  56  -3.866  -6.814   1.848
  439    HB3  HIS  56           2HB      HIS  56  -3.946  -8.538   2.277
  440    HD1  HIS  56           HD1      HIS  56  -6.421  -8.710   2.577
  441    HD2  HIS  56           HD2      HIS  56  -4.765  -5.680   4.994
  442    HE1  HIS  56           HE1      HIS  56  -8.232  -7.939   4.026
  443    H    VAL  57           H        VAL  57  -2.701  -6.618   5.922
  444    HA   VAL  57           HA       VAL  57  -3.489  -9.294   6.985
  445    HB   VAL  57           HB       VAL  57  -1.040  -9.293   7.248
  446   HG11  VAL  57          1HG1      VAL  57   0.058  -7.556   8.623
  447   HG12  VAL  57          2HG1      VAL  57  -0.676  -6.850   7.163
  448   HG13  VAL  57          3HG1      VAL  57  -1.483  -6.675   8.740
  449   HG21  VAL  57          3HG2      VAL  57  -2.392 -10.307   8.985
  450   HG22  VAL  57          1HG2      VAL  57  -0.935  -9.555   9.674
  451   HG23  VAL  57          2HG2      VAL  57  -2.512  -8.745   9.829
  452    H    MET  58           H        MET  58  -4.896  -9.265   8.542
  453    HA   MET  58           HA       MET  58  -6.557  -8.370   9.904
  454    HB2  MET  58           1HB      MET  58  -4.374  -7.552  11.021
  455    HB3  MET  58           2HB      MET  58  -4.801  -5.973  10.319
  456    HG2  MET  58           1HG      MET  58  -6.973  -6.068  11.509
  457    HG3  MET  58           2HG      MET  58  -6.474  -7.603  12.258
  458    HE1  MET  58           3HE      MET  58  -3.491  -7.263  13.006
  459    HE2  MET  58           1HE      MET  58  -3.589  -6.555  14.635
  460    HE3  MET  58           2HE      MET  58  -4.722  -7.842  14.154
  461    H    ASP  59           H        ASP  59  -6.268  -5.172  10.045
  462    HA   ASP  59           HA       ASP  59  -7.876  -4.724   7.549
  463    HB2  ASP  59           1HB      ASP  59  -9.268  -3.108   8.817
  464    HB3  ASP  59           2HB      ASP  59  -9.162  -4.742   9.520
  465    H    PHE  60           H        PHE  60  -4.988  -4.482   7.948
  466    HA   PHE  60           HA       PHE  60  -4.804  -1.683   6.950
  467    HB2  PHE  60           1HB      PHE  60  -2.858  -1.185   8.318
  468    HB3  PHE  60           2HB      PHE  60  -4.180  -1.674   9.401
  469    HD1  PHE  60           HD1      PHE  60  -0.933  -2.591   7.988
  470    HD2  PHE  60           HD2      PHE  60  -4.089  -3.721  10.635
  471    HE1  PHE  60           HE1      PHE  60   0.539  -4.291   9.013
  472    HE2  PHE  60           HE2      PHE  60  -2.618  -5.422  11.665
  473    HZ   PHE  60           HZ       PHE  60  -0.305  -5.708  10.852
  474    H    ILE  61           H        ILE  61  -2.699  -1.242   5.909
  475    HA   ILE  61           HA       ILE  61  -1.941  -3.699   4.341
  476    HB   ILE  61           HB       ILE  61  -2.288  -0.834   3.340
  477   HG12  ILE  61          1HG1      ILE  61  -4.402  -1.890   3.850
  478   HG13  ILE  61          2HG1      ILE  61  -4.172  -1.603   2.110
  479   HG21  ILE  61          1HG2      ILE  61  -1.897  -1.834   1.114
  480   HG22  ILE  61          2HG2      ILE  61  -0.496  -2.083   2.182
  481   HG23  ILE  61          3HG2      ILE  61  -1.628  -3.420   1.872
  482   HD11  ILE  61          3HD1      ILE  61  -3.840  -4.268   3.531
  483   HD12  ILE  61          1HD1      ILE  61  -5.223  -3.794   2.517
  484   HD13  ILE  61          2HD1      ILE  61  -3.609  -3.980   1.790
  485    H    SER  62           H        SER  62   0.058  -4.216   4.141
  486    HA   SER  62           HA       SER  62   2.186  -2.238   4.978
  487    HB2  SER  62           1HB      SER  62   2.186  -4.186   6.230
  488    HB3  SER  62           2HB      SER  62   2.253  -5.186   4.761
  489    HG   SER  62           HG       SER  62   4.311  -4.813   5.742
  490    H    VAL  63           H        VAL  63   3.048  -1.148   3.313
  491    HA   VAL  63           HA       VAL  63   3.189  -2.498   0.618
  492    HB   VAL  63           HB       VAL  63   3.027   0.465   1.310
  493   HG11  VAL  63          1HG1      VAL  63   2.868   0.771  -1.137
  494   HG12  VAL  63          2HG1      VAL  63   4.408   0.001  -0.688
  495   HG13  VAL  63          3HG1      VAL  63   3.089  -0.977  -1.371
  496   HG21  VAL  63          3HG2      VAL  63   0.903  -0.644   1.658
  497   HG22  VAL  63          1HG2      VAL  63   0.844   0.397   0.219
  498   HG23  VAL  63          2HG2      VAL  63   0.992  -1.366   0.035
  499    H    ASP  64           H        ASP  64   5.026  -3.009  -0.164
  500    HA   ASP  64           HA       ASP  64   7.455  -1.627   0.929
  501    HB2  ASP  64           1HB      ASP  64   7.284  -4.183   1.332
  502    HB3  ASP  64           2HB      ASP  64   7.189  -4.224  -0.445
  503    H    LYS  65           H        LYS  65   8.638  -0.425  -0.321
  504    HA   LYS  65           HA       LYS  65   7.921  -0.341  -3.219
  505    HB2  LYS  65           1HB      LYS  65   8.900   1.825  -3.249
  506    HB3  LYS  65           2HB      LYS  65   7.765   1.724  -1.882
  507    HG2  LYS  65           1HG      LYS  65   9.567   1.553  -0.301
  508    HG3  LYS  65           2HG      LYS  65  10.766   1.379  -1.606
  509    HD2  LYS  65           1HD      LYS  65  10.330   3.652  -2.362
  510    HD3  LYS  65           2HD      LYS  65   9.036   3.833  -1.154
  511    HE2  LYS  65           1HE      LYS  65  10.944   4.929  -0.255
  512    HE3  LYS  65           2HE      LYS  65  10.775   3.393   0.624
  513    HZ1  LYS  65           3HZ      LYS  65  12.636   3.895  -1.609
  514    HZ2  LYS  65           1HZ      LYS  65  13.053   3.808  -0.017
  515    HZ3  LYS  65           2HZ      LYS  65  12.481   2.469  -0.794
  516    H    GLU  66           H        GLU  66   9.865   0.498  -4.587
  517    HA   GLU  66           HA       GLU  66  11.998  -1.526  -4.350
  518    HB2  GLU  66           1HB      GLU  66  11.510   0.707  -6.325
  519    HB3  GLU  66           2HB      GLU  66  12.831  -0.481  -6.426
  520    HG2  GLU  66           1HG      GLU  66  11.020  -2.316  -6.596
  521    HG3  GLU  66           2HG      GLU  66   9.885  -0.946  -6.587
  522    H    ASN  67           H        ASN  67  14.256  -0.975  -4.517
  523    HA   ASN  67           HA       ASN  67  15.008   0.761  -2.353
  524    HB2  ASN  67           1HB      ASN  67  16.897  -0.529  -4.462
  525    HB3  ASN  67           2HB      ASN  67  17.102   0.556  -3.066
  526   HD21  ASN  67          2HD2      ASN  67  18.032  -2.205  -3.610
  527   HD22  ASN  67          1HD2      ASN  67  17.485  -3.143  -2.260
  528    H    ASP  68           H        ASP  68  15.068   1.174  -5.875
  529    HA   ASP  68           HA       ASP  68  16.337   3.783  -5.765
  530    HB2  ASP  68           1HB      ASP  68  14.699   2.419  -7.986
  531    HB3  ASP  68           2HB      ASP  68  15.449   4.035  -7.970
  532    H    ALA  69           H        ALA  69  12.975   2.666  -5.842
  533    HA   ALA  69           HA       ALA  69  11.803   5.235  -6.242
  534    HB1  ALA  69           3HB      ALA  69  10.686   2.804  -4.806
  535    HB2  ALA  69           1HB      ALA  69   9.743   4.202  -5.369
  536    HB3  ALA  69           2HB      ALA  69  10.556   3.145  -6.547
  537    H    ASN  70           H        ASN  70  10.603   6.545  -4.753
  538    HA   ASN  70           HA       ASN  70  11.557   6.347  -1.916
  539    HB2  ASN  70           1HB      ASN  70  11.282   9.090  -3.354
  540    HB3  ASN  70           2HB      ASN  70  11.550   8.486  -1.701
  541   HD21  ASN  70          2HD2      ASN  70  12.919   9.069  -4.813
  542   HD22  ASN  70          1HD2      ASN  70  14.561   8.694  -4.407
  543    H    TRP  71           H        TRP  71  10.179   7.103  -0.317
  544    HA   TRP  71           HA       TRP  71   7.354   6.693  -0.864
  545    HB2  TRP  71           1HB      TRP  71   8.870   7.691   1.583
  546    HB3  TRP  71           2HB      TRP  71   7.107   7.454   1.540
  547    HD1  TRP  71           HD1      TRP  71   9.893   5.900   2.759
  548    HE1  TRP  71           HE1      TRP  71   9.635   3.217   2.975
  549    HE3  TRP  71           HE3      TRP  71   5.887   5.299  -0.311
  550    HZ2  TRP  71           HZ2      TRP  71   7.927   1.316   1.926
  551    HZ3  TRP  71           HZ3      TRP  71   4.970   3.096  -0.693
  552    HH2  TRP  71           HH2      TRP  71   5.924   1.101   0.378
  553    H    GLU  72           H        GLU  72   9.457   9.418  -0.997
  554    HA   GLU  72           HA       GLU  72   7.628  11.540  -0.524
  555    HB2  GLU  72           1HB      GLU  72   9.955  11.283  -2.429
  556    HB3  GLU  72           2HB      GLU  72   9.061  12.797  -2.155
  557    HG2  GLU  72           1HG      GLU  72   9.780  12.757   0.270
  558    HG3  GLU  72           2HG      GLU  72  10.529  11.188  -0.107
  559    H    THR  73           H        THR  73   8.150   9.571  -3.421
  560    HA   THR  73           HA       THR  73   6.003  11.028  -4.848
  561    HB   THR  73           HB       THR  73   7.626   8.570  -5.633
  562    HG1  THR  73           HG1      THR  73   8.644  10.123  -7.033
  563   HG21  THR  73          3HG2      THR  73   5.730  10.317  -7.253
  564   HG22  THR  73          1HG2      THR  73   6.719   8.983  -7.892
  565   HG23  THR  73          2HG2      THR  73   5.413   8.645  -6.731
  566    H    VAL  74           H        VAL  74   6.555   7.777  -3.484
  567    HA   VAL  74           HA       VAL  74   4.048   6.746  -4.570
  568    HB   VAL  74           HB       VAL  74   5.933   5.671  -2.431
  569   HG11  VAL  74          1HG1      VAL  74   4.730   3.533  -2.743
  570   HG12  VAL  74          2HG1      VAL  74   3.637   4.802  -2.142
  571   HG13  VAL  74          3HG1      VAL  74   3.598   4.334  -3.858
  572   HG21  VAL  74          3HG2      VAL  74   6.960   5.813  -4.621
  573   HG22  VAL  74          1HG2      VAL  74   6.652   4.119  -4.177
  574   HG23  VAL  74          2HG2      VAL  74   5.587   4.940  -5.343
  575    H    LEU  75           H        LEU  75   5.016   7.977  -1.380
  576    HA   LEU  75           HA       LEU  75   2.861   6.730   0.011
  577    HB2  LEU  75           1HB      LEU  75   4.867   7.563   0.927
  578    HB3  LEU  75           2HB      LEU  75   4.413   9.273   0.755
  579    HG   LEU  75           HG       LEU  75   2.743   7.292   2.328
  580   HD11  LEU  75          1HD1      LEU  75   3.843   8.198   4.392
  581   HD12  LEU  75          2HD1      LEU  75   5.020   7.381   3.340
  582   HD13  LEU  75          3HD1      LEU  75   4.937   9.159   3.369
  583   HD21  LEU  75          3HD2      LEU  75   1.623   9.325   1.629
  584   HD22  LEU  75          1HD2      LEU  75   1.861   9.338   3.392
  585   HD23  LEU  75          2HD2      LEU  75   2.915  10.318   2.344
  586    HA   PRO  76           HA       PRO  76   0.529  10.940  -0.253
  587    HB2  PRO  76           2HB      PRO  76   1.930  12.768  -0.839
  588    HB3  PRO  76           1HB      PRO  76   1.258  12.517  -2.455
  589    HG2  PRO  76           1HG      PRO  76   3.095  11.197  -3.166
  590    HG3  PRO  76           2HG      PRO  76   3.891  12.376  -2.115
  591    HD2  PRO  76           1HD      PRO  76   4.280   9.767  -1.640
  592    HD3  PRO  76           2HD      PRO  76   4.001  10.837  -0.261
  593    H    LYS  77           H        LYS  77   1.641   9.392  -3.238
  594    HA   LYS  77           HA       LYS  77  -0.902   9.634  -4.594
  595    HB2  LYS  77           1HB      LYS  77   1.429   7.739  -4.894
  596    HB3  LYS  77           2HB      LYS  77  -0.008   7.710  -5.944
  597    HG2  LYS  77           1HG      LYS  77   0.466  10.037  -6.634
  598    HG3  LYS  77           2HG      LYS  77   1.926  10.030  -5.615
  599    HD2  LYS  77           1HD      LYS  77   2.859   8.190  -6.943
  600    HD3  LYS  77           2HD      LYS  77   1.391   8.159  -7.949
  601    HE2  LYS  77           1HE      LYS  77   1.843  10.490  -8.644
  602    HE3  LYS  77           2HE      LYS  77   3.338  10.470  -7.680
  603    HZ1  LYS  77           3HZ      LYS  77   2.754   8.710  -9.974
  604    HZ2  LYS  77           1HZ      LYS  77   3.767  10.012  -9.998
  605    HZ3  LYS  77           2HZ      LYS  77   4.140   8.691  -9.081
  606    H    VAL  78           H        VAL  78   0.551   7.055  -2.612
  607    HA   VAL  78           HA       VAL  78  -1.691   5.241  -2.783
  608    HB   VAL  78           HB       VAL  78   0.418   5.645  -0.622
  609   HG11  VAL  78          1HG1      VAL  78  -0.292   3.426   0.206
  610   HG12  VAL  78          2HG1      VAL  78  -1.623   4.604   0.307
  611   HG13  VAL  78          3HG1      VAL  78  -1.599   3.394  -1.000
  612   HG21  VAL  78          3HG2      VAL  78   1.335   4.942  -2.752
  613   HG22  VAL  78          1HG2      VAL  78   1.417   3.622  -1.562
  614   HG23  VAL  78          2HG2      VAL  78   0.170   3.598  -2.831
  615    H    GLU  79           H        GLU  79  -0.930   7.807  -0.439
  616    HA   GLU  79           HA       GLU  79  -3.218   7.473   1.204
  617    HB2  GLU  79           1HB      GLU  79  -1.316   8.966   1.679
  618    HB3  GLU  79           2HB      GLU  79  -1.860  10.041   0.370
  619    HG2  GLU  79           1HG      GLU  79  -3.997  10.483   1.666
  620    HG3  GLU  79           2HG      GLU  79  -3.363   9.318   2.850
  621    H    ALA  80           H        ALA  80  -2.854   9.271  -1.839
  622    HA   ALA  80           HA       ALA  80  -5.468  10.376  -1.898
  623    HB1  ALA  80           3HB      ALA  80  -3.718   9.468  -4.209
  624    HB2  ALA  80           1HB      ALA  80  -5.131  10.542  -4.334
  625    HB3  ALA  80           2HB      ALA  80  -3.687  11.072  -3.436
  626    H    VAL  81           H        VAL  81  -4.273   7.186  -2.855
  627    HA   VAL  81           HA       VAL  81  -6.530   6.255  -4.315
  628    HB   VAL  81           HB       VAL  81  -4.628   4.765  -2.462
  629   HG11  VAL  81          1HG1      VAL  81  -5.454   2.717  -3.573
  630   HG12  VAL  81          2HG1      VAL  81  -6.764   3.542  -2.697
  631   HG13  VAL  81          3HG1      VAL  81  -6.650   3.683  -4.468
  632   HG21  VAL  81          3HG2      VAL  81  -3.541   5.782  -4.373
  633   HG22  VAL  81          1HG2      VAL  81  -3.590   4.011  -4.542
  634   HG23  VAL  81          2HG2      VAL  81  -4.721   5.025  -5.471
  635    H    PHE  82           H        PHE  82  -5.983   6.171  -0.802
  636    HA   PHE  82           HA       PHE  82  -8.607   4.921  -0.370
  637    HB2  PHE  82           1HB      PHE  82  -6.626   6.125   1.612
  638    HB3  PHE  82           2HB      PHE  82  -8.038   5.123   2.015
  639    HD1  PHE  82           HD1      PHE  82  -4.577   5.152   1.338
  640    HD2  PHE  82           HD2      PHE  82  -8.099   2.762   0.969
  641    HE1  PHE  82           HE1      PHE  82  -3.178   3.120   1.177
  642    HE2  PHE  82           HE2      PHE  82  -6.705   0.727   0.811
  643    HZ   PHE  82           HZ       PHE  82  -4.243   0.907   0.913
  644    H    GLU  83           H        GLU  83  -7.228   8.158  -0.238
  645    HA   GLU  83           HA       GLU  83  -9.733   9.279   0.861
  646    HB2  GLU  83           1HB      GLU  83  -7.198  10.564  -0.171
  647    HB3  GLU  83           2HB      GLU  83  -8.575  11.436   0.546
  648    HG2  GLU  83           1HG      GLU  83  -8.151  10.145   2.725
  649    HG3  GLU  83           2HG      GLU  83  -6.789   9.422   1.841
  650    H    LEU  84           H        LEU  84 -10.696   8.053  -1.143
  651    HA   LEU  84           HA       LEU  84 -10.542   9.325  -3.707
  652    HB2  LEU  84           1HB      LEU  84 -12.627   7.803  -2.292
  653    HB3  LEU  84           2HB      LEU  84 -12.856   8.182  -4.014
  654    HG   LEU  84           HG       LEU  84 -10.665   6.451  -2.803
  655   HD11  LEU  84          1HD1      LEU  84 -11.769   4.617  -4.114
  656   HD12  LEU  84          2HD1      LEU  84 -12.892   5.335  -2.934
  657   HD13  LEU  84          3HD1      LEU  84 -13.008   5.773  -4.657
  658   HD21  LEU  84          3HD2      LEU  84  -9.815   7.732  -4.678
  659   HD22  LEU  84          1HD2      LEU  84  -9.974   6.020  -5.136
  660   HD23  LEU  84          2HD2      LEU  84 -11.178   7.207  -5.694
  661    H    GLU  85           H        GLU  85 -12.282  10.137  -0.794
  662    HA   GLU  85           HA       GLU  85 -14.106  12.028  -1.981
  663    HB2  GLU  85           1HB      GLU  85 -12.867  11.832   0.766
  664    HB3  GLU  85           2HB      GLU  85 -14.106  13.028   0.312
  665    HG2  GLU  85           1HG      GLU  85 -15.752  11.185  -0.092
  666    HG3  GLU  85           2HG      GLU  85 -14.396  10.058   0.145
  667    H    HIS  86           H        HIS  86 -10.735  12.225  -0.996
  668    HA   HIS  86           HA       HIS  86 -10.739  15.134  -1.687
  669    HB2  HIS  86           1HB      HIS  86  -8.645  13.444  -0.243
  670    HB3  HIS  86           2HB      HIS  86  -8.537  15.193  -0.555
  671    HD2  HIS  86           HD2      HIS  86  -9.684  12.888   2.301
  672    HE1  HIS  86           HE1      HIS  86 -11.663  16.619   2.774
  673    HE2  HIS  86           HE2      HIS  86 -11.034  14.308   3.857
  674    H    HIS  87           H        HIS  87 -10.204  12.194  -3.119
  675    HA   HIS  87           HA       HIS  87  -7.919  13.147  -4.770
  676    HB2  HIS  87           1HB      HIS  87  -7.942  10.786  -3.844
  677    HB3  HIS  87           2HB      HIS  87  -9.353  10.460  -4.879
  678    HD2  HIS  87           HD2      HIS  87  -6.968  12.548  -7.041
  679    HE1  HIS  87           HE1      HIS  87  -5.927   8.461  -7.561
  680    HE2  HIS  87           HE2      HIS  87  -5.661  10.929  -8.429
  681    H    HIS  88           H        HIS  88 -11.204  11.823  -5.259
  682    HA   HIS  88           HA       HIS  88 -11.238  13.282  -7.883
  683    HB2  HIS  88           1HB      HIS  88 -12.661  10.690  -7.117
  684    HB3  HIS  88           2HB      HIS  88 -12.810  11.538  -8.675
  685    HD1  HIS  88           HD1      HIS  88 -10.480  11.746 -10.059
  686    HD2  HIS  88           HD2      HIS  88 -10.552   8.807  -7.038
  687    HE1  HIS  88           HE1      HIS  88  -8.700  10.166 -10.612
  688    H    HIS  89           H        HIS  89 -13.498  13.710  -8.667
  689    HA   HIS  89           HA       HIS  89 -14.814  15.368  -6.675
  690    HB2  HIS  89           1HB      HIS  89 -16.376  15.924  -8.475
  691    HB3  HIS  89           2HB      HIS  89 -14.722  15.931  -9.130
  692    HD1  HIS  89           HD1      HIS  89 -17.929  13.949  -9.176
  693    HD2  HIS  89           HD2      HIS  89 -14.276  14.084 -11.272
  694    HE1  HIS  89           HE1      HIS  89 -18.178  12.418 -11.065
  695    H    HIS  90           H        HIS  90 -17.205  15.296  -6.377
  696    HA   HIS  90           HA       HIS  90 -17.903  12.794  -5.120
  697    HB2  HIS  90           1HB      HIS  90 -18.750  15.099  -4.434
  698    HB3  HIS  90           2HB      HIS  90 -19.805  15.052  -5.867
  699    HD2  HIS  90           HD2      HIS  90 -19.822  13.785  -2.159
  700    HE1  HIS  90           HE1      HIS  90 -23.057  12.006  -4.260
  701    HE2  HIS  90           HE2      HIS  90 -21.928  12.455  -1.929
  702    H    HIS  91           H        HIS  91 -19.022  11.097  -5.740
  703    HA   HIS  91           HA       HIS  91 -19.988  11.095  -8.578
  704    HB2  HIS  91           1HB      HIS  91 -19.043   8.770  -6.838
  705    HB3  HIS  91           2HB      HIS  91 -19.636   8.643  -8.512
  706    HD1  HIS  91           HD1      HIS  91 -18.114   9.678 -10.390
  707    HD2  HIS  91           HD2      HIS  91 -16.289   9.549  -6.593
  708    HE1  HIS  91           HE1      HIS  91 -15.715   9.926 -10.784
  Start of MODEL    8
    1    H1   MET   1           1H       MET   1 -12.164   1.116   1.162
    2    H2   MET   1           2H       MET   1 -12.929   1.065   2.451
    3    H3   MET   1           3H       MET   1 -12.777   2.366   1.722
    4    HA   MET   1           HA       MET   1 -11.041   1.450   3.771
    5    HB2  MET   1           1HB      MET   1  -9.831   1.586   1.013
    6    HB3  MET   1           2HB      MET   1  -8.881   1.672   2.517
    7    HG2  MET   1           1HG      MET   1  -9.449  -0.552   3.118
    8    HG3  MET   1           2HG      MET   1 -10.722  -0.639   1.878
    9    HE1  MET   1           3HE      MET   1  -9.828  -2.966   0.986
   10    HE2  MET   1           1HE      MET   1  -8.129  -3.276   0.556
   11    HE3  MET   1           2HE      MET   1  -8.574  -2.949   2.249
   12    H    LYS   2           H        LYS   2 -10.156   3.067   4.862
   13    HA   LYS   2           HA       LYS   2  -9.687   5.669   3.544
   14    HB2  LYS   2           1HB      LYS   2 -12.085   5.663   4.210
   15    HB3  LYS   2           2HB      LYS   2 -11.568   5.407   5.894
   16    HG2  LYS   2           1HG      LYS   2 -10.474   7.550   5.959
   17    HG3  LYS   2           2HG      LYS   2 -10.730   7.790   4.214
   18    HD2  LYS   2           1HD      LYS   2 -13.173   7.807   4.585
   19    HD3  LYS   2           2HD      LYS   2 -12.901   7.601   6.332
   20    HE2  LYS   2           1HE      LYS   2 -11.759   9.727   6.459
   21    HE3  LYS   2           2HE      LYS   2 -11.836   9.918   4.692
   22    HZ1  LYS   2           3HZ      LYS   2 -14.156   9.846   6.514
   23    HZ2  LYS   2           1HZ      LYS   2 -13.538  11.200   5.801
   24    HZ3  LYS   2           2HZ      LYS   2 -14.230  10.023   4.874
   25    H    ILE   3           H        ILE   3  -8.180   6.901   4.491
   26    HA   ILE   3           HA       ILE   3  -6.328   5.431   6.183
   27    HB   ILE   3           HB       ILE   3  -6.385   8.347   5.282
   28   HG12  ILE   3          1HG1      ILE   3  -6.176   6.652   3.519
   29   HG13  ILE   3          2HG1      ILE   3  -4.792   7.760   3.665
   30   HG21  ILE   3          1HG2      ILE   3  -4.023   8.409   6.006
   31   HG22  ILE   3          2HG2      ILE   3  -5.104   8.075   7.378
   32   HG23  ILE   3          3HG2      ILE   3  -4.171   6.754   6.637
   33   HD11  ILE   3          3HD1      ILE   3  -4.903   4.906   4.703
   34   HD12  ILE   3          1HD1      ILE   3  -4.043   5.450   3.245
   35   HD13  ILE   3          2HD1      ILE   3  -3.519   6.014   4.849
   36    H    ILE   4           H        ILE   4  -6.169   5.231   8.254
   37    HA   ILE   4           HA       ILE   4  -7.257   7.450   9.962
   38    HB   ILE   4           HB       ILE   4  -6.374   4.614  10.666
   39   HG12  ILE   4          1HG1      ILE   4  -9.078   5.927  10.786
   40   HG13  ILE   4          2HG1      ILE   4  -8.527   4.780   9.543
   41   HG21  ILE   4          1HG2      ILE   4  -7.107   5.176  12.959
   42   HG22  ILE   4          2HG2      ILE   4  -5.770   6.228  12.438
   43   HG23  ILE   4          3HG2      ILE   4  -7.438   6.847  12.444
   44   HD11  ILE   4          3HD1      ILE   4  -8.813   4.183  12.508
   45   HD12  ILE   4          1HD1      ILE   4  -9.928   3.656  11.227
   46   HD13  ILE   4          2HD1      ILE   4  -8.261   3.038  11.264
   47    H    SER   5           H        SER   5  -4.351   5.454   9.484
   48    HA   SER   5           HA       SER   5  -2.612   7.790  10.076
   49    HB2  SER   5           1HB      SER   5  -3.227   7.306  12.256
   50    HB3  SER   5           2HB      SER   5  -2.785   5.595  12.049
   51    HG   SER   5           HG       SER   5  -1.121   6.832  13.024
   52    H    ILE   6           H        ILE   6  -0.789   7.549   8.941
   53    HA   ILE   6           HA       ILE   6   0.097   4.765   8.213
   54    HB   ILE   6           HB       ILE   6   0.664   7.426   6.823
   55   HG12  ILE   6          1HG1      ILE   6  -0.929   5.061   5.867
   56   HG13  ILE   6          2HG1      ILE   6  -1.616   6.558   6.541
   57   HG21  ILE   6          1HG2      ILE   6   1.796   6.029   5.127
   58   HG22  ILE   6          2HG2      ILE   6   2.571   5.857   6.717
   59   HG23  ILE   6          3HG2      ILE   6   1.490   4.581   6.113
   60   HD11  ILE   6          3HD1      ILE   6   0.085   6.355   4.031
   61   HD12  ILE   6          1HD1      ILE   6  -1.678   6.581   4.078
   62   HD13  ILE   6          2HD1      ILE   6  -0.601   7.852   4.705
   63    H    SER   7           H        SER   7   1.957   4.006   8.785
   64    HA   SER   7           HA       SER   7   3.889   5.862  10.209
   65    HB2  SER   7           1HB      SER   7   4.206   4.357  11.913
   66    HB3  SER   7           2HB      SER   7   2.496   4.835  11.819
   67    HG   SER   7           HG       SER   7   2.773   2.587  12.153
   68    H    GLU   8           H        GLU   8   6.024   4.912  10.436
   69    HA   GLU   8           HA       GLU   8   6.771   3.357   8.014
   70    HB2  GLU   8           1HB      GLU   8   8.418   4.787  10.106
   71    HB3  GLU   8           2HB      GLU   8   9.072   3.926   8.691
   72    HG2  GLU   8           1HG      GLU   8   7.879   5.588   7.181
   73    HG3  GLU   8           2HG      GLU   8   7.250   6.297   8.685
   74    H    THR   9           H        THR   9   8.559   1.767   8.251
   75    HA   THR   9           HA       THR   9   8.206   0.138  10.744
   76    HB   THR   9           HB       THR   9   8.108  -1.892   9.487
   77    HG1  THR   9           HG1      THR   9   8.597  -0.274   7.179
   78   HG21  THR   9          3HG2      THR   9   6.357   0.159   8.078
   79   HG22  THR   9          1HG2      THR   9   6.095  -1.599   8.086
   80   HG23  THR   9          2HG2      THR   9   5.961  -0.673   9.600
   81    HA   PRO  10           HA       PRO  10  12.507  -0.403  11.118
   82    HB2  PRO  10           2HB      PRO  10  12.943  -2.571  12.017
   83    HB3  PRO  10           1HB      PRO  10  12.114  -3.397  10.689
   84    HG2  PRO  10           1HG      PRO  10  10.525  -3.603  12.438
   85    HG3  PRO  10           2HG      PRO  10  10.920  -2.020  13.121
   86    HD2  PRO  10           1HD      PRO  10   9.233  -2.669  10.673
   87    HD3  PRO  10           2HD      PRO  10   8.976  -1.422  11.899
   88    H    ASN  11           H        ASN  11  10.949  -2.107   8.447
   89    HA   ASN  11           HA       ASN  11  13.412  -1.725   6.818
   90    HB2  ASN  11           1HB      ASN  11  11.861  -3.927   6.536
   91    HB3  ASN  11           2HB      ASN  11  10.803  -2.577   6.050
   92   HD21  ASN  11          2HD2      ASN  11  11.752  -4.923   4.562
   93   HD22  ASN  11          1HD2      ASN  11  12.533  -4.297   3.146
   94    H    HIS  12           H        HIS  12  13.800   0.164   6.002
   95    HA   HIS  12           HA       HIS  12  12.002   2.332   5.960
   96    HB2  HIS  12           1HB      HIS  12  14.447   2.620   5.721
   97    HB3  HIS  12           2HB      HIS  12  14.388   1.839   4.121
   98    HD2  HIS  12           HD2      HIS  12  13.965   3.645   1.990
   99    HE1  HIS  12           HE1      HIS  12  12.790   6.890   4.468
  100    HE2  HIS  12           HE2      HIS  12  13.360   6.072   2.036
  101    H    ASN  13           H        ASN  13  12.492  -0.196   3.559
  102    HA   ASN  13           HA       ASN  13  11.178   1.305   1.427
  103    HB2  ASN  13           1HB      ASN  13  12.059  -1.678   1.463
  104    HB3  ASN  13           2HB      ASN  13  11.067  -0.690   0.363
  105   HD21  ASN  13          2HD2      ASN  13  13.757  -2.029   0.160
  106   HD22  ASN  13          1HD2      ASN  13  14.812  -0.788  -0.429
  107    H    THR  14           H        THR  14  10.030  -0.339   4.126
  108    HA   THR  14           HA       THR  14   7.370  -0.737   2.792
  109    HB   THR  14           HB       THR  14   8.549  -2.328   5.110
  110    HG1  THR  14           HG1      THR  14   8.511  -4.032   3.526
  111   HG21  THR  14          3HG2      THR  14   5.940  -2.630   3.569
  112   HG22  THR  14          1HG2      THR  14   6.530  -3.725   4.841
  113   HG23  THR  14          2HG2      THR  14   6.097  -2.046   5.242
  114    H    MET  15           H        MET  15   5.611   0.086   3.681
  115    HA   MET  15           HA       MET  15   5.880   1.353   6.384
  116    HB2  MET  15           1HB      MET  15   4.643   2.508   3.886
  117    HB3  MET  15           2HB      MET  15   4.410   3.165   5.524
  118    HG2  MET  15           1HG      MET  15   6.857   3.536   5.686
  119    HG3  MET  15           2HG      MET  15   7.033   2.958   4.013
  120    HE1  MET  15           3HE      MET  15   5.865   5.831   6.379
  121    HE2  MET  15           1HE      MET  15   4.940   6.889   5.288
  122    HE3  MET  15           2HE      MET  15   4.302   5.285   5.722
  123    H    LYS  16           H        LYS  16   3.930   1.674   7.533
  124    HA   LYS  16           HA       LYS  16   1.960  -0.482   6.854
  125    HB2  LYS  16           1HB      LYS  16   3.256  -0.864   8.886
  126    HB3  LYS  16           2HB      LYS  16   2.738   0.716   9.517
  127    HG2  LYS  16           1HG      LYS  16   0.379  -0.088   9.469
  128    HG3  LYS  16           2HG      LYS  16   0.970  -1.687   8.961
  129    HD2  LYS  16           1HD      LYS  16   2.259  -1.893  11.030
  130    HD3  LYS  16           2HD      LYS  16   1.746  -0.265  11.531
  131    HE2  LYS  16           1HE      LYS  16  -0.596  -1.009  11.562
  132    HE3  LYS  16           2HE      LYS  16  -0.086  -2.635  11.058
  133    HZ1  LYS  16           3HZ      LYS  16   0.685  -1.298  13.572
  134    HZ2  LYS  16           1HZ      LYS  16  -0.429  -2.505  13.432
  135    HZ3  LYS  16           2HZ      LYS  16   1.159  -2.809  13.106
  136    H    ILE  17           H        ILE  17  -0.098  -0.065   6.586
  137    HA   ILE  17           HA       ILE  17  -1.001   2.764   7.077
  138    HB   ILE  17           HB       ILE  17  -1.865   0.835   4.873
  139   HG12  ILE  17          1HG1      ILE  17  -0.329   3.404   4.614
  140   HG13  ILE  17          2HG1      ILE  17   0.416   1.789   4.651
  141   HG21  ILE  17          1HG2      ILE  17  -3.138   2.776   4.021
  142   HG22  ILE  17          2HG2      ILE  17  -3.677   2.324   5.655
  143   HG23  ILE  17          3HG2      ILE  17  -2.618   3.735   5.425
  144   HD11  ILE  17          3HD1      ILE  17  -1.594   2.773   2.597
  145   HD12  ILE  17          1HD1      ILE  17   0.155   2.595   2.338
  146   HD13  ILE  17          2HD1      ILE  17  -0.851   1.158   2.635
  147    H    THR  18           H        THR  18  -2.286   2.943   8.680
  148    HA   THR  18           HA       THR  18  -4.116   0.708   9.364
  149    HB   THR  18           HB       THR  18  -3.666   3.410  10.703
  150    HG1  THR  18           HG1      THR  18  -2.605   2.062  12.274
  151   HG21  THR  18          3HG2      THR  18  -5.235   0.961  11.607
  152   HG22  THR  18          1HG2      THR  18  -4.955   2.431  12.569
  153   HG23  THR  18          2HG2      THR  18  -5.938   2.512  11.087
  154    H    LEU  19           H        LEU  19  -6.094   0.531   8.699
  155    HA   LEU  19           HA       LEU  19  -7.378   2.961   7.496
  156    HB2  LEU  19           1HB      LEU  19  -7.571   0.094   6.841
  157    HB3  LEU  19           2HB      LEU  19  -8.561   1.288   5.969
  158    HG   LEU  19           HG       LEU  19  -5.523   1.109   5.933
  159   HD11  LEU  19          1HD1      LEU  19  -5.841   0.445   3.535
  160   HD12  LEU  19          2HD1      LEU  19  -6.624  -0.711   4.635
  161   HD13  LEU  19          3HD1      LEU  19  -7.602   0.497   3.769
  162   HD21  LEU  19          3HD2      LEU  19  -6.298   3.400   5.747
  163   HD22  LEU  19          1HD2      LEU  19  -5.654   2.848   4.182
  164   HD23  LEU  19          2HD2      LEU  19  -7.414   2.946   4.436
  165    H    SER  20           H        SER  20  -9.610   3.203   7.653
  166    HA   SER  20           HA       SER  20 -10.879   2.103  10.096
  167    HB2  SER  20           1HB      SER  20 -12.669   3.456   9.609
  168    HB3  SER  20           2HB      SER  20 -11.148   4.369   9.485
  169    HG   SER  20           HG       SER  20 -12.716   4.739   7.776
  170    H    GLU  21           H        GLU  21 -11.701   2.134   6.589
  171    HA   GLU  21           HA       GLU  21 -13.046  -0.512   6.939
  172    HB2  GLU  21           1HB      GLU  21 -12.969   1.427   4.620
  173    HB3  GLU  21           2HB      GLU  21 -13.816  -0.139   4.627
  174    HG2  GLU  21           1HG      GLU  21 -15.310   0.735   6.497
  175    HG3  GLU  21           2HG      GLU  21 -14.335   2.218   6.391
  176    H    SER  22           H        SER  22 -12.671  -2.203   5.419
  177    HA   SER  22           HA       SER  22  -9.868  -2.236   4.269
  178    HB2  SER  22           1HB      SER  22  -9.900  -3.122   6.533
  179    HB3  SER  22           2HB      SER  22 -10.939  -4.431   5.923
  180    HG   SER  22           HG       SER  22  -8.738  -4.991   5.833
  181    H    ARG  23           H        ARG  23  -9.805  -4.794   3.450
  182    HA   ARG  23           HA       ARG  23 -11.513  -4.866   1.127
  183    HB2  ARG  23           1HB      ARG  23  -9.331  -5.834   1.127
  184    HB3  ARG  23           2HB      ARG  23  -9.851  -7.034   2.333
  185    HG2  ARG  23           1HG      ARG  23 -11.432  -7.991   0.751
  186    HG3  ARG  23           2HG      ARG  23 -11.025  -6.740  -0.448
  187    HD2  ARG  23           1HD      ARG  23  -8.810  -7.612  -0.656
  188    HD3  ARG  23           2HD      ARG  23  -9.130  -8.805   0.624
  189    HE   ARG  23           HE       ARG  23 -10.968  -9.327  -1.555
  190   HH11  ARG  23          1HH1      ARG  23  -7.540  -9.470  -0.932
  191   HH12  ARG  23          2HH1      ARG  23  -7.382 -10.785  -2.078
  192   HH21  ARG  23          2HH2      ARG  23  -9.239 -11.560  -3.189
  193   HH22  ARG  23          1HH2      ARG  23 -10.800 -10.827  -2.877
  194    H    GLU  24           H        GLU  24 -13.143  -6.278   0.544
  195    HA   GLU  24           HA       GLU  24 -15.309  -6.587   2.219
  196    HB2  GLU  24           1HB      GLU  24 -15.274  -7.096  -0.190
  197    HB3  GLU  24           2HB      GLU  24 -14.389  -8.600   0.161
  198    HG2  GLU  24           1HG      GLU  24 -16.399  -9.438   1.462
  199    HG3  GLU  24           2HG      GLU  24 -17.124  -7.855   1.107
  200    H    GLY  25           H        GLY  25 -12.765  -9.074   1.791
  201    HA2  GLY  25           1HA      GLY  25 -13.504 -10.060   4.514
  202    HA3  GLY  25           2HA      GLY  25 -12.570 -10.974   3.306
  203    H    MET  26           H        MET  26 -12.180  -9.753   6.191
  204    HA   MET  26           HA       MET  26  -9.717  -8.155   5.705
  205    HB2  MET  26           1HB      MET  26 -11.338  -8.806   8.162
  206    HB3  MET  26           2HB      MET  26  -9.785  -7.936   8.202
  207    HG2  MET  26           1HG      MET  26 -10.734  -6.144   6.839
  208    HG3  MET  26           2HG      MET  26 -12.276  -7.025   6.728
  209    HE1  MET  26           3HE      MET  26 -13.414  -4.680   7.540
  210    HE2  MET  26           1HE      MET  26 -12.994  -3.876   9.071
  211    HE3  MET  26           2HE      MET  26 -11.809  -3.935   7.743
  212    H    THR  27           H        THR  27  -9.517 -10.800   4.879
  213    HA   THR  27           HA       THR  27  -7.887 -12.108   7.002
  214    HB   THR  27           HB       THR  27  -7.797 -14.030   5.507
  215    HG1  THR  27           HG1      THR  27  -8.887 -13.889   3.457
  216   HG21  THR  27          3HG2      THR  27 -10.603 -12.851   5.592
  217   HG22  THR  27          1HG2      THR  27 -10.202 -14.567   5.343
  218   HG23  THR  27          2HG2      THR  27  -9.826 -13.782   6.894
  219    H    SER  28           H        SER  28  -5.832 -13.130   6.303
  220    HA   SER  28           HA       SER  28  -4.021 -11.020   5.307
  221    HB2  SER  28           1HB      SER  28  -2.299 -12.394   5.882
  222    HB3  SER  28           2HB      SER  28  -3.505 -12.387   7.189
  223    HG   SER  28           HG       SER  28  -2.708 -14.484   6.724
  224    H    ASP  29           H        ASP  29  -2.943 -10.967   3.398
  225    HA   ASP  29           HA       ASP  29  -2.590 -13.302   1.723
  226    HB2  ASP  29           1HB      ASP  29  -5.100 -12.304   1.267
  227    HB3  ASP  29           2HB      ASP  29  -4.044 -11.149   0.418
  228    H    THR  30           H        THR  30  -1.297 -12.928  -0.123
  229    HA   THR  30           HA       THR  30   0.169 -10.311   0.012
  230    HB   THR  30           HB       THR  30   1.326 -13.069  -0.573
  231    HG1  THR  30           HG1      THR  30   2.431 -12.663   1.432
  232   HG21  THR  30          3HG2      THR  30   2.644 -10.336  -0.332
  233   HG22  THR  30          1HG2      THR  30   3.491 -11.883  -0.570
  234   HG23  THR  30          2HG2      THR  30   2.418 -11.250  -1.841
  235    H    TYR  31           H        TYR  31   0.219  -9.157  -1.736
  236    HA   TYR  31           HA       TYR  31  -0.088 -10.556  -4.371
  237    HB2  TYR  31           1HB      TYR  31  -1.348  -7.957  -3.473
  238    HB3  TYR  31           2HB      TYR  31  -1.325  -8.559  -5.148
  239    HD1  TYR  31           HD1      TYR  31  -2.926  -8.804  -1.887
  240    HD2  TYR  31           HD2      TYR  31  -2.589 -10.638  -5.722
  241    HE1  TYR  31           HE1      TYR  31  -4.997 -10.092  -1.445
  242    HE2  TYR  31           HE2      TYR  31  -4.653 -11.930  -5.297
  243    HH   TYR  31           HH       TYR  31  -6.340 -12.376  -3.831
  244    H    THR  32           H        THR  32   1.068  -9.819  -6.066
  245    HA   THR  32           HA       THR  32   3.051  -7.653  -5.449
  246    HB   THR  32           HB       THR  32   4.706  -8.869  -6.796
  247    HG1  THR  32           HG1      THR  32   4.178 -11.035  -7.460
  248   HG21  THR  32          3HG2      THR  32   3.462 -10.634  -4.650
  249   HG22  THR  32          1HG2      THR  32   5.123 -10.769  -5.274
  250   HG23  THR  32          2HG2      THR  32   4.627  -9.320  -4.367
  251    H    LYS  33           H        LYS  33   0.765  -9.024  -7.653
  252    HA   LYS  33           HA       LYS  33   1.472  -6.895  -9.645
  253    HB2  LYS  33           1HB      LYS  33   0.591  -9.741 -10.144
  254    HB3  LYS  33           2HB      LYS  33   0.696  -8.472 -11.387
  255    HG2  LYS  33           1HG      LYS  33   3.123  -8.281 -10.970
  256    HG3  LYS  33           2HG      LYS  33   3.007  -9.579  -9.757
  257    HD2  LYS  33           1HD      LYS  33   2.209 -11.131 -11.494
  258    HD3  LYS  33           2HD      LYS  33   2.327  -9.833 -12.707
  259    HE2  LYS  33           1HE      LYS  33   4.746  -9.663 -12.282
  260    HE3  LYS  33           2HE      LYS  33   4.624 -10.971 -11.083
  261    HZ1  LYS  33           3HZ      LYS  33   4.013 -11.218 -13.959
  262    HZ2  LYS  33           1HZ      LYS  33   5.372 -11.786 -13.216
  263    HZ3  LYS  33           2HZ      LYS  33   3.899 -12.432 -12.848
  264    H    VAL  34           H        VAL  34  -0.209  -6.073 -10.916
  265    HA   VAL  34           HA       VAL  34  -2.686  -5.647  -9.457
  266    HB   VAL  34           HB       VAL  34  -1.909  -5.067 -12.345
  267   HG11  VAL  34          1HG1      VAL  34  -3.899  -3.599 -12.369
  268   HG12  VAL  34          2HG1      VAL  34  -4.358  -5.297 -12.096
  269   HG13  VAL  34          3HG1      VAL  34  -4.327  -4.153 -10.732
  270   HG21  VAL  34          3HG2      VAL  34  -0.587  -3.833 -10.733
  271   HG22  VAL  34          1HG2      VAL  34  -1.719  -2.754 -11.581
  272   HG23  VAL  34          2HG2      VAL  34  -2.069  -3.278  -9.916
  273    H    ASP  35           H        ASP  35  -4.634  -6.449  -9.578
  274    HA   ASP  35           HA       ASP  35  -5.413  -8.260 -11.745
  275    HB2  ASP  35           1HB      ASP  35  -4.027  -9.646  -9.872
  276    HB3  ASP  35           2HB      ASP  35  -5.557  -9.312  -9.025
  277    H    ASP  36           H        ASP  36  -7.611  -8.953 -11.623
  278    HA   ASP  36           HA       ASP  36  -9.264  -6.754 -10.621
  279    HB2  ASP  36           1HB      ASP  36 -10.000  -9.332 -12.134
  280    HB3  ASP  36           2HB      ASP  36 -11.065  -8.056 -11.493
  281    H    SER  37           H        SER  37  -8.155  -9.682  -9.325
  282    HA   SER  37           HA       SER  37 -10.447 -10.377  -7.632
  283    HB2  SER  37           1HB      SER  37  -9.061 -11.857  -6.578
  284    HB3  SER  37           2HB      SER  37  -8.820 -11.956  -8.337
  285    HG   SER  37           HG       SER  37  -6.851 -11.989  -7.168
  286    H    GLN  38           H        GLN  38  -8.064  -7.881  -7.582
  287    HA   GLN  38           HA       GLN  38  -8.185  -7.647  -4.608
  288    HB2  GLN  38           1HB      GLN  38  -6.424  -6.272  -6.649
  289    HB3  GLN  38           2HB      GLN  38  -6.335  -6.068  -4.883
  290    HG2  GLN  38           1HG      GLN  38  -5.527  -8.600  -4.727
  291    HG3  GLN  38           2HG      GLN  38  -6.032  -8.490  -6.430
  292   HE21  GLN  38          2HE2      GLN  38  -4.335  -8.563  -7.738
  293   HE22  GLN  38          1HE2      GLN  38  -2.807  -7.791  -7.470
  294    HA   PRO  39           HA       PRO  39 -10.743  -4.014  -4.550
  295    HB2  PRO  39           2HB      PRO  39 -10.295  -3.010  -2.441
  296    HB3  PRO  39           1HB      PRO  39  -8.554  -2.928  -2.742
  297    HG2  PRO  39           1HG      PRO  39  -8.665  -4.719  -1.196
  298    HG3  PRO  39           2HG      PRO  39 -10.221  -5.290  -1.813
  299    HD2  PRO  39           1HD      PRO  39  -7.446  -5.671  -3.010
  300    HD3  PRO  39           2HD      PRO  39  -8.780  -6.827  -2.916
  301    H    ALA  40           H        ALA  40 -10.888  -2.222  -5.676
  302    HA   ALA  40           HA       ALA  40  -8.960  -1.346  -7.508
  303    HB1  ALA  40           3HB      ALA  40 -11.031   0.320  -6.038
  304    HB2  ALA  40           1HB      ALA  40 -10.183   0.794  -7.528
  305    HB3  ALA  40           2HB      ALA  40 -11.295  -0.594  -7.541
  306    H    PHE  41           H        PHE  41  -9.348  -0.454  -4.102
  307    HA   PHE  41           HA       PHE  41  -7.452   1.655  -3.994
  308    HB2  PHE  41           1HB      PHE  41  -8.222  -0.439  -1.919
  309    HB3  PHE  41           2HB      PHE  41  -7.201   0.976  -1.578
  310    HD1  PHE  41           HD1      PHE  41 -10.571  -0.228  -2.251
  311    HD2  PHE  41           HD2      PHE  41  -8.127   3.208  -1.568
  312    HE1  PHE  41           HE1      PHE  41 -12.594   1.117  -1.795
  313    HE2  PHE  41           HE2      PHE  41 -10.147   4.557  -1.110
  314    HZ   PHE  41           HZ       PHE  41 -12.381   3.511  -1.224
  315    H    ILE  42           H        ILE  42  -6.981  -1.837  -4.029
  316    HA   ILE  42           HA       ILE  42  -4.101  -1.583  -3.419
  317    HB   ILE  42           HB       ILE  42  -5.738  -3.985  -4.358
  318   HG12  ILE  42          1HG1      ILE  42  -6.574  -3.176  -2.276
  319   HG13  ILE  42          2HG1      ILE  42  -5.707  -4.716  -2.062
  320   HG21  ILE  42          1HG2      ILE  42  -3.822  -5.298  -3.514
  321   HG22  ILE  42          2HG2      ILE  42  -3.315  -4.189  -4.809
  322   HG23  ILE  42          3HG2      ILE  42  -2.967  -3.792  -3.110
  323   HD11  ILE  42          3HD1      ILE  42  -4.619  -1.955  -1.407
  324   HD12  ILE  42          1HD1      ILE  42  -5.206  -3.150  -0.227
  325   HD13  ILE  42          2HD1      ILE  42  -3.752  -3.494  -1.194
  326    H    ASN  43           H        ASN  43  -6.109  -2.152  -6.268
  327    HA   ASN  43           HA       ASN  43  -3.892  -2.789  -8.004
  328    HB2  ASN  43           1HB      ASN  43  -6.736  -1.824  -8.822
  329    HB3  ASN  43           2HB      ASN  43  -5.229  -2.191  -9.696
  330   HD21  ASN  43          2HD2      ASN  43  -7.993  -3.438  -9.502
  331   HD22  ASN  43          1HD2      ASN  43  -7.674  -5.120  -9.239
  332    H    ASP  44           H        ASP  44  -5.662   0.245  -7.395
  333    HA   ASP  44           HA       ASP  44  -4.232   1.883  -9.213
  334    HB2  ASP  44           1HB      ASP  44  -5.476   2.595  -6.489
  335    HB3  ASP  44           2HB      ASP  44  -4.661   3.660  -7.661
  336    H    ILE  45           H        ILE  45  -3.462   1.090  -5.824
  337    HA   ILE  45           HA       ILE  45  -1.056   2.682  -5.725
  338    HB   ILE  45           HB       ILE  45  -1.918   0.208  -4.159
  339   HG12  ILE  45          1HG1      ILE  45  -1.817   3.081  -3.295
  340   HG13  ILE  45          2HG1      ILE  45  -3.264   2.290  -3.962
  341   HG21  ILE  45          1HG2      ILE  45  -0.118   0.808  -2.577
  342   HG22  ILE  45          2HG2      ILE  45   0.545   0.423  -4.182
  343   HG23  ILE  45          3HG2      ILE  45   0.400   2.119  -3.663
  344   HD11  ILE  45          3HD1      ILE  45  -1.781   1.454  -1.446
  345   HD12  ILE  45          1HD1      ILE  45  -3.328   2.330  -1.499
  346   HD13  ILE  45          2HD1      ILE  45  -3.229   0.662  -2.114
  347    H    LEU  46           H        LEU  46  -1.570  -0.743  -6.512
  348    HA   LEU  46           HA       LEU  46   1.159  -1.383  -6.988
  349    HB2  LEU  46           1HB      LEU  46  -1.396  -2.240  -8.157
  350    HB3  LEU  46           2HB      LEU  46   0.078  -3.099  -8.658
  351    HG   LEU  46           HG       LEU  46  -0.988  -2.922  -5.814
  352   HD11  LEU  46          1HD1      LEU  46  -1.506  -5.361  -6.107
  353   HD12  LEU  46          2HD1      LEU  46  -2.407  -4.363  -7.273
  354   HD13  LEU  46          3HD1      LEU  46  -0.960  -5.257  -7.796
  355   HD21  LEU  46          3HD2      LEU  46   1.429  -3.087  -5.896
  356   HD22  LEU  46          1HD2      LEU  46   0.737  -4.616  -5.306
  357   HD23  LEU  46          2HD2      LEU  46   1.327  -4.493  -6.982
  358    H    LYS  47           H        LYS  47  -1.211   0.248  -9.029
  359    HA   LYS  47           HA       LYS  47   0.470   0.123 -11.413
  360    HB2  LYS  47           1HB      LYS  47  -1.975   1.733 -10.672
  361    HB3  LYS  47           2HB      LYS  47  -1.158   1.840 -12.250
  362    HG2  LYS  47           1HG      LYS  47  -1.631  -0.516 -12.684
  363    HG3  LYS  47           2HG      LYS  47  -2.383  -0.680 -11.079
  364    HD2  LYS  47           1HD      LYS  47  -4.098   0.970 -11.715
  365    HD3  LYS  47           2HD      LYS  47  -3.349   1.127 -13.322
  366    HE2  LYS  47           1HE      LYS  47  -3.773  -1.258 -13.750
  367    HE3  LYS  47           2HE      LYS  47  -4.536  -1.407 -12.150
  368    HZ1  LYS  47           3HZ      LYS  47  -5.493   0.306 -14.351
  369    HZ2  LYS  47           1HZ      LYS  47  -6.167  -1.125 -13.889
  370    HZ3  LYS  47           2HZ      LYS  47  -6.200   0.169 -12.867
  371    H    VAL  48           H        VAL  48   0.231   2.228  -8.665
  372    HA   VAL  48           HA       VAL  48   1.647   4.503  -9.758
  373    HB   VAL  48           HB       VAL  48   1.562   3.361  -6.934
  374   HG11  VAL  48          1HG1      VAL  48   2.420   5.573  -6.242
  375   HG12  VAL  48          2HG1      VAL  48   3.580   4.739  -7.303
  376   HG13  VAL  48          3HG1      VAL  48   2.565   6.051  -7.950
  377   HG21  VAL  48          3HG2      VAL  48  -0.612   4.068  -7.736
  378   HG22  VAL  48          1HG2      VAL  48  -0.003   5.185  -6.493
  379   HG23  VAL  48          2HG2      VAL  48   0.056   5.649  -8.210
  380    H    GLU  49           H        GLU  49   3.547   4.740 -10.514
  381    HA   GLU  49           HA       GLU  49   5.445   2.610 -10.655
  382    HB2  GLU  49           1HB      GLU  49   5.323   4.541 -12.193
  383    HB3  GLU  49           2HB      GLU  49   5.918   5.586 -10.880
  384    HG2  GLU  49           1HG      GLU  49   8.085   4.254 -10.862
  385    HG3  GLU  49           2HG      GLU  49   7.326   3.262 -12.128
  386    H    GLY  50           H        GLY  50   6.780   1.773  -9.278
  387    HA2  GLY  50           1HA      GLY  50   8.761   2.298  -7.865
  388    HA3  GLY  50           2HA      GLY  50   7.755   3.511  -7.043
  389    H    VAL  51           H        VAL  51   5.383   1.699  -7.158
  390    HA   VAL  51           HA       VAL  51   5.822   0.329  -4.608
  391    HB   VAL  51           HB       VAL  51   3.496   0.242  -6.574
  392   HG11  VAL  51          1HG1      VAL  51   2.233  -0.728  -4.685
  393   HG12  VAL  51          2HG1      VAL  51   3.596  -1.772  -5.149
  394   HG13  VAL  51          3HG1      VAL  51   3.714  -0.743  -3.701
  395   HG21  VAL  51          3HG2      VAL  51   3.846   2.456  -5.655
  396   HG22  VAL  51          1HG2      VAL  51   2.377   1.715  -4.978
  397   HG23  VAL  51          2HG2      VAL  51   3.864   1.789  -4.004
  398    H    LYS  52           H        LYS  52   6.382  -1.618  -4.136
  399    HA   LYS  52           HA       LYS  52   7.153  -3.352  -6.432
  400    HB2  LYS  52           1HB      LYS  52   8.849  -2.772  -4.765
  401    HB3  LYS  52           2HB      LYS  52   7.835  -3.487  -3.489
  402    HG2  LYS  52           1HG      LYS  52   8.047  -5.695  -4.539
  403    HG3  LYS  52           2HG      LYS  52   9.036  -4.989  -5.839
  404    HD2  LYS  52           1HD      LYS  52  10.725  -4.304  -4.172
  405    HD3  LYS  52           2HD      LYS  52   9.741  -5.041  -2.885
  406    HE2  LYS  52           1HE      LYS  52   9.974  -7.235  -3.930
  407    HE3  LYS  52           2HE      LYS  52  10.900  -6.518  -5.269
  408    HZ1  LYS  52           3HZ      LYS  52  11.732  -6.560  -2.438
  409    HZ2  LYS  52           1HZ      LYS  52  12.339  -7.525  -3.632
  410    HZ3  LYS  52           2HZ      LYS  52  12.590  -5.894  -3.680
  411    H    SER  53           H        SER  53   5.660  -3.773  -3.204
  412    HA   SER  53           HA       SER  53   3.704  -5.733  -4.349
  413    HB2  SER  53           1HB      SER  53   4.270  -7.509  -3.036
  414    HB3  SER  53           2HB      SER  53   5.671  -7.033  -4.026
  415    HG   SER  53           HG       SER  53   6.331  -5.837  -2.059
  416    H    ILE  54           H        ILE  54   2.050  -6.273  -2.849
  417    HA   ILE  54           HA       ILE  54   1.890  -4.512  -0.423
  418    HB   ILE  54           HB       ILE  54  -0.312  -5.008  -2.481
  419   HG12  ILE  54          1HG1      ILE  54   1.119  -2.473  -1.723
  420   HG13  ILE  54          2HG1      ILE  54   1.367  -3.414  -3.212
  421   HG21  ILE  54          1HG2      ILE  54  -1.660  -3.504  -1.056
  422   HG22  ILE  54          2HG2      ILE  54  -1.159  -4.957  -0.159
  423   HG23  ILE  54          3HG2      ILE  54  -0.322  -3.411   0.113
  424   HD11  ILE  54          3HD1      ILE  54  -1.217  -2.048  -2.380
  425   HD12  ILE  54          1HD1      ILE  54  -0.084  -1.465  -3.620
  426   HD13  ILE  54          2HD1      ILE  54  -0.970  -2.989  -3.869
  427    H    PHE  55           H        PHE  55   1.481  -5.473   1.357
  428    HA   PHE  55           HA       PHE  55   0.129  -8.149   1.230
  429    HB2  PHE  55           1HB      PHE  55   2.343  -8.286   2.260
  430    HB3  PHE  55           2HB      PHE  55   1.951  -6.942   3.357
  431    HD1  PHE  55           HD1      PHE  55   0.819 -10.366   2.412
  432    HD2  PHE  55           HD2      PHE  55   1.138  -7.377   5.449
  433    HE1  PHE  55           HE1      PHE  55  -0.018 -11.980   4.086
  434    HE2  PHE  55           HE2      PHE  55   0.304  -8.990   7.126
  435    HZ   PHE  55           HZ       PHE  55  -0.276 -11.292   6.444
  436    H    HIS  56           H        HIS  56  -1.798  -8.428   2.029
  437    HA   HIS  56           HA       HIS  56  -2.949  -6.205   3.681
  438    HB2  HIS  56           1HB      HIS  56  -4.112  -6.454   1.525
  439    HB3  HIS  56           2HB      HIS  56  -4.349  -8.190   1.833
  440    HD1  HIS  56           HD1      HIS  56  -6.058  -8.844   3.707
  441    HD2  HIS  56           HD2      HIS  56  -6.030  -4.727   2.801
  442    HE1  HIS  56           HE1      HIS  56  -8.145  -7.943   4.602
  443    H    VAL  57           H        VAL  57  -3.648  -6.565   5.646
  444    HA   VAL  57           HA       VAL  57  -4.694  -9.223   6.412
  445    HB   VAL  57           HB       VAL  57  -2.289  -9.515   6.917
  446   HG11  VAL  57          1HG1      VAL  57  -1.206  -8.058   8.595
  447   HG12  VAL  57          2HG1      VAL  57  -1.686  -7.130   7.155
  448   HG13  VAL  57          3HG1      VAL  57  -2.660  -7.032   8.643
  449   HG21  VAL  57          3HG2      VAL  57  -3.933 -10.550   8.365
  450   HG22  VAL  57          1HG2      VAL  57  -2.505 -10.036   9.294
  451   HG23  VAL  57          2HG2      VAL  57  -4.006  -9.079   9.366
  452    H    MET  58           H        MET  58  -6.357  -9.075   7.641
  453    HA   MET  58           HA       MET  58  -7.961  -8.159   9.053
  454    HB2  MET  58           1HB      MET  58  -5.806  -8.071  10.467
  455    HB3  MET  58           2HB      MET  58  -5.832  -6.328  10.109
  456    HG2  MET  58           1HG      MET  58  -8.098  -6.190  11.103
  457    HG3  MET  58           2HG      MET  58  -7.997  -7.916  11.521
  458    HE1  MET  58           3HE      MET  58  -5.090  -8.374  12.504
  459    HE2  MET  58           1HE      MET  58  -5.225  -8.021  14.243
  460    HE3  MET  58           2HE      MET  58  -6.523  -8.915  13.413
  461    H    ASP  59           H        ASP  59  -7.077  -5.189   9.931
  462    HA   ASP  59           HA       ASP  59  -8.408  -3.923   7.555
  463    HB2  ASP  59           1HB      ASP  59  -9.481  -2.327   9.124
  464    HB3  ASP  59           2HB      ASP  59  -9.750  -4.052   9.481
  465    H    PHE  60           H        PHE  60  -5.566  -4.373   7.915
  466    HA   PHE  60           HA       PHE  60  -4.801  -1.576   7.336
  467    HB2  PHE  60           1HB      PHE  60  -2.846  -1.620   8.818
  468    HB3  PHE  60           2HB      PHE  60  -4.324  -1.842   9.781
  469    HD1  PHE  60           HD1      PHE  60  -1.207  -3.320   8.651
  470    HD2  PHE  60           HD2      PHE  60  -4.873  -4.018  10.730
  471    HE1  PHE  60           HE1      PHE  60  -0.250  -5.371   9.645
  472    HE2  PHE  60           HE2      PHE  60  -3.919  -6.069  11.729
  473    HZ   PHE  60           HZ       PHE  60  -1.608  -6.747  11.183
  474    H    ILE  61           H        ILE  61  -2.735  -1.381   6.288
  475    HA   ILE  61           HA       ILE  61  -2.126  -3.865   4.711
  476    HB   ILE  61           HB       ILE  61  -2.581  -1.045   3.632
  477   HG12  ILE  61          1HG1      ILE  61  -4.156  -3.565   3.171
  478   HG13  ILE  61          2HG1      ILE  61  -4.623  -2.234   4.257
  479   HG21  ILE  61          1HG2      ILE  61  -2.208  -2.087   1.422
  480   HG22  ILE  61          2HG2      ILE  61  -0.771  -2.253   2.457
  481   HG23  ILE  61          3HG2      ILE  61  -1.855  -3.640   2.214
  482   HD11  ILE  61          3HD1      ILE  61  -4.241  -2.026   1.249
  483   HD12  ILE  61          1HD1      ILE  61  -5.802  -2.078   2.098
  484   HD13  ILE  61          2HD1      ILE  61  -4.707  -0.695   2.335
  485    H    SER  62           H        SER  62  -0.128  -4.317   4.265
  486    HA   SER  62           HA       SER  62   2.016  -2.348   5.071
  487    HB2  SER  62           1HB      SER  62   2.141  -4.384   6.170
  488    HB3  SER  62           2HB      SER  62   2.126  -5.269   4.627
  489    HG   SER  62           HG       SER  62   4.239  -4.945   5.443
  490    H    VAL  63           H        VAL  63   2.571  -1.067   3.392
  491    HA   VAL  63           HA       VAL  63   2.789  -2.309   0.653
  492    HB   VAL  63           HB       VAL  63   2.370   0.606   1.432
  493   HG11  VAL  63          1HG1      VAL  63   2.095   0.949  -1.000
  494   HG12  VAL  63          2HG1      VAL  63   3.712   0.311  -0.621
  495   HG13  VAL  63          3HG1      VAL  63   2.461  -0.768  -1.284
  496   HG21  VAL  63          3HG2      VAL  63   0.367  -0.696   1.827
  497   HG22  VAL  63          1HG2      VAL  63   0.162   0.366   0.415
  498   HG23  VAL  63          2HG2      VAL  63   0.460  -1.373   0.184
  499    H    ASP  64           H        ASP  64   4.622  -2.482  -0.299
  500    HA   ASP  64           HA       ASP  64   6.941  -0.967   0.850
  501    HB2  ASP  64           1HB      ASP  64   8.324  -3.012   0.745
  502    HB3  ASP  64           2HB      ASP  64   6.808  -3.183   1.665
  503    H    LYS  65           H        LYS  65   8.610  -0.440  -0.514
  504    HA   LYS  65           HA       LYS  65   7.724  -0.368  -3.380
  505    HB2  LYS  65           1HB      LYS  65   8.875   1.715  -3.573
  506    HB3  LYS  65           2HB      LYS  65   7.722   1.793  -2.221
  507    HG2  LYS  65           1HG      LYS  65   9.524   1.547  -0.611
  508    HG3  LYS  65           2HG      LYS  65  10.705   1.321  -1.921
  509    HD2  LYS  65           1HD      LYS  65  10.345   3.585  -2.709
  510    HD3  LYS  65           2HD      LYS  65   9.032   3.822  -1.530
  511    HE2  LYS  65           1HE      LYS  65  10.977   4.898  -0.651
  512    HE3  LYS  65           2HE      LYS  65  10.703   3.419   0.298
  513    HZ1  LYS  65           3HZ      LYS  65  12.654   3.713  -1.896
  514    HZ2  LYS  65           1HZ      LYS  65  13.017   3.686  -0.286
  515    HZ3  LYS  65           2HZ      LYS  65  12.402   2.341  -1.016
  516    H    GLU  66           H        GLU  66   9.683   0.226  -4.841
  517    HA   GLU  66           HA       GLU  66  11.743  -1.854  -4.440
  518    HB2  GLU  66           1HB      GLU  66  11.325   0.203  -6.613
  519    HB3  GLU  66           2HB      GLU  66  12.580  -1.058  -6.614
  520    HG2  GLU  66           1HG      GLU  66  10.693  -2.808  -6.611
  521    HG3  GLU  66           2HG      GLU  66   9.613  -1.398  -6.677
  522    H    ASN  67           H        ASN  67  14.035  -1.314  -4.855
  523    HA   ASN  67           HA       ASN  67  14.896   0.471  -2.762
  524    HB2  ASN  67           1HB      ASN  67  16.668  -0.917  -4.912
  525    HB3  ASN  67           2HB      ASN  67  16.956   0.231  -3.584
  526   HD21  ASN  67          2HD2      ASN  67  17.799  -2.588  -4.074
  527   HD22  ASN  67          1HD2      ASN  67  17.337  -3.446  -2.642
  528    H    ASP  68           H        ASP  68  14.767   0.785  -6.291
  529    HA   ASP  68           HA       ASP  68  16.142   3.335  -6.349
  530    HB2  ASP  68           1HB      ASP  68  14.288   1.990  -8.405
  531    HB3  ASP  68           2HB      ASP  68  15.109   3.567  -8.493
  532    H    ALA  69           H        ALA  69  12.741   2.380  -6.125
  533    HA   ALA  69           HA       ALA  69  11.675   4.997  -6.573
  534    HB1  ALA  69           3HB      ALA  69  10.508   2.664  -5.015
  535    HB2  ALA  69           1HB      ALA  69   9.610   4.093  -5.576
  536    HB3  ALA  69           2HB      ALA  69  10.313   2.964  -6.758
  537    H    ASN  70           H        ASN  70  10.670   6.441  -5.096
  538    HA   ASN  70           HA       ASN  70  11.687   6.238  -2.280
  539    HB2  ASN  70           1HB      ASN  70  11.504   8.967  -3.756
  540    HB3  ASN  70           2HB      ASN  70  11.816   8.369  -2.107
  541   HD21  ASN  70          2HD2      ASN  70  13.067   8.836  -5.289
  542   HD22  ASN  70          1HD2      ASN  70  14.704   8.377  -4.953
  543    H    TRP  71           H        TRP  71  10.396   7.046  -0.652
  544    HA   TRP  71           HA       TRP  71   7.545   6.751  -1.108
  545    HB2  TRP  71           1HB      TRP  71   9.238   7.599   1.266
  546    HB3  TRP  71           2HB      TRP  71   7.460   7.638   1.315
  547    HD1  TRP  71           HD1      TRP  71  10.087   5.646   2.316
  548    HE1  TRP  71           HE1      TRP  71   9.406   3.046   2.601
  549    HE3  TRP  71           HE3      TRP  71   5.744   5.732  -0.323
  550    HZ2  TRP  71           HZ2      TRP  71   7.305   1.461   1.764
  551    HZ3  TRP  71           HZ3      TRP  71   4.436   3.715  -0.573
  552    HH2  TRP  71           HH2      TRP  71   5.145   1.587   0.430
  553    H    GLU  72           H        GLU  72   9.750   9.427  -1.193
  554    HA   GLU  72           HA       GLU  72   8.000  11.601  -0.739
  555    HB2  GLU  72           1HB      GLU  72  10.425  11.782  -1.085
  556    HB3  GLU  72           2HB      GLU  72  10.200  11.353  -2.799
  557    HG2  GLU  72           1HG      GLU  72   8.858  13.487  -3.115
  558    HG3  GLU  72           2HG      GLU  72   9.103  13.741  -1.372
  559    H    THR  73           H        THR  73   8.469   9.673  -3.686
  560    HA   THR  73           HA       THR  73   6.307  11.163  -5.050
  561    HB   THR  73           HB       THR  73   7.886   8.697  -5.895
  562    HG1  THR  73           HG1      THR  73   8.911  10.260  -7.282
  563   HG21  THR  73          3HG2      THR  73   5.998  10.502  -7.460
  564   HG22  THR  73          1HG2      THR  73   6.956   9.165  -8.137
  565   HG23  THR  73          2HG2      THR  73   5.661   8.827  -6.964
  566    H    VAL  74           H        VAL  74   6.833   7.907  -3.688
  567    HA   VAL  74           HA       VAL  74   4.364   6.877  -4.857
  568    HB   VAL  74           HB       VAL  74   6.205   5.787  -2.688
  569   HG11  VAL  74          1HG1      VAL  74   5.016   3.648  -3.043
  570   HG12  VAL  74          2HG1      VAL  74   3.907   4.908  -2.449
  571   HG13  VAL  74          3HG1      VAL  74   3.900   4.455  -4.169
  572   HG21  VAL  74          3HG2      VAL  74   7.271   5.953  -4.858
  573   HG22  VAL  74          1HG2      VAL  74   6.960   4.254  -4.434
  574   HG23  VAL  74          2HG2      VAL  74   5.914   5.081  -5.613
  575    H    LEU  75           H        LEU  75   5.235   8.012  -1.594
  576    HA   LEU  75           HA       LEU  75   3.001   6.678  -0.382
  577    HB2  LEU  75           1HB      LEU  75   4.904   7.199   0.769
  578    HB3  LEU  75           2HB      LEU  75   4.792   8.965   0.596
  579    HG   LEU  75           HG       LEU  75   2.633   8.867   1.897
  580   HD11  LEU  75          1HD1      LEU  75   2.239   6.810   3.279
  581   HD12  LEU  75          2HD1      LEU  75   2.159   6.445   1.541
  582   HD13  LEU  75          3HD1      LEU  75   3.614   6.022   2.472
  583   HD21  LEU  75          3HD2      LEU  75   4.703   9.576   2.940
  584   HD22  LEU  75          1HD2      LEU  75   3.730   8.637   4.097
  585   HD23  LEU  75          2HD2      LEU  75   5.136   7.889   3.299
  586    HA   PRO  76           HA       PRO  76   0.961  11.166  -0.501
  587    HB2  PRO  76           2HB      PRO  76   1.727  12.924  -1.935
  588    HB3  PRO  76           1HB      PRO  76   2.199  11.805  -3.220
  589    HG2  PRO  76           1HG      PRO  76   4.301  12.388  -2.269
  590    HG3  PRO  76           2HG      PRO  76   3.652  12.445  -0.624
  591    HD2  PRO  76           1HD      PRO  76   4.355  10.008  -2.308
  592    HD3  PRO  76           2HD      PRO  76   4.601  10.269  -0.577
  593    H    LYS  77           H        LYS  77   1.759   9.321  -3.443
  594    HA   LYS  77           HA       LYS  77  -0.914   9.572  -4.536
  595    HB2  LYS  77           1HB      LYS  77   1.348   7.642  -5.065
  596    HB3  LYS  77           2HB      LYS  77  -0.183   7.663  -5.973
  597    HG2  LYS  77           1HG      LYS  77   0.283   9.945  -6.738
  598    HG3  LYS  77           2HG      LYS  77   1.795   9.963  -5.799
  599    HD2  LYS  77           1HD      LYS  77   2.644   8.078  -7.147
  600    HD3  LYS  77           2HD      LYS  77   1.139   8.084  -8.094
  601    HE2  LYS  77           1HE      LYS  77   1.609  10.377  -8.835
  602    HE3  LYS  77           2HE      LYS  77   3.109  10.383  -7.879
  603    HZ1  LYS  77           3HZ      LYS  77   2.526   8.584 -10.144
  604    HZ2  LYS  77           1HZ      LYS  77   3.530   9.893 -10.193
  605    HZ3  LYS  77           2HZ      LYS  77   3.917   8.589  -9.259
  606    H    VAL  78           H        VAL  78   0.733   7.046  -2.647
  607    HA   VAL  78           HA       VAL  78  -1.395   5.142  -2.578
  608    HB   VAL  78           HB       VAL  78   0.663   5.878  -0.453
  609   HG11  VAL  78          1HG1      VAL  78   0.117   3.683   0.544
  610   HG12  VAL  78          2HG1      VAL  78  -1.302   4.757   0.544
  611   HG13  VAL  78          3HG1      VAL  78  -1.171   3.454  -0.662
  612   HG21  VAL  78          3HG2      VAL  78   1.654   5.084  -2.517
  613   HG22  VAL  78          1HG2      VAL  78   1.825   3.872  -1.225
  614   HG23  VAL  78          2HG2      VAL  78   0.597   3.651  -2.495
  615    H    GLU  79           H        GLU  79  -0.748   7.773  -0.253
  616    HA   GLU  79           HA       GLU  79  -3.118   7.390   1.273
  617    HB2  GLU  79           1HB      GLU  79  -1.189   8.819   1.890
  618    HB3  GLU  79           2HB      GLU  79  -1.704   9.984   0.647
  619    HG2  GLU  79           1HG      GLU  79  -3.887  10.302   1.933
  620    HG3  GLU  79           2HG      GLU  79  -3.221   9.107   3.068
  621    H    ALA  80           H        ALA  80  -2.565   9.279  -1.677
  622    HA   ALA  80           HA       ALA  80  -5.101  10.526  -1.805
  623    HB1  ALA  80           3HB      ALA  80  -3.350   9.533  -4.080
  624    HB2  ALA  80           1HB      ALA  80  -4.686  10.698  -4.228
  625    HB3  ALA  80           2HB      ALA  80  -3.237  11.121  -3.285
  626    H    VAL  81           H        VAL  81  -4.081   7.293  -2.841
  627    HA   VAL  81           HA       VAL  81  -6.457   6.572  -4.278
  628    HB   VAL  81           HB       VAL  81  -4.488   4.881  -2.687
  629   HG11  VAL  81          1HG1      VAL  81  -5.458   2.955  -3.896
  630   HG12  VAL  81          2HG1      VAL  81  -6.675   3.746  -2.867
  631   HG13  VAL  81          3HG1      VAL  81  -6.677   4.027  -4.624
  632   HG21  VAL  81          3HG2      VAL  81  -3.496   6.017  -4.584
  633   HG22  VAL  81          1HG2      VAL  81  -3.621   4.267  -4.887
  634   HG23  VAL  81          2HG2      VAL  81  -4.774   5.387  -5.652
  635    H    PHE  82           H        PHE  82  -5.679   6.219  -0.828
  636    HA   PHE  82           HA       PHE  82  -8.315   5.073  -0.262
  637    HB2  PHE  82           1HB      PHE  82  -6.165   6.176   1.599
  638    HB3  PHE  82           2HB      PHE  82  -7.604   5.261   2.100
  639    HD1  PHE  82           HD1      PHE  82  -4.201   5.086   1.161
  640    HD2  PHE  82           HD2      PHE  82  -7.872   2.903   1.108
  641    HE1  PHE  82           HE1      PHE  82  -2.939   2.973   0.919
  642    HE2  PHE  82           HE2      PHE  82  -6.615   0.788   0.868
  643    HZ   PHE  82           HZ       PHE  82  -4.148   0.824   0.771
  644    H    GLU  83           H        GLU  83  -6.849   8.269  -0.201
  645    HA   GLU  83           HA       GLU  83  -9.300   9.361   1.114
  646    HB2  GLU  83           1HB      GLU  83  -6.596  10.584   0.546
  647    HB3  GLU  83           2HB      GLU  83  -7.962  11.418   1.324
  648    HG2  GLU  83           1HG      GLU  83  -6.407   9.034   2.494
  649    HG3  GLU  83           2HG      GLU  83  -6.388  10.755   2.942
  650    H    LEU  84           H        LEU  84 -10.307   8.726  -1.051
  651    HA   LEU  84           HA       LEU  84  -9.943  10.902  -3.051
  652    HB2  LEU  84           1HB      LEU  84 -11.579   8.455  -2.924
  653    HB3  LEU  84           2HB      LEU  84 -11.632   9.483  -4.373
  654    HG   LEU  84           HG       LEU  84  -9.216   7.957  -3.325
  655   HD11  LEU  84          1HD1      LEU  84  -9.464   6.636  -5.443
  656   HD12  LEU  84          2HD1      LEU  84 -10.917   6.505  -4.427
  657   HD13  LEU  84          3HD1      LEU  84 -10.917   7.581  -5.845
  658   HD21  LEU  84          3HD2      LEU  84  -8.561  10.067  -4.325
  659   HD22  LEU  84          1HD2      LEU  84  -8.091   8.718  -5.388
  660   HD23  LEU  84          2HD2      LEU  84  -9.519   9.706  -5.783
  661    H    GLU  85           H        GLU  85 -11.471  10.658  -0.221
  662    HA   GLU  85           HA       GLU  85 -14.048  11.839  -1.101
  663    HB2  GLU  85           1HB      GLU  85 -12.921  11.159   1.617
  664    HB3  GLU  85           2HB      GLU  85 -14.523  11.879   1.330
  665    HG2  GLU  85           1HG      GLU  85 -15.157   9.780   0.013
  666    HG3  GLU  85           2HG      GLU  85 -13.513   9.223   0.402
  667    H    HIS  86           H        HIS  86 -11.002  12.969  -0.761
  668    HA   HIS  86           HA       HIS  86 -11.624  15.468   0.648
  669    HB2  HIS  86           1HB      HIS  86  -9.196  14.546  -0.951
  670    HB3  HIS  86           2HB      HIS  86  -9.315  16.121  -0.129
  671    HD2  HIS  86           HD2      HIS  86 -10.827  13.580   2.315
  672    HE1  HIS  86           HE1      HIS  86  -6.649  13.754   3.069
  673    HE2  HIS  86           HE2      HIS  86  -9.007  12.956   3.915
  674    H    HIS  87           H        HIS  87 -11.864  17.486  -0.157
  675    HA   HIS  87           HA       HIS  87 -12.164  17.712  -3.125
  676    HB2  HIS  87           1HB      HIS  87 -14.113  18.797  -1.040
  677    HB3  HIS  87           2HB      HIS  87 -14.191  19.092  -2.794
  678    HD1  HIS  87           HD1      HIS  87 -14.449  16.787  -4.267
  679    HD2  HIS  87           HD2      HIS  87 -15.591  16.546  -0.217
  680    HE1  HIS  87           HE1      HIS  87 -15.954  14.868  -4.105
  681    H    HIS  88           H        HIS  88 -10.666  18.768  -0.371
  682    HA   HIS  88           HA       HIS  88 -10.073  21.412  -1.653
  683    HB2  HIS  88           1HB      HIS  88 -10.396  20.861   1.333
  684    HB3  HIS  88           2HB      HIS  88  -9.900  22.406   0.604
  685    HD2  HIS  88           HD2      HIS  88 -13.174  20.681   1.750
  686    HE1  HIS  88           HE1      HIS  88 -14.187  23.833  -0.910
  687    HE2  HIS  88           HE2      HIS  88 -15.040  22.085   0.856
  688    H    HIS  89           H        HIS  89  -8.860  18.495  -1.101
  689    HA   HIS  89           HA       HIS  89  -6.140  19.563  -0.414
  690    HB2  HIS  89           1HB      HIS  89  -7.274  16.804   0.237
  691    HB3  HIS  89           2HB      HIS  89  -5.645  17.400   0.638
  692    HD2  HIS  89           HD2      HIS  89  -9.230  17.358   2.212
  693    HE1  HIS  89           HE1      HIS  89  -6.762  20.005   4.437
  694    HE2  HIS  89           HE2      HIS  89  -9.044  18.707   4.310
  695    H    HIS  90           H        HIS  90  -4.367  18.084  -1.149
  696    HA   HIS  90           HA       HIS  90  -4.911  16.512  -3.561
  697    HB2  HIS  90           1HB      HIS  90  -3.566  17.899  -5.083
  698    HB3  HIS  90           2HB      HIS  90  -4.939  18.849  -4.464
  699    HD2  HIS  90           HD2      HIS  90  -1.000  19.019  -4.528
  700    HE1  HIS  90           HE1      HIS  90  -2.533  22.172  -2.129
  701    HE2  HIS  90           HE2      HIS  90  -0.432  21.135  -3.321
  702    H    HIS  91           H        HIS  91  -2.930  15.640  -4.531
  703    HA   HIS  91           HA       HIS  91  -0.704  15.460  -2.541
  704    HB2  HIS  91           1HB      HIS  91  -2.131  13.128  -3.899
  705    HB3  HIS  91           2HB      HIS  91  -0.591  12.992  -3.017
  706    HD2  HIS  91           HD2      HIS  91  -0.847  12.898  -0.151
  707    HE1  HIS  91           HE1      HIS  91  -5.083  13.197  -0.238
  708    HE2  HIS  91           HE2      HIS  91  -2.937  12.752   1.214
  Start of MODEL    9
    1    H1   MET   1           1H       MET   1 -14.047   1.608   3.012
    2    H2   MET   1           2H       MET   1 -14.222   1.760   4.495
    3    H3   MET   1           3H       MET   1 -14.131   2.976   3.622
    4    HA   MET   1           HA       MET   1 -11.927   1.753   4.926
    5    HB2  MET   1           1HB      MET   1 -11.954   1.523   1.923
    6    HB3  MET   1           2HB      MET   1 -10.463   1.485   2.892
    7    HG2  MET   1           1HG      MET   1 -11.214  -0.514   4.044
    8    HG3  MET   1           2HG      MET   1 -12.779  -0.447   3.197
    9    HE1  MET   1           3HE      MET   1 -12.665  -0.265   0.340
   10    HE2  MET   1           1HE      MET   1 -12.143  -1.865  -0.244
   11    HE3  MET   1           2HE      MET   1 -13.271  -1.742   1.129
   12    H    LYS   2           H        LYS   2 -11.378   3.576   5.865
   13    HA   LYS   2           HA       LYS   2 -10.356   5.735   4.062
   14    HB2  LYS   2           1HB      LYS   2 -12.573   6.330   5.027
   15    HB3  LYS   2           2HB      LYS   2 -11.857   6.168   6.646
   16    HG2  LYS   2           1HG      LYS   2 -10.378   8.018   6.267
   17    HG3  LYS   2           2HG      LYS   2 -10.814   8.086   4.542
   18    HD2  LYS   2           1HD      LYS   2 -13.158   8.636   5.209
   19    HD3  LYS   2           2HD      LYS   2 -12.622   8.695   6.906
   20    HE2  LYS   2           1HE      LYS   2 -11.183  10.549   6.483
   21    HE3  LYS   2           2HE      LYS   2 -11.378  10.381   4.723
   22    HZ1  LYS   2           3HZ      LYS   2 -13.503  11.159   6.615
   23    HZ2  LYS   2           1HZ      LYS   2 -12.706  12.182   5.596
   24    HZ3  LYS   2           2HZ      LYS   2 -13.684  11.003   4.983
   25    H    ILE   3           H        ILE   3  -8.387   6.386   4.446
   26    HA   ILE   3           HA       ILE   3  -6.754   4.966   6.362
   27    HB   ILE   3           HB       ILE   3  -5.975   6.069   4.162
   28   HG12  ILE   3          1HG1      ILE   3  -4.398   6.773   6.620
   29   HG13  ILE   3          2HG1      ILE   3  -4.548   5.126   5.963
   30   HG21  ILE   3          1HG2      ILE   3  -5.267   8.429   4.356
   31   HG22  ILE   3          2HG2      ILE   3  -7.027   8.272   4.547
   32   HG23  ILE   3          3HG2      ILE   3  -5.996   8.514   5.976
   33   HD11  ILE   3          3HD1      ILE   3  -3.375   7.522   4.507
   34   HD12  ILE   3          1HD1      ILE   3  -2.449   6.188   5.232
   35   HD13  ILE   3          2HD1      ILE   3  -3.524   5.875   3.850
   36    H    ILE   4           H        ILE   4  -5.895   5.433   8.255
   37    HA   ILE   4           HA       ILE   4  -6.992   7.865   9.639
   38    HB   ILE   4           HB       ILE   4  -5.842   5.274  10.775
   39   HG12  ILE   4          1HG1      ILE   4  -8.650   6.335  10.916
   40   HG13  ILE   4          2HG1      ILE   4  -8.082   5.123   9.743
   41   HG21  ILE   4          1HG2      ILE   4  -6.521   6.199  12.964
   42   HG22  ILE   4          2HG2      ILE   4  -5.315   7.242  12.175
   43   HG23  ILE   4          3HG2      ILE   4  -7.033   7.705  12.168
   44   HD11  ILE   4          3HD1      ILE   4  -8.065   4.818  12.766
   45   HD12  ILE   4          1HD1      ILE   4  -9.218   4.054  11.648
   46   HD13  ILE   4          2HD1      ILE   4  -7.497   3.606  11.593
   47    H    SER   5           H        SER   5  -4.009   5.917   9.449
   48    HA   SER   5           HA       SER   5  -2.374   8.408   9.354
   49    HB2  SER   5           1HB      SER   5  -1.186   8.120  11.277
   50    HB3  SER   5           2HB      SER   5  -2.915   8.257  11.670
   51    HG   SER   5           HG       SER   5  -1.865   6.597  12.848
   52    H    ILE   6           H        ILE   6  -0.090   7.902   9.133
   53    HA   ILE   6           HA       ILE   6   0.477   5.070   8.295
   54    HB   ILE   6           HB       ILE   6   1.530   7.630   7.005
   55   HG12  ILE   6          1HG1      ILE   6  -0.356   5.547   5.931
   56   HG13  ILE   6          2HG1      ILE   6  -0.788   7.192   6.454
   57   HG21  ILE   6          1HG2      ILE   6   2.596   6.083   5.399
   58   HG22  ILE   6          2HG2      ILE   6   3.181   5.792   7.052
   59   HG23  ILE   6          3HG2      ILE   6   1.984   4.696   6.328
   60   HD11  ILE   6          3HD1      ILE   6   1.068   6.487   4.153
   61   HD12  ILE   6          1HD1      ILE   6  -0.609   7.056   4.000
   62   HD13  ILE   6          2HD1      ILE   6   0.637   8.132   4.677
   63    H    SER   7           H        SER   7   1.969   4.092   9.325
   64    HA   SER   7           HA       SER   7   3.933   5.725  10.956
   65    HB2  SER   7           1HB      SER   7   4.104   3.942  12.409
   66    HB3  SER   7           2HB      SER   7   2.416   4.486  12.258
   67    HG   SER   7           HG       SER   7   2.620   2.205  12.237
   68    H    GLU   8           H        GLU   8   6.064   4.860  11.155
   69    HA   GLU   8           HA       GLU   8   7.024   3.553   8.666
   70    HB2  GLU   8           1HB      GLU   8   8.472   4.761  11.027
   71    HB3  GLU   8           2HB      GLU   8   9.254   4.049   9.596
   72    HG2  GLU   8           1HG      GLU   8   8.176   5.853   8.163
   73    HG3  GLU   8           2HG      GLU   8   7.418   6.406   9.674
   74    H    THR   9           H        THR   9   8.816   1.956   8.896
   75    HA   THR   9           HA       THR   9   8.326   0.092  11.185
   76    HB   THR   9           HB       THR   9   8.175  -1.811   9.760
   77    HG1  THR   9           HG1      THR   9   8.345  -0.374   7.363
   78   HG21  THR   9          3HG2      THR   9   6.538   0.413   8.483
   79   HG22  THR   9          1HG2      THR   9   6.214  -1.329   8.339
   80   HG23  THR   9          2HG2      THR   9   6.072  -0.525   9.920
   81    HA   PRO  10           HA       PRO  10  12.609  -0.540  11.566
   82    HB2  PRO  10           2HB      PRO  10  12.970  -2.747  12.394
   83    HB3  PRO  10           1HB      PRO  10  12.159  -3.502  11.016
   84    HG2  PRO  10           1HG      PRO  10  10.519  -3.747  12.708
   85    HG3  PRO  10           2HG      PRO  10  10.933  -2.209  13.476
   86    HD2  PRO  10           1HD      PRO  10   9.295  -2.700  10.959
   87    HD3  PRO  10           2HD      PRO  10   9.032  -1.508  12.238
   88    H    ASN  11           H        ASN  11  11.040  -2.103   8.820
   89    HA   ASN  11           HA       ASN  11  13.558  -1.689   7.258
   90    HB2  ASN  11           1HB      ASN  11  12.235  -4.043   7.060
   91    HB3  ASN  11           2HB      ASN  11  11.071  -2.832   6.467
   92   HD21  ASN  11          2HD2      ASN  11  12.208  -5.130   5.107
   93   HD22  ASN  11          1HD2      ASN  11  13.005  -4.518   3.696
   94    H    HIS  12           H        HIS  12  13.791   0.175   6.317
   95    HA   HIS  12           HA       HIS  12  11.590   2.044   6.180
   96    HB2  HIS  12           1HB      HIS  12  13.205   3.600   5.284
   97    HB3  HIS  12           2HB      HIS  12  14.054   2.637   6.517
   98    HD2  HIS  12           HD2      HIS  12  14.367   3.481   2.685
   99    HE1  HIS  12           HE1      HIS  12  17.204   0.493   3.723
  100    HE2  HIS  12           HE2      HIS  12  16.369   2.199   1.905
  101    H    ASN  13           H        ASN  13  12.596  -0.444   4.108
  102    HA   ASN  13           HA       ASN  13  11.835   0.777   1.585
  103    HB2  ASN  13           1HB      ASN  13  12.194  -2.249   2.217
  104    HB3  ASN  13           2HB      ASN  13  11.649  -1.308   0.806
  105   HD21  ASN  13          2HD2      ASN  13  13.998  -3.055   1.253
  106   HD22  ASN  13          1HD2      ASN  13  15.372  -2.087   0.837
  107    H    THR  14           H        THR  14  10.075  -0.581   4.215
  108    HA   THR  14           HA       THR  14   7.573  -0.252   2.604
  109    HB   THR  14           HB       THR  14   7.956  -2.672   2.811
  110    HG1  THR  14           HG1      THR  14   5.992  -3.113   4.030
  111   HG21  THR  14          3HG2      THR  14   8.033  -2.126   5.805
  112   HG22  THR  14          1HG2      THR  14   8.039  -3.733   5.041
  113   HG23  THR  14          2HG2      THR  14   9.416  -2.628   4.805
  114    H    MET  15           H        MET  15   5.759   0.436   3.679
  115    HA   MET  15           HA       MET  15   6.227   1.410   6.478
  116    HB2  MET  15           1HB      MET  15   4.875   2.824   4.181
  117    HB3  MET  15           2HB      MET  15   4.812   3.352   5.880
  118    HG2  MET  15           1HG      MET  15   7.245   3.655   5.882
  119    HG3  MET  15           2HG      MET  15   7.321   3.108   4.191
  120    HE1  MET  15           3HE      MET  15   6.791   6.026   6.623
  121    HE2  MET  15           1HE      MET  15   5.769   7.175   5.723
  122    HE3  MET  15           2HE      MET  15   5.081   5.639   6.308
  123    H    LYS  16           H        LYS  16   4.290   1.830   7.705
  124    HA   LYS  16           HA       LYS  16   2.220  -0.232   7.032
  125    HB2  LYS  16           1HB      LYS  16   3.466  -0.713   9.047
  126    HB3  LYS  16           2HB      LYS  16   3.130   0.916   9.676
  127    HG2  LYS  16           1HG      LYS  16   0.695   0.349   9.683
  128    HG3  LYS  16           2HG      LYS  16   1.122  -1.312   9.207
  129    HD2  LYS  16           1HD      LYS  16   2.397  -1.618  11.250
  130    HD3  LYS  16           2HD      LYS  16   2.127   0.078  11.711
  131    HE2  LYS  16           1HE      LYS  16  -0.290  -0.337  11.839
  132    HE3  LYS  16           2HE      LYS  16  -0.024  -2.032  11.371
  133    HZ1  LYS  16           3HZ      LYS  16   1.009  -0.746  13.818
  134    HZ2  LYS  16           1HZ      LYS  16  -0.264  -1.792  13.749
  135    HZ3  LYS  16           2HZ      LYS  16   1.256  -2.319  13.384
  136    H    ILE  17           H        ILE  17   0.222   0.308   6.663
  137    HA   ILE  17           HA       ILE  17  -0.604   3.135   7.286
  138    HB   ILE  17           HB       ILE  17  -1.389   1.369   4.922
  139   HG12  ILE  17          1HG1      ILE  17   0.199   3.920   5.032
  140   HG13  ILE  17          2HG1      ILE  17   0.843   2.286   4.746
  141   HG21  ILE  17          1HG2      ILE  17  -2.668   3.343   4.164
  142   HG22  ILE  17          2HG2      ILE  17  -3.264   2.759   5.734
  143   HG23  ILE  17          3HG2      ILE  17  -2.229   4.203   5.659
  144   HD11  ILE  17          3HD1      ILE  17  -1.119   3.763   2.957
  145   HD12  ILE  17          1HD1      ILE  17   0.615   3.534   2.634
  146   HD13  ILE  17          2HD1      ILE  17  -0.477   2.129   2.670
  147    H    THR  18           H        THR  18  -2.127   3.405   8.644
  148    HA   THR  18           HA       THR  18  -3.760   1.032   9.405
  149    HB   THR  18           HB       THR  18  -3.420   3.742  10.757
  150    HG1  THR  18           HG1      THR  18  -2.250   2.438  12.289
  151   HG21  THR  18          3HG2      THR  18  -4.838   1.211  11.678
  152   HG22  THR  18          1HG2      THR  18  -4.608   2.685  12.647
  153   HG23  THR  18          2HG2      THR  18  -5.631   2.728  11.190
  154    H    LEU  19           H        LEU  19  -5.785   0.771   8.914
  155    HA   LEU  19           HA       LEU  19  -7.211   3.101   7.675
  156    HB2  LEU  19           1HB      LEU  19  -7.555   0.197   7.296
  157    HB3  LEU  19           2HB      LEU  19  -8.457   1.385   6.327
  158    HG   LEU  19           HG       LEU  19  -5.462   0.851   6.245
  159   HD11  LEU  19          1HD1      LEU  19  -5.937   0.139   3.886
  160   HD12  LEU  19          2HD1      LEU  19  -6.846  -0.847   5.055
  161   HD13  LEU  19          3HD1      LEU  19  -7.669   0.451   4.158
  162   HD21  LEU  19          3HD2      LEU  19  -5.913   3.218   5.973
  163   HD22  LEU  19          1HD2      LEU  19  -5.398   2.516   4.420
  164   HD23  LEU  19          2HD2      LEU  19  -7.117   2.874   4.709
  165    H    SER  20           H        SER  20  -9.444   3.308   7.972
  166    HA   SER  20           HA       SER  20 -10.434   2.621  10.657
  167    HB2  SER  20           1HB      SER  20 -12.358   3.748  10.077
  168    HB3  SER  20           2HB      SER  20 -10.913   4.694   9.655
  169    HG   SER  20           HG       SER  20 -12.810   4.407   8.090
  170    H    GLU  21           H        GLU  21 -11.629   1.901   7.333
  171    HA   GLU  21           HA       GLU  21 -12.412  -0.820   8.333
  172    HB2  GLU  21           1HB      GLU  21 -13.383   0.710   5.914
  173    HB3  GLU  21           2HB      GLU  21 -13.886  -0.928   6.394
  174    HG2  GLU  21           1HG      GLU  21 -14.413   1.579   8.100
  175    HG3  GLU  21           2HG      GLU  21 -15.491   0.830   6.900
  176    H    SER  22           H        SER  22 -12.469  -2.407   6.357
  177    HA   SER  22           HA       SER  22  -9.707  -2.326   5.114
  178    HB2  SER  22           1HB      SER  22  -9.640  -3.359   7.304
  179    HB3  SER  22           2HB      SER  22 -10.711  -4.626   6.664
  180    HG   SER  22           HG       SER  22  -8.543  -5.213   6.428
  181    H    ARG  23           H        ARG  23  -9.572  -4.697   3.996
  182    HA   ARG  23           HA       ARG  23 -11.371  -4.852   1.817
  183    HB2  ARG  23           1HB      ARG  23  -9.241  -5.937   1.839
  184    HB3  ARG  23           2HB      ARG  23  -9.825  -7.073   3.077
  185    HG2  ARG  23           1HG      ARG  23 -11.456  -7.986   1.526
  186    HG3  ARG  23           2HG      ARG  23 -10.996  -6.785   0.294
  187    HD2  ARG  23           1HD      ARG  23 -10.093  -8.974  -0.173
  188    HD3  ARG  23           2HD      ARG  23  -8.815  -7.770   0.119
  189    HE   ARG  23           HE       ARG  23  -8.148  -9.124   2.071
  190   HH11  ARG  23          1HH1      ARG  23 -11.254 -10.199   0.904
  191   HH12  ARG  23          2HH1      ARG  23 -11.147 -11.625   1.919
  192   HH21  ARG  23          2HH2      ARG  23  -9.301 -11.938   3.254
  193   HH22  ARG  23          1HH2      ARG  23  -8.015 -10.746   3.244
  194    H    GLU  24           H        GLU  24 -13.012  -6.338   1.285
  195    HA   GLU  24           HA       GLU  24 -15.232  -6.435   2.903
  196    HB2  GLU  24           1HB      GLU  24 -15.168  -7.206   0.584
  197    HB3  GLU  24           2HB      GLU  24 -14.263  -8.651   1.091
  198    HG2  GLU  24           1HG      GLU  24 -16.277  -9.401   2.438
  199    HG3  GLU  24           2HG      GLU  24 -17.024  -7.870   1.928
  200    H    GLY  25           H        GLY  25 -12.771  -9.041   2.819
  201    HA2  GLY  25           1HA      GLY  25 -13.576  -9.658   5.633
  202    HA3  GLY  25           2HA      GLY  25 -12.720 -10.774   4.545
  203    H    MET  26           H        MET  26 -12.094  -9.598   7.272
  204    HA   MET  26           HA       MET  26  -9.605  -8.073   6.682
  205    HB2  MET  26           1HB      MET  26 -11.089  -8.751   9.216
  206    HB3  MET  26           2HB      MET  26  -9.503  -7.946   9.184
  207    HG2  MET  26           1HG      MET  26 -10.472  -6.078   7.923
  208    HG3  MET  26           2HG      MET  26 -12.058  -6.884   7.941
  209    HE1  MET  26           3HE      MET  26 -12.968  -4.480   8.894
  210    HE2  MET  26           1HE      MET  26 -12.370  -3.749  10.403
  211    HE3  MET  26           2HE      MET  26 -11.308  -3.843   8.977
  212    H    THR  27           H        THR  27  -9.711 -10.809   5.845
  213    HA   THR  27           HA       THR  27  -7.537 -11.905   7.577
  214    HB   THR  27           HB       THR  27  -7.676 -13.916   6.200
  215    HG1  THR  27           HG1      THR  27  -9.250 -13.993   4.505
  216   HG21  THR  27          3HG2      THR  27 -10.447 -12.926   6.980
  217   HG22  THR  27          1HG2      THR  27  -9.986 -14.623   6.714
  218   HG23  THR  27          2HG2      THR  27  -9.280 -13.710   8.069
  219    H    SER  28           H        SER  28  -5.657 -12.857   6.395
  220    HA   SER  28           HA       SER  28  -4.215 -10.590   5.269
  221    HB2  SER  28           1HB      SER  28  -2.374 -11.922   5.225
  222    HB3  SER  28           2HB      SER  28  -3.259 -12.206   6.742
  223    HG   SER  28           HG       SER  28  -2.525 -14.143   5.768
  224    H    ASP  29           H        ASP  29  -3.267 -10.409   3.226
  225    HA   ASP  29           HA       ASP  29  -3.765 -12.346   1.109
  226    HB2  ASP  29           1HB      ASP  29  -5.998 -10.839   1.400
  227    HB3  ASP  29           2HB      ASP  29  -4.862  -9.675   0.674
  228    H    THR  30           H        THR  30  -2.764 -11.818  -0.880
  229    HA   THR  30           HA       THR  30  -0.573  -9.801  -0.495
  230    HB   THR  30           HB       THR  30  -0.399 -12.534  -1.835
  231    HG1  THR  30           HG1      THR  30   1.043 -12.934  -0.055
  232   HG21  THR  30          3HG2      THR  30   1.712 -10.394  -1.347
  233   HG22  THR  30          1HG2      THR  30   2.005 -12.005  -2.042
  234   HG23  THR  30          2HG2      THR  30   1.011 -10.821  -2.926
  235    H    TYR  31           H        TYR  31  -0.317  -8.330  -1.970
  236    HA   TYR  31           HA       TYR  31  -1.554  -8.807  -4.664
  237    HB2  TYR  31           1HB      TYR  31  -1.433  -6.216  -3.109
  238    HB3  TYR  31           2HB      TYR  31  -2.085  -6.436  -4.751
  239    HD1  TYR  31           HD1      TYR  31  -2.744  -6.785  -1.178
  240    HD2  TYR  31           HD2      TYR  31  -4.191  -7.719  -5.079
  241    HE1  TYR  31           HE1      TYR  31  -4.967  -7.304  -0.219
  242    HE2  TYR  31           HE2      TYR  31  -6.418  -8.241  -4.140
  243    HH   TYR  31           HH       TYR  31  -7.695  -8.366  -2.259
  244    H    THR  32           H        THR  32   0.080  -9.217  -5.951
  245    HA   THR  32           HA       THR  32   2.397  -7.307  -5.880
  246    HB   THR  32           HB       THR  32   3.782  -9.142  -6.796
  247    HG1  THR  32           HG1      THR  32   2.918 -11.219  -6.944
  248   HG21  THR  32          3HG2      THR  32   2.332  -9.902  -4.231
  249   HG22  THR  32          1HG2      THR  32   3.918 -10.516  -4.749
  250   HG23  THR  32          2HG2      THR  32   3.718  -8.792  -4.351
  251    H    LYS  33           H        LYS  33   0.320  -9.331  -7.932
  252    HA   LYS  33           HA       LYS  33   1.042  -7.518 -10.216
  253    HB2  LYS  33           1HB      LYS  33   0.287 -10.444 -10.213
  254    HB3  LYS  33           2HB      LYS  33   0.414  -9.430 -11.670
  255    HG2  LYS  33           1HG      LYS  33   2.808  -9.035 -11.152
  256    HG3  LYS  33           2HG      LYS  33   2.663 -10.118  -9.748
  257    HD2  LYS  33           1HD      LYS  33   2.027 -11.971 -11.245
  258    HD3  LYS  33           2HD      LYS  33   2.185 -10.887 -12.646
  259    HE2  LYS  33           1HE      LYS  33   4.561 -10.549 -12.119
  260    HE3  LYS  33           2HE      LYS  33   4.405 -11.635 -10.719
  261    HZ1  LYS  33           3HZ      LYS  33   3.991 -12.401 -13.537
  262    HZ2  LYS  33           1HZ      LYS  33   5.316 -12.772 -12.628
  263    HZ3  LYS  33           2HZ      LYS  33   3.845 -13.408 -12.240
  264    H    VAL  34           H        VAL  34  -0.512  -6.651 -11.440
  265    HA   VAL  34           HA       VAL  34  -3.082  -6.226 -10.188
  266    HB   VAL  34           HB       VAL  34  -2.148  -5.707 -13.041
  267   HG11  VAL  34          1HG1      VAL  34  -4.089  -4.180 -13.162
  268   HG12  VAL  34          2HG1      VAL  34  -4.610  -5.859 -12.881
  269   HG13  VAL  34          3HG1      VAL  34  -4.594  -4.693 -11.535
  270   HG21  VAL  34          3HG2      VAL  34  -0.850  -4.487 -11.398
  271   HG22  VAL  34          1HG2      VAL  34  -1.916  -3.388 -12.305
  272   HG23  VAL  34          2HG2      VAL  34  -2.343  -3.874 -10.647
  273    H    ASP  35           H        ASP  35  -4.791  -7.369 -10.063
  274    HA   ASP  35           HA       ASP  35  -5.483  -9.161 -12.348
  275    HB2  ASP  35           1HB      ASP  35  -4.347 -10.388 -10.216
  276    HB3  ASP  35           2HB      ASP  35  -5.953  -9.956  -9.578
  277    H    ASP  36           H        ASP  36  -7.708  -9.878 -12.338
  278    HA   ASP  36           HA       ASP  36  -9.445  -7.594 -11.846
  279    HB2  ASP  36           1HB      ASP  36 -10.050 -10.433 -12.868
  280    HB3  ASP  36           2HB      ASP  36 -11.178  -9.095 -12.540
  281    H    SER  37           H        SER  37  -8.750 -10.599 -10.185
  282    HA   SER  37           HA       SER  37 -11.047 -10.711  -8.430
  283    HB2  SER  37           1HB      SER  37  -9.851 -12.165  -7.135
  284    HB3  SER  37           2HB      SER  37  -9.593 -12.539  -8.855
  285    HG   SER  37           HG       SER  37  -7.661 -12.616  -7.629
  286    H    GLN  38           H        GLN  38  -8.308  -8.578  -8.600
  287    HA   GLN  38           HA       GLN  38  -8.407  -7.937  -5.706
  288    HB2  GLN  38           1HB      GLN  38  -6.717  -6.708  -7.887
  289    HB3  GLN  38           2HB      GLN  38  -6.485  -6.573  -6.128
  290    HG2  GLN  38           1HG      GLN  38  -5.737  -9.103  -6.095
  291    HG3  GLN  38           2HG      GLN  38  -6.473  -8.988  -7.711
  292   HE21  GLN  38          2HE2      GLN  38  -3.770  -9.882  -6.804
  293   HE22  GLN  38          1HE2      GLN  38  -2.646  -8.914  -7.700
  294    HA   PRO  39           HA       PRO  39 -10.967  -4.346  -5.941
  295    HB2  PRO  39           2HB      PRO  39 -10.543  -3.189  -3.904
  296    HB3  PRO  39           1HB      PRO  39  -8.799  -3.116  -4.197
  297    HG2  PRO  39           1HG      PRO  39  -8.907  -4.797  -2.535
  298    HG3  PRO  39           2HG      PRO  39 -10.458  -5.419  -3.117
  299    HD2  PRO  39           1HD      PRO  39  -7.675  -5.875  -4.264
  300    HD3  PRO  39           2HD      PRO  39  -9.014  -7.019  -4.114
  301    H    ALA  40           H        ALA  40 -11.151  -2.779  -7.302
  302    HA   ALA  40           HA       ALA  40  -9.210  -2.267  -9.269
  303    HB1  ALA  40           3HB      ALA  40 -11.432  -0.437  -8.300
  304    HB2  ALA  40           1HB      ALA  40 -10.556  -0.284  -9.841
  305    HB3  ALA  40           2HB      ALA  40 -11.582  -1.706  -9.538
  306    H    PHE  41           H        PHE  41  -9.847  -0.503  -6.247
  307    HA   PHE  41           HA       PHE  41  -7.921   1.593  -6.849
  308    HB2  PHE  41           1HB      PHE  41  -8.365   2.367  -4.594
  309    HB3  PHE  41           2HB      PHE  41  -9.912   1.852  -5.304
  310    HD1  PHE  41           HD1      PHE  41  -7.282   1.029  -2.874
  311    HD2  PHE  41           HD2      PHE  41 -11.124   0.009  -4.438
  312    HE1  PHE  41           HE1      PHE  41  -7.677  -0.447  -0.932
  313    HE2  PHE  41           HE2      PHE  41 -11.524  -1.467  -2.498
  314    HZ   PHE  41           HZ       PHE  41  -9.799  -1.697  -0.744
  315    H    ILE  42           H        ILE  42  -7.764  -1.539  -5.291
  316    HA   ILE  42           HA       ILE  42  -4.998  -1.214  -4.398
  317    HB   ILE  42           HB       ILE  42  -6.704  -3.665  -5.018
  318   HG12  ILE  42          1HG1      ILE  42  -7.415  -2.405  -3.100
  319   HG13  ILE  42          2HG1      ILE  42  -6.748  -3.991  -2.649
  320   HG21  ILE  42          1HG2      ILE  42  -4.896  -4.977  -3.960
  321   HG22  ILE  42          2HG2      ILE  42  -4.315  -4.151  -5.425
  322   HG23  ILE  42          3HG2      ILE  42  -3.908  -3.503  -3.819
  323   HD11  ILE  42          3HD1      ILE  42  -5.306  -1.326  -2.420
  324   HD12  ILE  42          1HD1      ILE  42  -6.022  -2.242  -1.074
  325   HD13  ILE  42          2HD1      ILE  42  -4.638  -2.914  -1.970
  326    H    ASN  43           H        ASN  43  -6.540  -2.226  -7.397
  327    HA   ASN  43           HA       ASN  43  -4.119  -3.016  -8.732
  328    HB2  ASN  43           1HB      ASN  43  -6.704  -1.936 -10.087
  329    HB3  ASN  43           2HB      ASN  43  -5.123  -2.544 -10.632
  330   HD21  ASN  43          2HD2      ASN  43  -7.924  -3.530 -10.944
  331   HD22  ASN  43          1HD2      ASN  43  -7.876  -5.179 -10.413
  332    H    ASP  44           H        ASP  44  -5.773   0.127  -8.486
  333    HA   ASP  44           HA       ASP  44  -3.953   1.654 -10.033
  334    HB2  ASP  44           1HB      ASP  44  -5.523   2.462  -7.510
  335    HB3  ASP  44           2HB      ASP  44  -4.482   3.456  -8.559
  336    H    ILE  45           H        ILE  45  -3.795   0.828  -6.564
  337    HA   ILE  45           HA       ILE  45  -1.360   2.235  -6.020
  338    HB   ILE  45           HB       ILE  45  -2.575  -0.267  -4.769
  339   HG12  ILE  45          1HG1      ILE  45  -2.405   2.543  -3.723
  340   HG13  ILE  45          2HG1      ILE  45  -3.802   1.876  -4.602
  341   HG21  ILE  45          1HG2      ILE  45  -0.984   0.091  -2.912
  342   HG22  ILE  45          2HG2      ILE  45  -0.125  -0.248  -4.433
  343   HG23  ILE  45          3HG2      ILE  45  -0.223   1.419  -3.819
  344   HD11  ILE  45          3HD1      ILE  45  -2.693   0.835  -1.969
  345   HD12  ILE  45          1HD1      ILE  45  -4.168   1.809  -2.166
  346   HD13  ILE  45          2HD1      ILE  45  -4.088   0.167  -2.848
  347    H    LEU  46           H        LEU  46  -1.861  -1.112  -7.096
  348    HA   LEU  46           HA       LEU  46   0.902  -1.821  -7.157
  349    HB2  LEU  46           1HB      LEU  46  -1.443  -2.579  -8.764
  350    HB3  LEU  46           2HB      LEU  46   0.070  -3.489  -8.978
  351    HG   LEU  46           HG       LEU  46  -1.570  -3.295  -6.422
  352   HD11  LEU  46          1HD1      LEU  46  -1.989  -5.738  -6.812
  353   HD12  LEU  46          2HD1      LEU  46  -2.608  -4.754  -8.156
  354   HD13  LEU  46          3HD1      LEU  46  -1.073  -5.637  -8.333
  355   HD21  LEU  46          3HD2      LEU  46   0.804  -3.438  -5.951
  356   HD22  LEU  46          1HD2      LEU  46   0.008  -4.972  -5.526
  357   HD23  LEU  46          2HD2      LEU  46   0.963  -4.848  -7.024
  358    H    LYS  47           H        LYS  47  -1.099  -0.054  -9.461
  359    HA   LYS  47           HA       LYS  47   0.921  -0.200 -11.577
  360    HB2  LYS  47           1HB      LYS  47  -1.617   1.394 -11.225
  361    HB3  LYS  47           2HB      LYS  47  -0.568   1.502 -12.658
  362    HG2  LYS  47           1HG      LYS  47  -0.946  -0.877 -13.128
  363    HG3  LYS  47           2HG      LYS  47  -1.975  -1.006 -11.683
  364    HD2  LYS  47           1HD      LYS  47  -3.536   0.636 -12.645
  365    HD3  LYS  47           2HD      LYS  47  -2.508   0.766 -14.091
  366    HE2  LYS  47           1HE      LYS  47  -2.863  -1.624 -14.554
  367    HE3  LYS  47           2HE      LYS  47  -3.903  -1.745 -13.115
  368    HZ1  LYS  47           3HZ      LYS  47  -4.436  -0.062 -15.479
  369    HZ2  LYS  47           1HZ      LYS  47  -5.191  -1.485 -15.125
  370    HZ3  LYS  47           2HZ      LYS  47  -5.401  -0.174 -14.145
  371    H    VAL  48           H        VAL  48   0.357   1.802  -8.840
  372    HA   VAL  48           HA       VAL  48   1.663   4.219  -9.695
  373    HB   VAL  48           HB       VAL  48   1.545   2.865  -6.970
  374   HG11  VAL  48          1HG1      VAL  48   2.245   5.060  -6.072
  375   HG12  VAL  48          2HG1      VAL  48   3.495   4.374  -7.136
  376   HG13  VAL  48          3HG1      VAL  48   2.437   5.675  -7.731
  377   HG21  VAL  48          3HG2      VAL  48  -0.628   3.516  -7.821
  378   HG22  VAL  48          1HG2      VAL  48  -0.140   4.563  -6.468
  379   HG23  VAL  48          2HG2      VAL  48  -0.031   5.162  -8.141
  380    H    GLU  49           H        GLU  49   3.572   4.692 -10.308
  381    HA   GLU  49           HA       GLU  49   5.656   2.735 -10.509
  382    HB2  GLU  49           1HB      GLU  49   5.428   4.749 -11.925
  383    HB3  GLU  49           2HB      GLU  49   5.868   5.750 -10.521
  384    HG2  GLU  49           1HG      GLU  49   8.144   4.616 -10.479
  385    HG3  GLU  49           2HG      GLU  49   7.533   3.647 -11.839
  386    H    GLY  50           H        GLY  50   7.029   1.946  -9.138
  387    HA2  GLY  50           1HA      GLY  50   8.832   2.398  -7.547
  388    HA3  GLY  50           2HA      GLY  50   7.793   3.627  -6.786
  389    H    VAL  51           H        VAL  51   5.448   1.717  -7.161
  390    HA   VAL  51           HA       VAL  51   5.704   0.361  -4.557
  391    HB   VAL  51           HB       VAL  51   3.503   0.313  -6.663
  392   HG11  VAL  51          1HG1      VAL  51   2.121  -0.670  -4.865
  393   HG12  VAL  51          2HG1      VAL  51   3.506  -1.718  -5.255
  394   HG13  VAL  51          3HG1      VAL  51   3.539  -0.704  -3.793
  395   HG21  VAL  51          3HG2      VAL  51   3.808   2.515  -5.701
  396   HG22  VAL  51          1HG2      VAL  51   2.297   1.777  -5.124
  397   HG23  VAL  51          2HG2      VAL  51   3.722   1.831  -4.060
  398    H    LYS  52           H        LYS  52   6.382  -1.536  -4.110
  399    HA   LYS  52           HA       LYS  52   6.971  -3.366  -6.400
  400    HB2  LYS  52           1HB      LYS  52   8.837  -2.717  -4.958
  401    HB3  LYS  52           2HB      LYS  52   7.960  -3.348  -3.543
  402    HG2  LYS  52           1HG      LYS  52   8.046  -5.613  -4.488
  403    HG3  LYS  52           2HG      LYS  52   8.902  -4.990  -5.918
  404    HD2  LYS  52           1HD      LYS  52  10.744  -4.216  -4.447
  405    HD3  LYS  52           2HD      LYS  52   9.897  -4.924  -3.050
  406    HE2  LYS  52           1HE      LYS  52  10.060  -7.144  -4.031
  407    HE3  LYS  52           2HE      LYS  52  10.807  -6.468  -5.497
  408    HZ1  LYS  52           3HZ      LYS  52  11.973  -6.395  -2.788
  409    HZ2  LYS  52           1HZ      LYS  52  12.446  -7.398  -4.009
  410    HZ3  LYS  52           2HZ      LYS  52  12.667  -5.768  -4.147
  411    H    SER  53           H        SER  53   5.590  -3.420  -3.106
  412    HA   SER  53           HA       SER  53   3.919  -5.810  -3.873
  413    HB2  SER  53           1HB      SER  53   5.918  -6.768  -3.156
  414    HB3  SER  53           2HB      SER  53   5.859  -5.839  -1.641
  415    HG   SER  53           HG       SER  53   5.001  -7.949  -1.421
  416    H    ILE  54           H        ILE  54   1.928  -5.573  -3.080
  417    HA   ILE  54           HA       ILE  54   1.550  -3.892  -0.613
  418    HB   ILE  54           HB       ILE  54  -0.450  -4.540  -2.828
  419   HG12  ILE  54          1HG1      ILE  54   1.232  -3.015  -3.601
  420   HG13  ILE  54          2HG1      ILE  54  -0.348  -2.218  -3.419
  421   HG21  ILE  54          1HG2      ILE  54  -1.903  -2.932  -1.641
  422   HG22  ILE  54          2HG2      ILE  54  -1.482  -4.306  -0.594
  423   HG23  ILE  54          3HG2      ILE  54  -0.662  -2.741  -0.380
  424   HD11  ILE  54          3HD1      ILE  54   1.982  -2.007  -1.480
  425   HD12  ILE  54          1HD1      ILE  54   1.478  -0.759  -2.642
  426   HD13  ILE  54          2HD1      ILE  54   0.402  -1.212  -1.299
  427    H    PHE  55           H        PHE  55   1.204  -4.896   1.147
  428    HA   PHE  55           HA       PHE  55  -0.093  -7.601   0.991
  429    HB2  PHE  55           1HB      PHE  55   2.230  -7.747   1.786
  430    HB3  PHE  55           2HB      PHE  55   1.901  -6.515   3.026
  431    HD1  PHE  55           HD1      PHE  55   0.680  -9.849   1.873
  432    HD2  PHE  55           HD2      PHE  55   1.377  -7.181   5.137
  433    HE1  PHE  55           HE1      PHE  55   0.029 -11.627   3.463
  434    HE2  PHE  55           HE2      PHE  55   0.728  -8.958   6.730
  435    HZ   PHE  55           HZ       PHE  55   0.052 -11.180   5.891
  436    H    HIS  56           H        HIS  56  -2.001  -7.835   1.827
  437    HA   HIS  56           HA       HIS  56  -2.966  -5.799   3.788
  438    HB2  HIS  56           1HB      HIS  56  -4.482  -6.110   1.910
  439    HB3  HIS  56           2HB      HIS  56  -4.444  -7.877   2.117
  440    HD1  HIS  56           HD1      HIS  56  -6.530  -8.693   3.068
  441    HD2  HIS  56           HD2      HIS  56  -5.531  -4.953   4.734
  442    HE1  HIS  56           HE1      HIS  56  -8.345  -8.134   4.607
  443    H    VAL  57           H        VAL  57  -3.319  -6.206   5.840
  444    HA   VAL  57           HA       VAL  57  -3.967  -8.979   6.697
  445    HB   VAL  57           HB       VAL  57  -1.531  -8.919   7.030
  446   HG11  VAL  57          1HG1      VAL  57  -0.523  -7.243   8.542
  447   HG12  VAL  57          2HG1      VAL  57  -1.243  -6.465   7.113
  448   HG13  VAL  57          3HG1      VAL  57  -2.094  -6.419   8.677
  449   HG21  VAL  57          3HG2      VAL  57  -2.889 -10.086   8.661
  450   HG22  VAL  57          1HG2      VAL  57  -1.474  -9.337   9.437
  451   HG23  VAL  57          2HG2      VAL  57  -3.080  -8.587   9.602
  452    H    MET  58           H        MET  58  -5.508  -9.075   8.087
  453    HA   MET  58           HA       MET  58  -7.234  -8.320   9.456
  454    HB2  MET  58           1HB      MET  58  -5.265  -8.177  10.964
  455    HB3  MET  58           2HB      MET  58  -5.085  -6.471  10.493
  456    HG2  MET  58           1HG      MET  58  -7.336  -6.005  11.397
  457    HG3  MET  58           2HG      MET  58  -7.472  -7.704  11.905
  458    HE1  MET  58           3HE      MET  58  -4.746  -8.511  13.078
  459    HE2  MET  58           1HE      MET  58  -4.896  -8.014  14.780
  460    HE3  MET  58           2HE      MET  58  -6.283  -8.753  13.942
  461    H    ASP  59           H        ASP  59  -6.011  -5.176   9.986
  462    HA   ASP  59           HA       ASP  59  -7.846  -4.039   7.919
  463    HB2  ASP  59           1HB      ASP  59  -8.955  -2.598   9.596
  464    HB3  ASP  59           2HB      ASP  59  -9.007  -4.341   9.958
  465    H    PHE  60           H        PHE  60  -4.935  -4.242   8.124
  466    HA   PHE  60           HA       PHE  60  -4.480  -1.388   7.495
  467    HB2  PHE  60           1HB      PHE  60  -2.423  -1.262   8.855
  468    HB3  PHE  60           2HB      PHE  60  -3.835  -1.551   9.894
  469    HD1  PHE  60           HD1      PHE  60  -0.661  -2.813   8.707
  470    HD2  PHE  60           HD2      PHE  60  -4.221  -3.773  10.866
  471    HE1  PHE  60           HE1      PHE  60   0.473  -4.770   9.703
  472    HE2  PHE  60           HE2      PHE  60  -3.088  -5.729  11.867
  473    HZ   PHE  60           HZ       PHE  60  -0.741  -6.229  11.284
  474    H    ILE  61           H        ILE  61  -2.415  -1.019   6.412
  475    HA   ILE  61           HA       ILE  61  -1.855  -3.401   4.658
  476    HB   ILE  61           HB       ILE  61  -2.002  -0.453   3.871
  477   HG12  ILE  61          1HG1      ILE  61  -4.182  -1.368   4.396
  478   HG13  ILE  61          2HG1      ILE  61  -3.988  -0.963   2.673
  479   HG21  ILE  61          1HG2      ILE  61  -1.774  -1.325   1.569
  480   HG22  ILE  61          2HG2      ILE  61  -0.367  -1.767   2.563
  481   HG23  ILE  61          3HG2      ILE  61  -1.622  -2.978   2.210
  482   HD11  ILE  61          3HD1      ILE  61  -3.841  -3.752   3.872
  483   HD12  ILE  61          1HD1      ILE  61  -5.211  -3.083   2.957
  484   HD13  ILE  61          2HD1      ILE  61  -3.644  -3.347   2.151
  485    H    SER  62           H        SER  62   0.111  -4.018   4.316
  486    HA   SER  62           HA       SER  62   2.402  -2.247   5.147
  487    HB2  SER  62           1HB      SER  62   2.448  -4.392   6.021
  488    HB3  SER  62           2HB      SER  62   2.306  -5.108   4.399
  489    HG   SER  62           HG       SER  62   4.475  -4.977   5.171
  490    H    VAL  63           H        VAL  63   3.000  -0.846   3.590
  491    HA   VAL  63           HA       VAL  63   2.877  -1.728   0.714
  492    HB   VAL  63           HB       VAL  63   3.073   1.064   1.921
  493   HG11  VAL  63          1HG1      VAL  63   2.739   1.821  -0.408
  494   HG12  VAL  63          2HG1      VAL  63   4.225   0.854  -0.256
  495   HG13  VAL  63          3HG1      VAL  63   2.759   0.130  -0.962
  496   HG21  VAL  63          3HG2      VAL  63   0.885   0.093   2.287
  497   HG22  VAL  63          1HG2      VAL  63   0.809   1.380   1.063
  498   HG23  VAL  63          2HG2      VAL  63   0.761  -0.326   0.561
  499    H    ASP  64           H        ASP  64   4.607  -2.457  -0.138
  500    HA   ASP  64           HA       ASP  64   7.228  -1.426   0.898
  501    HB2  ASP  64           1HB      ASP  64   6.746  -3.955   1.236
  502    HB3  ASP  64           2HB      ASP  64   6.599  -3.925  -0.537
  503    H    LYS  65           H        LYS  65   8.401  -0.234  -0.358
  504    HA   LYS  65           HA       LYS  65   7.686  -0.123  -3.258
  505    HB2  LYS  65           1HB      LYS  65   8.694   2.016  -3.298
  506    HB3  LYS  65           2HB      LYS  65   7.597   1.950  -1.900
  507    HG2  LYS  65           1HG      LYS  65   9.404   1.800  -0.360
  508    HG3  LYS  65           2HG      LYS  65  10.575   1.470  -1.657
  509    HD2  LYS  65           1HD      LYS  65  10.266   3.727  -2.547
  510    HD3  LYS  65           2HD      LYS  65   9.035   4.064  -1.306
  511    HE2  LYS  65           1HE      LYS  65  11.071   5.059  -0.559
  512    HE3  LYS  65           2HE      LYS  65  10.789   3.612   0.435
  513    HZ1  LYS  65           3HZ      LYS  65  12.620   3.775  -1.871
  514    HZ2  LYS  65           1HZ      LYS  65  13.074   3.763  -0.287
  515    HZ3  LYS  65           2HZ      LYS  65  12.358   2.433  -0.949
  516    H    GLU  66           H        GLU  66   9.630   0.575  -4.664
  517    HA   GLU  66           HA       GLU  66  11.832  -1.327  -4.330
  518    HB2  GLU  66           1HB      GLU  66  11.417   1.004  -6.207
  519    HB3  GLU  66           2HB      GLU  66  12.783  -0.134  -6.274
  520    HG2  GLU  66           1HG      GLU  66  11.092  -2.014  -6.713
  521    HG3  GLU  66           2HG      GLU  66   9.877  -0.717  -6.649
  522    H    ASN  67           H        ASN  67  13.938  -0.952  -3.847
  523    HA   ASN  67           HA       ASN  67  14.378   0.976  -1.759
  524    HB2  ASN  67           1HB      ASN  67  15.782  -1.304  -2.095
  525    HB3  ASN  67           2HB      ASN  67  16.306  -0.272  -3.449
  526   HD21  ASN  67          2HD2      ASN  67  15.779   0.222   0.033
  527   HD22  ASN  67          1HD2      ASN  67  17.338   0.908   0.352
  528    H    ASP  68           H        ASP  68  15.099   0.984  -5.214
  529    HA   ASP  68           HA       ASP  68  16.698   3.399  -5.145
  530    HB2  ASP  68           1HB      ASP  68  15.165   2.056  -7.451
  531    HB3  ASP  68           2HB      ASP  68  16.140   3.547  -7.464
  532    H    ALA  69           H        ALA  69  13.245   2.757  -5.644
  533    HA   ALA  69           HA       ALA  69  12.556   5.472  -6.260
  534    HB1  ALA  69           3HB      ALA  69  10.868   3.259  -5.042
  535    HB2  ALA  69           1HB      ALA  69  10.250   4.774  -5.738
  536    HB3  ALA  69           2HB      ALA  69  11.073   3.587  -6.778
  537    H    ASN  70           H        ASN  70  11.046   6.781  -4.886
  538    HA   ASN  70           HA       ASN  70  11.965   6.742  -2.028
  539    HB2  ASN  70           1HB      ASN  70  11.561   9.394  -3.599
  540    HB3  ASN  70           2HB      ASN  70  11.879   8.882  -1.924
  541   HD21  ASN  70          2HD2      ASN  70  13.181   9.420  -5.063
  542   HD22  ASN  70          1HD2      ASN  70  14.842   9.116  -4.674
  543    H    TRP  71           H        TRP  71  10.553   7.481  -0.464
  544    HA   TRP  71           HA       TRP  71   7.750   6.930  -0.990
  545    HB2  TRP  71           1HB      TRP  71   9.273   8.017   1.405
  546    HB3  TRP  71           2HB      TRP  71   7.501   7.849   1.394
  547    HD1  TRP  71           HD1      TRP  71  10.322   6.204   2.522
  548    HE1  TRP  71           HE1      TRP  71   9.932   3.553   2.883
  549    HE3  TRP  71           HE3      TRP  71   6.054   5.717  -0.194
  550    HZ2  TRP  71           HZ2      TRP  71   8.039   1.715   2.063
  551    HZ3  TRP  71           HZ3      TRP  71   4.985   3.557  -0.398
  552    HH2  TRP  71           HH2      TRP  71   5.908   1.556   0.688
  553    H    GLU  72           H        GLU  72   9.732   9.773  -1.104
  554    HA   GLU  72           HA       GLU  72   7.789  11.809  -0.814
  555    HB2  GLU  72           1HB      GLU  72  10.200  12.181  -1.080
  556    HB3  GLU  72           2HB      GLU  72  10.081  11.659  -2.778
  557    HG2  GLU  72           1HG      GLU  72   8.578  13.653  -3.246
  558    HG3  GLU  72           2HG      GLU  72   8.732  14.006  -1.509
  559    H    THR  73           H        THR  73   8.524   9.786  -3.637
  560    HA   THR  73           HA       THR  73   6.328  11.049  -5.165
  561    HB   THR  73           HB       THR  73   8.120   8.673  -5.823
  562    HG1  THR  73           HG1      THR  73   9.095  10.244  -7.235
  563   HG21  THR  73          3HG2      THR  73   6.182  10.258  -7.553
  564   HG22  THR  73          1HG2      THR  73   7.268   8.969  -8.121
  565   HG23  THR  73          2HG2      THR  73   5.946   8.588  -6.993
  566    H    VAL  74           H        VAL  74   7.028   7.901  -3.637
  567    HA   VAL  74           HA       VAL  74   4.682   6.647  -4.841
  568    HB   VAL  74           HB       VAL  74   6.507   5.784  -2.559
  569   HG11  VAL  74          1HG1      VAL  74   5.488   3.552  -2.866
  570   HG12  VAL  74          2HG1      VAL  74   4.269   4.751  -2.374
  571   HG13  VAL  74          3HG1      VAL  74   4.368   4.229  -4.072
  572   HG21  VAL  74          3HG2      VAL  74   7.650   5.939  -4.690
  573   HG22  VAL  74          1HG2      VAL  74   7.443   4.240  -4.205
  574   HG23  VAL  74          2HG2      VAL  74   6.394   4.941  -5.459
  575    H    LEU  75           H        LEU  75   5.344   7.990  -1.605
  576    HA   LEU  75           HA       LEU  75   3.185   6.496  -0.429
  577    HB2  LEU  75           1HB      LEU  75   5.148   7.302   0.636
  578    HB3  LEU  75           2HB      LEU  75   4.601   8.994   0.648
  579    HG   LEU  75           HG       LEU  75   2.588   8.238   1.968
  580   HD11  LEU  75          1HD1      LEU  75   2.777   6.032   3.149
  581   HD12  LEU  75          2HD1      LEU  75   2.714   5.818   1.383
  582   HD13  LEU  75          3HD1      LEU  75   4.269   5.694   2.240
  583   HD21  LEU  75          3HD2      LEU  75   4.458   9.349   3.039
  584   HD22  LEU  75          1HD2      LEU  75   3.801   8.094   4.115
  585   HD23  LEU  75          2HD2      LEU  75   5.313   7.798   3.221
  586    HA   PRO  76           HA       PRO  76   0.862  10.825  -0.646
  587    HB2  PRO  76           2HB      PRO  76   1.533  12.624  -2.074
  588    HB3  PRO  76           1HB      PRO  76   2.069  11.536  -3.361
  589    HG2  PRO  76           1HG      PRO  76   4.134  12.235  -2.411
  590    HG3  PRO  76           2HG      PRO  76   3.484  12.257  -0.766
  591    HD2  PRO  76           1HD      PRO  76   4.317   9.861  -2.452
  592    HD3  PRO  76           2HD      PRO  76   4.560  10.140  -0.723
  593    H    LYS  77           H        LYS  77   1.794   8.973  -3.541
  594    HA   LYS  77           HA       LYS  77  -0.847   9.201  -4.724
  595    HB2  LYS  77           1HB      LYS  77   1.482   7.349  -5.237
  596    HB3  LYS  77           2HB      LYS  77  -0.016   7.364  -6.197
  597    HG2  LYS  77           1HG      LYS  77   0.419   9.693  -6.851
  598    HG3  LYS  77           2HG      LYS  77   1.913   9.687  -5.884
  599    HD2  LYS  77           1HD      LYS  77   2.797   7.854  -7.294
  600    HD3  LYS  77           2HD      LYS  77   1.317   7.915  -8.278
  601    HE2  LYS  77           1HE      LYS  77   1.814  10.249  -8.878
  602    HE3  LYS  77           2HE      LYS  77   3.296  10.183  -7.900
  603    HZ1  LYS  77           3HZ      LYS  77   2.731   8.521 -10.272
  604    HZ2  LYS  77           1HZ      LYS  77   3.750   9.818 -10.230
  605    HZ3  LYS  77           2HZ      LYS  77   4.108   8.459  -9.366
  606    H    VAL  78           H        VAL  78   0.837   6.578  -2.988
  607    HA   VAL  78           HA       VAL  78  -1.417   4.749  -3.068
  608    HB   VAL  78           HB       VAL  78   0.941   4.935  -1.147
  609   HG11  VAL  78          1HG1      VAL  78   0.365   2.600  -0.570
  610   HG12  VAL  78          2HG1      VAL  78  -0.969   3.708  -0.169
  611   HG13  VAL  78          3HG1      VAL  78  -1.064   2.692  -1.628
  612   HG21  VAL  78          3HG2      VAL  78   1.637   4.564  -3.438
  613   HG22  VAL  78          1HG2      VAL  78   1.871   3.096  -2.461
  614   HG23  VAL  78          2HG2      VAL  78   0.496   3.205  -3.585
  615    H    GLU  79           H        GLU  79  -0.310   7.060  -0.599
  616    HA   GLU  79           HA       GLU  79  -2.339   6.546   1.310
  617    HB2  GLU  79           1HB      GLU  79  -0.432   7.985   1.736
  618    HB3  GLU  79           2HB      GLU  79  -1.021   9.153   0.529
  619    HG2  GLU  79           1HG      GLU  79  -3.062   9.560   2.012
  620    HG3  GLU  79           2HG      GLU  79  -2.326   8.360   3.098
  621    H    ALA  80           H        ALA  80  -2.412   8.666  -1.544
  622    HA   ALA  80           HA       ALA  80  -4.928   9.850  -1.063
  623    HB1  ALA  80           3HB      ALA  80  -3.672   9.084  -3.720
  624    HB2  ALA  80           1HB      ALA  80  -5.012  10.231  -3.497
  625    HB3  ALA  80           2HB      ALA  80  -3.403  10.603  -2.832
  626    H    VAL  81           H        VAL  81  -4.123   6.703  -2.453
  627    HA   VAL  81           HA       VAL  81  -6.762   6.056  -3.436
  628    HB   VAL  81           HB       VAL  81  -4.484   4.276  -2.477
  629   HG11  VAL  81          1HG1      VAL  81  -5.675   2.464  -3.666
  630   HG12  VAL  81          2HG1      VAL  81  -6.662   3.113  -2.335
  631   HG13  VAL  81          3HG1      VAL  81  -7.019   3.577  -4.015
  632   HG21  VAL  81          3HG2      VAL  81  -3.900   5.626  -4.401
  633   HG22  VAL  81          1HG2      VAL  81  -4.078   3.918  -4.860
  634   HG23  VAL  81          2HG2      VAL  81  -5.365   5.083  -5.253
  635    H    PHE  82           H        PHE  82  -5.253   5.644  -0.265
  636    HA   PHE  82           HA       PHE  82  -7.605   4.216   0.768
  637    HB2  PHE  82           1HB      PHE  82  -5.154   5.376   2.166
  638    HB3  PHE  82           2HB      PHE  82  -6.400   4.371   2.940
  639    HD1  PHE  82           HD1      PHE  82  -3.226   4.336   1.610
  640    HD2  PHE  82           HD2      PHE  82  -6.868   2.105   1.561
  641    HE1  PHE  82           HE1      PHE  82  -1.968   2.300   0.989
  642    HE2  PHE  82           HE2      PHE  82  -5.613   0.065   0.944
  643    HZ   PHE  82           HZ       PHE  82  -3.163   0.164   0.656
  644    H    GLU  83           H        GLU  83  -7.179   7.337  -0.104
  645    HA   GLU  83           HA       GLU  83  -9.049   8.310   2.018
  646    HB2  GLU  83           1HB      GLU  83  -7.536   9.752  -0.163
  647    HB3  GLU  83           2HB      GLU  83  -8.697  10.514   0.950
  648    HG2  GLU  83           1HG      GLU  83  -7.164   9.871   2.890
  649    HG3  GLU  83           2HG      GLU  83  -6.127   9.151   1.638
  650    H    LEU  84           H        LEU  84  -9.369   6.535  -0.595
  651    HA   LEU  84           HA       LEU  84 -11.322   8.050  -2.132
  652    HB2  LEU  84           1HB      LEU  84 -10.583   5.215  -1.865
  653    HB3  LEU  84           2HB      LEU  84 -11.817   5.660  -3.067
  654    HG   LEU  84           HG       LEU  84  -8.916   6.580  -3.036
  655   HD11  LEU  84          1HD1      LEU  84  -8.731   5.213  -5.132
  656   HD12  LEU  84          2HD1      LEU  84  -9.196   4.206  -3.742
  657   HD13  LEU  84          3HD1      LEU  84 -10.423   4.705  -4.931
  658   HD21  LEU  84          3HD2      LEU  84 -10.388   8.305  -3.895
  659   HD22  LEU  84          1HD2      LEU  84  -9.432   7.607  -5.223
  660   HD23  LEU  84          2HD2      LEU  84 -11.139   7.146  -5.018
  661    H    GLU  85           H        GLU  85 -11.429   6.308   0.819
  662    HA   GLU  85           HA       GLU  85 -13.181   5.548   2.144
  663    HB2  GLU  85           1HB      GLU  85 -14.735   7.572   0.523
  664    HB3  GLU  85           2HB      GLU  85 -15.280   6.796   2.030
  665    HG2  GLU  85           1HG      GLU  85 -13.314   7.932   3.229
  666    HG3  GLU  85           2HG      GLU  85 -12.964   8.642   1.637
  667    H    HIS  86           H        HIS  86 -12.581   3.891   0.081
  668    HA   HIS  86           HA       HIS  86 -14.893   3.234  -1.538
  669    HB2  HIS  86           1HB      HIS  86 -12.476   2.626  -2.081
  670    HB3  HIS  86           2HB      HIS  86 -12.584   1.389  -0.805
  671    HD1  HIS  86           HD1      HIS  86 -14.481  -0.483  -1.194
  672    HD2  HIS  86           HD2      HIS  86 -13.481   1.789  -4.598
  673    HE1  HIS  86           HE1      HIS  86 -15.219  -1.793  -3.120
  674    H    HIS  87           H        HIS  87 -16.456   1.755  -1.333
  675    HA   HIS  87           HA       HIS  87 -17.501   1.129   1.194
  676    HB2  HIS  87           1HB      HIS  87 -18.624   0.888  -1.123
  677    HB3  HIS  87           2HB      HIS  87 -17.833  -0.704  -1.205
  678    HD2  HIS  87           HD2      HIS  87 -21.067   0.897   0.318
  679    HE1  HIS  87           HE1      HIS  87 -20.568  -3.013   1.903
  680    HE2  HIS  87           HE2      HIS  87 -22.154  -0.934   1.628
  681    H    HIS  88           H        HIS  88 -17.300  -0.388   2.686
  682    HA   HIS  88           HA       HIS  88 -14.777  -1.642   2.993
  683    HB2  HIS  88           1HB      HIS  88 -16.188  -1.223   4.936
  684    HB3  HIS  88           2HB      HIS  88 -17.459  -2.290   4.292
  685    HD2  HIS  88           HD2      HIS  88 -17.160  -5.036   4.993
  686    HE1  HIS  88           HE1      HIS  88 -13.350  -4.511   6.797
  687    HE2  HIS  88           HE2      HIS  88 -15.361  -6.140   6.336
  688    H    HIS  89           H        HIS  89 -17.843  -3.003   1.813
  689    HA   HIS  89           HA       HIS  89 -16.577  -5.652   1.497
  690    HB2  HIS  89           1HB      HIS  89 -19.392  -4.637   0.904
  691    HB3  HIS  89           2HB      HIS  89 -18.854  -6.318   0.676
  692    HD2  HIS  89           HD2      HIS  89 -20.220  -4.014   3.553
  693    HE1  HIS  89           HE1      HIS  89 -18.941  -7.720   5.193
  694    HE2  HIS  89           HE2      HIS  89 -20.223  -5.459   5.595
  695    H    HIS  90           H        HIS  90 -17.529  -6.756  -0.670
  696    HA   HIS  90           HA       HIS  90 -17.238  -6.954  -2.964
  697    HB2  HIS  90           1HB      HIS  90 -17.324  -3.905  -3.019
  698    HB3  HIS  90           2HB      HIS  90 -17.646  -5.019  -4.371
  699    HD1  HIS  90           HD1      HIS  90 -19.791  -6.705  -3.849
  700    HD2  HIS  90           HD2      HIS  90 -19.672  -3.067  -1.727
  701    HE1  HIS  90           HE1      HIS  90 -22.087  -6.263  -3.144
  702    H    HIS  91           H        HIS  91 -15.882  -5.191  -4.751
  703    HA   HIS  91           HA       HIS  91 -13.128  -5.058  -3.603
  704    HB2  HIS  91           1HB      HIS  91 -13.881  -6.339  -6.271
  705    HB3  HIS  91           2HB      HIS  91 -12.220  -6.003  -5.722
  706    HD2  HIS  91           HD2      HIS  91 -15.008  -8.766  -5.256
  707    HE1  HIS  91           HE1      HIS  91 -11.645  -9.678  -2.825
  708    HE2  HIS  91           HE2      HIS  91 -13.943 -10.501  -3.803
  Start of MODEL   10
    1    H1   MET   1           1H       MET   1 -14.588   1.278   1.737
    2    H2   MET   1           2H       MET   1 -15.068   1.087   3.145
    3    H3   MET   1           3H       MET   1 -14.886   2.472   2.597
    4    HA   MET   1           HA       MET   1 -12.912   1.031   4.042
    5    HB2  MET   1           1HB      MET   1 -12.654   0.251   1.545
    6    HB3  MET   1           2HB      MET   1 -11.809   1.810   1.380
    7    HG2  MET   1           1HG      MET   1 -10.263   1.144   3.186
    8    HG3  MET   1           2HG      MET   1 -11.094  -0.423   3.306
    9    HE1  MET   1           3HE      MET   1 -11.650  -1.401   0.459
   10    HE2  MET   1           1HE      MET   1 -10.140  -2.239   0.032
   11    HE3  MET   1           2HE      MET   1 -10.805  -2.392   1.675
   12    H    LYS   2           H        LYS   2 -11.490   2.316   5.053
   13    HA   LYS   2           HA       LYS   2 -11.276   5.158   4.264
   14    HB2  LYS   2           1HB      LYS   2 -13.389   5.098   5.456
   15    HB3  LYS   2           2HB      LYS   2 -12.614   4.252   6.818
   16    HG2  LYS   2           1HG      LYS   2 -12.812   6.514   7.501
   17    HG3  LYS   2           2HG      LYS   2 -11.105   6.290   7.050
   18    HD2  LYS   2           1HD      LYS   2 -11.564   7.276   4.837
   19    HD3  LYS   2           2HD      LYS   2 -13.268   7.506   5.296
   20    HE2  LYS   2           1HE      LYS   2 -12.646   9.041   7.053
   21    HE3  LYS   2           2HE      LYS   2 -10.919   8.720   6.777
   22    HZ1  LYS   2           3HZ      LYS   2 -12.753   9.996   4.853
   23    HZ2  LYS   2           1HZ      LYS   2 -11.614  10.777   5.755
   24    HZ3  LYS   2           2HZ      LYS   2 -11.151   9.698   4.596
   25    H    ILE   3           H        ILE   3  -9.354   5.899   4.660
   26    HA   ILE   3           HA       ILE   3  -7.548   4.277   6.398
   27    HB   ILE   3           HB       ILE   3  -6.808   4.921   4.069
   28   HG12  ILE   3          1HG1      ILE   3  -5.174   6.203   6.241
   29   HG13  ILE   3          2HG1      ILE   3  -5.284   4.449   5.961
   30   HG21  ILE   3          1HG2      ILE   3  -6.163   7.275   3.677
   31   HG22  ILE   3          2HG2      ILE   3  -7.912   7.131   3.973
   32   HG23  ILE   3          3HG2      ILE   3  -6.838   7.723   5.262
   33   HD11  ILE   3          3HD1      ILE   3  -4.247   6.505   3.979
   34   HD12  ILE   3          1HD1      ILE   3  -3.250   5.388   4.938
   35   HD13  ILE   3          2HD1      ILE   3  -4.356   4.752   3.700
   36    H    ILE   4           H        ILE   4  -6.336   5.033   8.041
   37    HA   ILE   4           HA       ILE   4  -7.288   7.624   9.226
   38    HB   ILE   4           HB       ILE   4  -5.800   5.266  10.473
   39   HG12  ILE   4          1HG1      ILE   4  -8.577   6.281  11.009
   40   HG13  ILE   4          2HG1      ILE   4  -8.185   4.915   9.941
   41   HG21  ILE   4          1HG2      ILE   4  -6.086   6.494  12.599
   42   HG22  ILE   4          2HG2      ILE   4  -5.110   7.431  11.447
   43   HG23  ILE   4          3HG2      ILE   4  -6.816   7.855  11.716
   44   HD11  ILE   4          3HD1      ILE   4  -7.576   5.079  12.914
   45   HD12  ILE   4          1HD1      ILE   4  -8.883   4.129  12.169
   46   HD13  ILE   4          2HD1      ILE   4  -7.182   3.713  11.844
   47    H    SER   5           H        SER   5  -4.266   5.779   8.781
   48    HA   SER   5           HA       SER   5  -2.802   8.195   7.923
   49    HB2  SER   5           1HB      SER   5  -1.411   8.521   9.697
   50    HB3  SER   5           2HB      SER   5  -3.098   8.706  10.230
   51    HG   SER   5           HG       SER   5  -1.827   7.500  11.705
   52    H    ILE   6           H        ILE   6  -0.534   7.726   7.571
   53    HA   ILE   6           HA       ILE   6   0.131   4.792   7.520
   54    HB   ILE   6           HB       ILE   6   1.015   6.929   5.528
   55   HG12  ILE   6          1HG1      ILE   6  -0.907   4.648   5.140
   56   HG13  ILE   6          2HG1      ILE   6  -1.351   6.361   5.328
   57   HG21  ILE   6          1HG2      ILE   6   1.962   5.008   4.295
   58   HG22  ILE   6          2HG2      ILE   6   2.678   5.142   5.916
   59   HG23  ILE   6          3HG2      ILE   6   1.436   3.913   5.594
   60   HD11  ILE   6          3HD1      ILE   6   0.336   5.197   3.084
   61   HD12  ILE   6          1HD1      ILE   6  -1.367   5.693   2.957
   62   HD13  ILE   6          2HD1      ILE   6  -0.108   6.910   3.273
   63    H    SER   7           H        SER   7   1.792   4.146   8.570
   64    HA   SER   7           HA       SER   7   3.735   6.236   9.607
   65    HB2  SER   7           1HB      SER   7   2.329   5.622  11.321
   66    HB3  SER   7           2HB      SER   7   2.593   3.893  11.000
   67    HG   SER   7           HG       SER   7   4.841   4.310  11.435
   68    H    GLU   8           H        GLU   8   5.821   5.862   9.192
   69    HA   GLU   8           HA       GLU   8   6.721   3.644   7.595
   70    HB2  GLU   8           1HB      GLU   8   8.922   4.469   7.984
   71    HB3  GLU   8           2HB      GLU   8   7.824   5.842   7.695
   72    HG2  GLU   8           1HG      GLU   8   7.777   6.221  10.240
   73    HG3  GLU   8           2HG      GLU   8   8.922   4.862  10.296
   74    H    THR   9           H        THR   9   8.357   2.084   8.159
   75    HA   THR   9           HA       THR   9   7.982   1.059  10.954
   76    HB   THR   9           HB       THR   9   7.850  -1.205  10.123
   77    HG1  THR   9           HG1      THR   9   8.253  -0.019   7.553
   78   HG21  THR   9          3HG2      THR   9   6.023   0.590   8.478
   79   HG22  THR   9          1HG2      THR   9   5.751  -1.132   8.822
   80   HG23  THR   9          2HG2      THR   9   5.725   0.054  10.147
   81    HA   PRO  10           HA       PRO  10  12.284   0.493  11.376
   82    HB2  PRO  10           2HB      PRO  10  12.609  -1.257  12.954
   83    HB3  PRO  10           1HB      PRO  10  11.761  -2.443  11.954
   84    HG2  PRO  10           1HG      PRO  10  10.146  -2.035  13.635
   85    HG3  PRO  10           2HG      PRO  10  10.603  -0.334  13.807
   86    HD2  PRO  10           1HD      PRO  10   8.914  -1.642  11.634
   87    HD3  PRO  10           2HD      PRO  10   8.683  -0.080  12.429
   88    H    ASN  11           H        ASN  11  10.479  -1.667   9.317
   89    HA   ASN  11           HA       ASN  11  12.905  -2.582   7.914
   90    HB2  ASN  11           1HB      ASN  11  10.611  -4.027   8.066
   91    HB3  ASN  11           2HB      ASN  11  10.192  -2.622   7.056
   92   HD21  ASN  11          2HD2      ASN  11  10.293  -5.574   6.564
   93   HD22  ASN  11          1HD2      ASN  11  11.252  -5.749   5.132
   94    H    HIS  12           H        HIS  12  14.014  -1.250   6.725
   95    HA   HIS  12           HA       HIS  12  13.012   1.223   5.710
   96    HB2  HIS  12           1HB      HIS  12  15.459   0.636   6.096
   97    HB3  HIS  12           2HB      HIS  12  15.385  -0.337   4.609
   98    HD2  HIS  12           HD2      HIS  12  13.621   3.233   4.495
   99    HE1  HIS  12           HE1      HIS  12  17.290   3.311   2.353
  100    HE2  HIS  12           HE2      HIS  12  15.071   4.583   2.968
  101    H    ASN  13           H        ASN  13  12.115   1.881   3.890
  102    HA   ASN  13           HA       ASN  13  11.251   1.791   1.720
  103    HB2  ASN  13           1HB      ASN  13  12.483  -1.012   1.243
  104    HB3  ASN  13           2HB      ASN  13  11.693   0.287   0.318
  105   HD21  ASN  13          2HD2      ASN  13  14.599  -1.012   1.359
  106   HD22  ASN  13          1HD2      ASN  13  15.644   0.307   0.950
  107    H    THR  14           H        THR  14  10.255   0.296   4.323
  108    HA   THR  14           HA       THR  14   7.742  -0.526   2.932
  109    HB   THR  14           HB       THR  14   9.021  -2.027   5.256
  110    HG1  THR  14           HG1      THR  14   9.125  -3.722   3.666
  111   HG21  THR  14          3HG2      THR  14   6.452  -2.526   3.699
  112   HG22  THR  14          1HG2      THR  14   7.119  -3.578   4.971
  113   HG23  THR  14          2HG2      THR  14   6.553  -1.940   5.375
  114    H    MET  15           H        MET  15   5.915   0.173   3.782
  115    HA   MET  15           HA       MET  15   6.056   1.522   6.455
  116    HB2  MET  15           1HB      MET  15   4.760   2.557   3.932
  117    HB3  MET  15           2HB      MET  15   4.593   3.273   5.552
  118    HG2  MET  15           1HG      MET  15   7.041   3.678   5.585
  119    HG3  MET  15           2HG      MET  15   7.144   3.044   3.926
  120    HE1  MET  15           3HE      MET  15   6.183   6.011   6.237
  121    HE2  MET  15           1HE      MET  15   5.158   7.026   5.196
  122    HE3  MET  15           2HE      MET  15   4.560   5.449   5.765
  123    H    LYS  16           H        LYS  16   4.077   1.765   7.557
  124    HA   LYS  16           HA       LYS  16   2.195  -0.461   6.865
  125    HB2  LYS  16           1HB      LYS  16   3.385  -0.736   8.966
  126    HB3  LYS  16           2HB      LYS  16   2.830   0.866   9.505
  127    HG2  LYS  16           1HG      LYS  16   0.475   0.027   9.376
  128    HG3  LYS  16           2HG      LYS  16   1.118  -1.588   9.003
  129    HD2  LYS  16           1HD      LYS  16   2.301  -1.643  11.141
  130    HD3  LYS  16           2HD      LYS  16   1.746   0.006  11.510
  131    HE2  LYS  16           1HE      LYS  16  -0.592  -0.779  11.453
  132    HE3  LYS  16           2HE      LYS  16  -0.019  -2.430  11.121
  133    HZ1  LYS  16           3HZ      LYS  16   0.574  -0.866  13.551
  134    HZ2  LYS  16           1HZ      LYS  16  -0.505  -2.109  13.451
  135    HZ3  LYS  16           2HZ      LYS  16   1.106  -2.398  13.245
  136    H    ILE  17           H        ILE  17   0.160  -0.109   6.433
  137    HA   ILE  17           HA       ILE  17  -0.844   2.709   6.716
  138    HB   ILE  17           HB       ILE  17  -1.751   0.478   4.840
  139   HG12  ILE  17          1HG1      ILE  17  -0.306   3.030   4.185
  140   HG13  ILE  17          2HG1      ILE  17   0.469   1.437   4.349
  141   HG21  ILE  17          1HG2      ILE  17  -3.139   2.243   3.809
  142   HG22  ILE  17          2HG2      ILE  17  -3.579   1.998   5.514
  143   HG23  ILE  17          3HG2      ILE  17  -2.588   3.399   5.044
  144   HD11  ILE  17          3HD1      ILE  17  -1.682   2.170   2.332
  145   HD12  ILE  17          1HD1      ILE  17   0.052   1.984   1.985
  146   HD13  ILE  17          2HD1      ILE  17  -0.908   0.576   2.496
  147    H    THR  18           H        THR  18  -2.259   3.170   8.137
  148    HA   THR  18           HA       THR  18  -3.728   0.908   9.426
  149    HB   THR  18           HB       THR  18  -3.260   3.767  10.375
  150    HG1  THR  18           HG1      THR  18  -1.912   2.662  11.918
  151   HG21  THR  18          3HG2      THR  18  -4.540   1.379  11.764
  152   HG22  THR  18          1HG2      THR  18  -4.217   2.965  12.506
  153   HG23  THR  18          2HG2      THR  18  -5.398   2.824  11.181
  154    H    LEU  19           H        LEU  19  -5.733   0.538   8.976
  155    HA   LEU  19           HA       LEU  19  -7.314   2.744   7.707
  156    HB2  LEU  19           1HB      LEU  19  -7.634  -0.185   7.663
  157    HB3  LEU  19           2HB      LEU  19  -8.669   0.880   6.684
  158    HG   LEU  19           HG       LEU  19  -5.683   0.411   6.334
  159   HD11  LEU  19          1HD1      LEU  19  -6.374  -0.572   4.132
  160   HD12  LEU  19          2HD1      LEU  19  -7.114  -1.447   5.493
  161   HD13  LEU  19          3HD1      LEU  19  -8.077  -0.282   4.556
  162   HD21  LEU  19          3HD2      LEU  19  -6.253   2.719   5.859
  163   HD22  LEU  19          1HD2      LEU  19  -5.876   1.864   4.344
  164   HD23  LEU  19          2HD2      LEU  19  -7.570   2.202   4.779
  165    H    SER  20           H        SER  20  -9.142   3.454   8.555
  166    HA   SER  20           HA       SER  20 -10.250   2.449  11.080
  167    HB2  SER  20           1HB      SER  20 -10.415   4.705  10.510
  168    HB3  SER  20           2HB      SER  20 -11.367   4.303   9.063
  169    HG   SER  20           HG       SER  20 -12.673   4.865  10.858
  170    H    GLU  21           H        GLU  21 -11.197   2.256   7.614
  171    HA   GLU  21           HA       GLU  21 -12.504  -0.361   8.269
  172    HB2  GLU  21           1HB      GLU  21 -14.222   1.346   7.898
  173    HB3  GLU  21           2HB      GLU  21 -13.487   1.735   6.324
  174    HG2  GLU  21           1HG      GLU  21 -14.024  -0.668   5.581
  175    HG3  GLU  21           2HG      GLU  21 -14.762  -0.824   7.191
  176    H    SER  22           H        SER  22 -11.576  -1.971   7.316
  177    HA   SER  22           HA       SER  22  -9.922  -1.539   4.839
  178    HB2  SER  22           1HB      SER  22  -9.005  -2.620   6.819
  179    HB3  SER  22           2HB      SER  22 -10.102  -3.979   6.484
  180    HG   SER  22           HG       SER  22  -8.154  -4.351   5.465
  181    H    ARG  23           H        ARG  23 -10.012  -3.992   3.746
  182    HA   ARG  23           HA       ARG  23 -12.342  -4.095   2.148
  183    HB2  ARG  23           1HB      ARG  23 -10.195  -5.174   1.664
  184    HB3  ARG  23           2HB      ARG  23 -10.627  -6.436   2.841
  185    HG2  ARG  23           1HG      ARG  23 -12.687  -6.889   1.481
  186    HG3  ARG  23           2HG      ARG  23 -12.059  -5.759   0.257
  187    HD2  ARG  23           1HD      ARG  23 -11.577  -7.935  -0.460
  188    HD3  ARG  23           2HD      ARG  23 -10.052  -7.203   0.090
  189    HE   ARG  23           HE       ARG  23 -11.329  -9.050   2.065
  190   HH11  ARG  23          1HH1      ARG  23  -8.967  -8.680  -0.473
  191   HH12  ARG  23          2HH1      ARG  23  -8.096 -10.077   0.126
  192   HH21  ARG  23          2HH2      ARG  23  -8.883 -11.207   1.967
  193   HH22  ARG  23          1HH2      ARG  23 -10.348 -10.657   2.758
  194    H    GLU  24           H        GLU  24 -14.235  -5.145   2.167
  195    HA   GLU  24           HA       GLU  24 -15.668  -5.462   4.522
  196    HB2  GLU  24           1HB      GLU  24 -16.592  -5.519   2.230
  197    HB3  GLU  24           2HB      GLU  24 -15.946  -7.167   2.042
  198    HG2  GLU  24           1HG      GLU  24 -17.484  -7.965   3.874
  199    HG3  GLU  24           2HG      GLU  24 -17.935  -6.257   4.081
  200    H    GLY  25           H        GLY  25 -13.889  -8.068   2.838
  201    HA2  GLY  25           1HA      GLY  25 -13.922  -9.593   5.396
  202    HA3  GLY  25           2HA      GLY  25 -13.439 -10.225   3.805
  203    H    MET  26           H        MET  26 -12.292  -9.350   6.759
  204    HA   MET  26           HA       MET  26  -9.831  -7.981   5.785
  205    HB2  MET  26           1HB      MET  26 -10.986  -8.499   8.521
  206    HB3  MET  26           2HB      MET  26  -9.381  -7.784   8.243
  207    HG2  MET  26           1HG      MET  26 -10.382  -5.881   7.114
  208    HG3  MET  26           2HG      MET  26 -11.998  -6.613   7.254
  209    HE1  MET  26           3HE      MET  26 -12.824  -4.251   8.288
  210    HE2  MET  26           1HE      MET  26 -12.081  -3.500   9.721
  211    HE3  MET  26           2HE      MET  26 -11.165  -3.608   8.197
  212    H    THR  27           H        THR  27 -10.077 -10.630   4.964
  213    HA   THR  27           HA       THR  27  -8.314 -12.213   6.730
  214    HB   THR  27           HB       THR  27  -8.487 -13.945   5.002
  215    HG1  THR  27           HG1      THR  27  -9.754 -13.488   3.118
  216   HG21  THR  27          3HG2      THR  27 -11.173 -12.625   5.553
  217   HG22  THR  27          1HG2      THR  27 -10.928 -14.314   5.056
  218   HG23  THR  27          2HG2      THR  27 -10.330 -13.756   6.637
  219    H    SER  28           H        SER  28  -6.407 -13.307   5.774
  220    HA   SER  28           HA       SER  28  -4.491 -11.194   5.031
  221    HB2  SER  28           1HB      SER  28  -3.876 -12.716   6.639
  222    HB3  SER  28           2HB      SER  28  -4.176 -14.088   5.548
  223    HG   SER  28           HG       SER  28  -1.968 -13.482   5.629
  224    H    ASP  29           H        ASP  29  -3.925 -10.649   3.027
  225    HA   ASP  29           HA       ASP  29  -3.783 -12.764   0.941
  226    HB2  ASP  29           1HB      ASP  29  -5.324 -10.126   0.565
  227    HB3  ASP  29           2HB      ASP  29  -4.633 -11.212  -0.665
  228    H    THR  30           H        THR  30  -2.366 -12.355  -0.748
  229    HA   THR  30           HA       THR  30  -0.464 -10.093  -0.216
  230    HB   THR  30           HB       THR  30   0.087 -12.791  -1.526
  231    HG1  THR  30           HG1      THR  30   1.384 -13.069   0.385
  232   HG21  THR  30          3HG2      THR  30   1.936 -10.469  -0.846
  233   HG22  THR  30          1HG2      THR  30   2.441 -12.042  -1.505
  234   HG23  THR  30          2HG2      THR  30   1.429 -10.949  -2.482
  235    H    TYR  31           H        TYR  31  -0.098  -8.640  -1.706
  236    HA   TYR  31           HA       TYR  31  -1.319  -9.108  -4.408
  237    HB2  TYR  31           1HB      TYR  31  -1.299  -6.558  -2.780
  238    HB3  TYR  31           2HB      TYR  31  -1.936  -6.751  -4.432
  239    HD1  TYR  31           HD1      TYR  31  -2.824  -6.659  -1.026
  240    HD2  TYR  31           HD2      TYR  31  -3.759  -8.684  -4.660
  241    HE1  TYR  31           HE1      TYR  31  -5.029  -7.295  -0.094
  242    HE2  TYR  31           HE2      TYR  31  -5.964  -9.327  -3.747
  243    HH   TYR  31           HH       TYR  31  -7.404  -9.164  -1.987
  244    H    THR  32           H        THR  32   0.199  -9.266  -5.849
  245    HA   THR  32           HA       THR  32   2.573  -7.445  -5.599
  246    HB   THR  32           HB       THR  32   3.934  -9.208  -6.641
  247    HG1  THR  32           HG1      THR  32   2.968 -11.312  -6.878
  248   HG21  THR  32          3HG2      THR  32   2.387 -10.221  -4.224
  249   HG22  THR  32          1HG2      THR  32   3.976 -10.809  -4.762
  250   HG23  THR  32          2HG2      THR  32   3.798  -9.139  -4.175
  251    H    LYS  33           H        LYS  33   0.066  -8.758  -7.599
  252    HA   LYS  33           HA       LYS  33   1.059  -7.089  -9.870
  253    HB2  LYS  33           1HB      LYS  33   1.745  -9.445 -10.198
  254    HB3  LYS  33           2HB      LYS  33   0.033  -9.921 -10.099
  255    HG2  LYS  33           1HG      LYS  33  -0.477  -8.632 -12.104
  256    HG3  LYS  33           2HG      LYS  33   1.202  -8.046 -12.182
  257    HD2  LYS  33           1HD      LYS  33   2.005 -10.337 -12.518
  258    HD3  LYS  33           2HD      LYS  33   0.340 -10.952 -12.390
  259    HE2  LYS  33           1HE      LYS  33  -0.304  -9.690 -14.380
  260    HE3  LYS  33           2HE      LYS  33   1.332  -9.001 -14.493
  261    HZ1  LYS  33           3HZ      LYS  33   0.653 -11.862 -14.746
  262    HZ2  LYS  33           1HZ      LYS  33   1.039 -10.854 -15.993
  263    HZ3  LYS  33           2HZ      LYS  33   2.170 -11.226 -14.850
  264    H    VAL  34           H        VAL  34  -0.397  -5.875 -10.794
  265    HA   VAL  34           HA       VAL  34  -2.964  -5.451  -9.663
  266    HB   VAL  34           HB       VAL  34  -1.979  -4.907 -12.494
  267   HG11  VAL  34          1HG1      VAL  34  -3.870  -3.322 -12.627
  268   HG12  VAL  34          2HG1      VAL  34  -4.447  -4.989 -12.395
  269   HG13  VAL  34          3HG1      VAL  34  -4.429  -3.854 -11.024
  270   HG21  VAL  34          3HG2      VAL  34  -0.686  -3.764 -10.794
  271   HG22  VAL  34          1HG2      VAL  34  -1.696  -2.614 -11.702
  272   HG23  VAL  34          2HG2      VAL  34  -2.178  -3.121 -10.065
  273    H    ASP  35           H        ASP  35  -4.891  -6.245  -9.790
  274    HA   ASP  35           HA       ASP  35  -5.702  -8.044 -11.948
  275    HB2  ASP  35           1HB      ASP  35  -4.211  -9.485 -10.277
  276    HB3  ASP  35           2HB      ASP  35  -5.589  -9.107  -9.213
  277    H    ASP  36           H        ASP  36  -7.870  -8.560 -11.947
  278    HA   ASP  36           HA       ASP  36  -9.497  -6.448 -10.853
  279    HB2  ASP  36           1HB      ASP  36 -10.279  -9.083 -12.241
  280    HB3  ASP  36           2HB      ASP  36 -11.332  -7.800 -11.593
  281    H    SER  37           H        SER  37  -8.689  -9.661  -9.741
  282    HA   SER  37           HA       SER  37 -10.873 -10.019  -7.847
  283    HB2  SER  37           1HB      SER  37  -9.640 -11.747  -6.954
  284    HB3  SER  37           2HB      SER  37  -9.637 -11.818  -8.730
  285    HG   SER  37           HG       SER  37  -7.540 -11.083  -8.729
  286    H    GLN  38           H        GLN  38  -8.083  -7.978  -7.906
  287    HA   GLN  38           HA       GLN  38  -7.855  -7.879  -4.950
  288    HB2  GLN  38           1HB      GLN  38  -6.393  -6.245  -7.027
  289    HB3  GLN  38           2HB      GLN  38  -5.960  -6.479  -5.318
  290    HG2  GLN  38           1HG      GLN  38  -5.399  -9.033  -5.956
  291    HG3  GLN  38           2HG      GLN  38  -6.086  -8.403  -7.470
  292   HE21  GLN  38          2HE2      GLN  38  -3.462  -9.647  -6.920
  293   HE22  GLN  38          1HE2      GLN  38  -2.276  -8.490  -7.425
  294    HA   PRO  39           HA       PRO  39 -10.229  -4.211  -4.175
  295    HB2  PRO  39           2HB      PRO  39  -9.320  -3.294  -2.171
  296    HB3  PRO  39           1HB      PRO  39  -7.674  -3.258  -2.819
  297    HG2  PRO  39           1HG      PRO  39  -7.546  -5.112  -1.349
  298    HG3  PRO  39           2HG      PRO  39  -9.216  -5.606  -1.662
  299    HD2  PRO  39           1HD      PRO  39  -6.751  -6.029  -3.397
  300    HD3  PRO  39           2HD      PRO  39  -8.101  -7.131  -3.098
  301    H    ALA  40           H        ALA  40 -10.642  -2.586  -5.392
  302    HA   ALA  40           HA       ALA  40  -9.065  -1.781  -7.565
  303    HB1  ALA  40           3HB      ALA  40 -11.073  -0.127  -5.997
  304    HB2  ALA  40           1HB      ALA  40 -10.476   0.238  -7.632
  305    HB3  ALA  40           2HB      ALA  40 -11.445  -1.226  -7.345
  306    H    PHE  41           H        PHE  41  -9.189  -0.384  -4.290
  307    HA   PHE  41           HA       PHE  41  -7.261   1.665  -4.639
  308    HB2  PHE  41           1HB      PHE  41  -7.963  -0.103  -2.268
  309    HB3  PHE  41           2HB      PHE  41  -6.742   1.186  -2.170
  310    HD1  PHE  41           HD1      PHE  41  -8.876   2.504  -4.434
  311    HD2  PHE  41           HD2      PHE  41  -8.783   1.404  -0.307
  312    HE1  PHE  41           HE1      PHE  41 -10.653   4.156  -3.956
  313    HE2  PHE  41           HE2      PHE  41 -10.563   3.051   0.173
  314    HZ   PHE  41           HZ       PHE  41 -11.496   4.428  -1.652
  315    H    ILE  42           H        ILE  42  -6.739  -1.756  -3.758
  316    HA   ILE  42           HA       ILE  42  -3.880  -1.591  -3.610
  317    HB   ILE  42           HB       ILE  42  -5.752  -3.896  -4.301
  318   HG12  ILE  42          1HG1      ILE  42  -5.938  -3.010  -2.058
  319   HG13  ILE  42          2HG1      ILE  42  -5.310  -4.673  -2.099
  320   HG21  ILE  42          1HG2      ILE  42  -3.800  -5.373  -3.960
  321   HG22  ILE  42          2HG2      ILE  42  -3.536  -4.272  -5.332
  322   HG23  ILE  42          3HG2      ILE  42  -2.754  -3.947  -3.769
  323   HD11  ILE  42          3HD1      ILE  42  -3.655  -2.157  -1.690
  324   HD12  ILE  42          1HD1      ILE  42  -4.122  -3.315  -0.421
  325   HD13  ILE  42          2HD1      ILE  42  -3.027  -3.821  -1.731
  326    H    ASN  43           H        ASN  43  -6.019  -2.127  -6.367
  327    HA   ASN  43           HA       ASN  43  -3.910  -2.737  -8.231
  328    HB2  ASN  43           1HB      ASN  43  -6.755  -1.644  -8.868
  329    HB3  ASN  43           2HB      ASN  43  -5.303  -2.012  -9.831
  330   HD21  ASN  43          2HD2      ASN  43  -8.088  -3.186  -9.580
  331   HD22  ASN  43          1HD2      ASN  43  -7.813  -4.887  -9.406
  332    H    ASP  44           H        ASP  44  -5.605   0.328  -7.521
  333    HA   ASP  44           HA       ASP  44  -4.049   1.980  -9.233
  334    HB2  ASP  44           1HB      ASP  44  -5.403   2.652  -6.552
  335    HB3  ASP  44           2HB      ASP  44  -4.516   3.723  -7.666
  336    H    ILE  45           H        ILE  45  -3.469   1.016  -5.854
  337    HA   ILE  45           HA       ILE  45  -1.070   2.585  -5.533
  338    HB   ILE  45           HB       ILE  45  -2.025   0.034  -4.159
  339   HG12  ILE  45          1HG1      ILE  45  -1.948   2.849  -3.118
  340   HG13  ILE  45          2HG1      ILE  45  -3.360   2.126  -3.923
  341   HG21  ILE  45          1HG2      ILE  45  -0.310   0.530  -2.450
  342   HG22  ILE  45          2HG2      ILE  45   0.437   0.228  -4.036
  343   HG23  ILE  45          3HG2      ILE  45   0.275   1.894  -3.432
  344   HD11  ILE  45          3HD1      ILE  45  -2.048   1.107  -1.379
  345   HD12  ILE  45          1HD1      ILE  45  -3.577   2.011  -1.471
  346   HD13  ILE  45          2HD1      ILE  45  -3.461   0.384  -2.183
  347    H    LEU  46           H        LEU  46  -1.538  -0.790  -6.535
  348    HA   LEU  46           HA       LEU  46   1.223  -1.375  -6.936
  349    HB2  LEU  46           1HB      LEU  46  -1.292  -2.227  -8.184
  350    HB3  LEU  46           2HB      LEU  46   0.203  -3.025  -8.724
  351    HG   LEU  46           HG       LEU  46  -0.887  -3.027  -5.882
  352   HD11  LEU  46          1HD1      LEU  46  -1.325  -5.461  -6.308
  353   HD12  LEU  46          2HD1      LEU  46  -2.246  -4.433  -7.431
  354   HD13  LEU  46          3HD1      LEU  46  -0.765  -5.253  -7.984
  355   HD21  LEU  46          3HD2      LEU  46   1.534  -3.112  -5.944
  356   HD22  LEU  46          1HD2      LEU  46   0.885  -4.691  -5.443
  357   HD23  LEU  46          2HD2      LEU  46   1.488  -4.461  -7.102
  358    H    LYS  47           H        LYS  47  -1.113   0.312  -8.967
  359    HA   LYS  47           HA       LYS  47   0.613   0.320 -11.314
  360    HB2  LYS  47           1HB      LYS  47  -1.843   1.879 -10.519
  361    HB3  LYS  47           2HB      LYS  47  -0.989   2.117 -12.062
  362    HG2  LYS  47           1HG      LYS  47  -1.444  -0.184 -12.712
  363    HG3  LYS  47           2HG      LYS  47  -2.208  -0.504 -11.137
  364    HD2  LYS  47           1HD      LYS  47  -3.940   1.174 -11.635
  365    HD3  LYS  47           2HD      LYS  47  -3.178   1.491 -13.211
  366    HE2  LYS  47           1HE      LYS  47  -3.558  -0.861 -13.853
  367    HE3  LYS  47           2HE      LYS  47  -4.357  -1.148 -12.289
  368    HZ1  LYS  47           3HZ      LYS  47  -5.273   0.739 -14.364
  369    HZ2  LYS  47           1HZ      LYS  47  -5.949  -0.732 -14.039
  370    HZ3  LYS  47           2HZ      LYS  47  -6.015   0.473 -12.915
  371    H    VAL  48           H        VAL  48   0.348   2.270  -8.459
  372    HA   VAL  48           HA       VAL  48   1.785   4.597  -9.392
  373    HB   VAL  48           HB       VAL  48   1.698   3.277  -6.647
  374   HG11  VAL  48          1HG1      VAL  48   2.530   5.454  -5.819
  375   HG12  VAL  48          2HG1      VAL  48   3.699   4.701  -6.929
  376   HG13  VAL  48          3HG1      VAL  48   2.668   6.037  -7.493
  377   HG21  VAL  48          3HG2      VAL  48  -0.485   4.008  -7.404
  378   HG22  VAL  48          1HG2      VAL  48   0.114   5.052  -6.093
  379   HG23  VAL  48          2HG2      VAL  48   0.165   5.623  -7.778
  380    H    GLU  49           H        GLU  49   3.661   4.811 -10.210
  381    HA   GLU  49           HA       GLU  49   5.539   2.672 -10.427
  382    HB2  GLU  49           1HB      GLU  49   5.401   4.638 -11.920
  383    HB3  GLU  49           2HB      GLU  49   6.037   5.648 -10.599
  384    HG2  GLU  49           1HG      GLU  49   8.188   4.293 -10.656
  385    HG3  GLU  49           2HG      GLU  49   7.392   3.339 -11.929
  386    H    GLY  50           H        GLY  50   6.866   1.785  -9.073
  387    HA2  GLY  50           1HA      GLY  50   8.891   2.273  -7.699
  388    HA3  GLY  50           2HA      GLY  50   7.906   3.472  -6.825
  389    H    VAL  51           H        VAL  51   5.520   1.698  -6.916
  390    HA   VAL  51           HA       VAL  51   5.973   0.283  -4.407
  391    HB   VAL  51           HB       VAL  51   3.663   0.163  -6.390
  392   HG11  VAL  51          1HG1      VAL  51   2.404  -0.836  -4.513
  393   HG12  VAL  51          2HG1      VAL  51   3.790  -1.854  -4.969
  394   HG13  VAL  51          3HG1      VAL  51   3.879  -0.825  -3.517
  395   HG21  VAL  51          3HG2      VAL  51   3.965   2.381  -5.461
  396   HG22  VAL  51          1HG2      VAL  51   2.505   1.610  -4.798
  397   HG23  VAL  51          2HG2      VAL  51   3.984   1.709  -3.814
  398    H    LYS  52           H        LYS  52   6.627  -1.631  -3.956
  399    HA   LYS  52           HA       LYS  52   7.380  -3.358  -6.264
  400    HB2  LYS  52           1HB      LYS  52   9.108  -2.718  -4.650
  401    HB3  LYS  52           2HB      LYS  52   8.153  -3.459  -3.345
  402    HG2  LYS  52           1HG      LYS  52   8.397  -5.663  -4.409
  403    HG3  LYS  52           2HG      LYS  52   9.339  -4.925  -5.727
  404    HD2  LYS  52           1HD      LYS  52  11.045  -4.205  -4.100
  405    HD3  LYS  52           2HD      LYS  52  10.105  -4.954  -2.786
  406    HE2  LYS  52           1HE      LYS  52  10.362  -7.150  -3.831
  407    HE3  LYS  52           2HE      LYS  52  11.252  -6.417  -5.186
  408    HZ1  LYS  52           3HZ      LYS  52  12.127  -6.434  -2.369
  409    HZ2  LYS  52           1HZ      LYS  52  12.736  -7.390  -3.568
  410    HZ3  LYS  52           2HZ      LYS  52  12.953  -5.755  -3.624
  411    H    SER  53           H        SER  53   6.018  -3.813  -2.983
  412    HA   SER  53           HA       SER  53   4.120  -5.878  -4.059
  413    HB2  SER  53           1HB      SER  53   4.791  -7.586  -2.713
  414    HB3  SER  53           2HB      SER  53   6.163  -7.060  -3.716
  415    HG   SER  53           HG       SER  53   6.813  -5.819  -1.812
  416    H    ILE  54           H        ILE  54   2.412  -6.291  -2.665
  417    HA   ILE  54           HA       ILE  54   2.274  -4.620  -0.169
  418    HB   ILE  54           HB       ILE  54   0.028  -5.107  -2.180
  419   HG12  ILE  54          1HG1      ILE  54   1.397  -2.519  -1.504
  420   HG13  ILE  54          2HG1      ILE  54   1.801  -3.532  -2.910
  421   HG21  ILE  54          1HG2      ILE  54  -1.248  -3.554  -0.742
  422   HG22  ILE  54          2HG2      ILE  54  -0.735  -4.994   0.168
  423   HG23  ILE  54          3HG2      ILE  54   0.132  -3.454   0.376
  424   HD11  ILE  54          3HD1      ILE  54  -0.901  -2.257  -2.355
  425   HD12  ILE  54          1HD1      ILE  54   0.292  -1.690  -3.545
  426   HD13  ILE  54          2HD1      ILE  54  -0.496  -3.272  -3.760
  427    H    PHE  55           H        PHE  55   1.523  -5.479   1.600
  428    HA   PHE  55           HA       PHE  55   0.208  -8.167   1.369
  429    HB2  PHE  55           1HB      PHE  55   2.495  -8.427   2.286
  430    HB3  PHE  55           2HB      PHE  55   2.125  -7.231   3.548
  431    HD1  PHE  55           HD1      PHE  55   0.718 -10.407   2.166
  432    HD2  PHE  55           HD2      PHE  55   1.568  -8.012   5.599
  433    HE1  PHE  55           HE1      PHE  55  -0.116 -12.216   3.631
  434    HE2  PHE  55           HE2      PHE  55   0.738  -9.820   7.068
  435    HZ   PHE  55           HZ       PHE  55  -0.106 -11.921   6.082
  436    H    HIS  56           H        HIS  56  -1.755  -8.263   2.088
  437    HA   HIS  56           HA       HIS  56  -2.660  -6.104   3.965
  438    HB2  HIS  56           1HB      HIS  56  -3.669  -5.854   1.718
  439    HB3  HIS  56           2HB      HIS  56  -4.250  -7.535   1.788
  440    HD1  HIS  56           HD1      HIS  56  -6.608  -6.343   1.372
  441    HD2  HIS  56           HD2      HIS  56  -4.931  -5.742   5.191
  442    HE1  HIS  56           HE1      HIS  56  -8.415  -5.484   2.773
  443    H    VAL  57           H        VAL  57  -2.893  -6.827   5.920
  444    HA   VAL  57           HA       VAL  57  -4.420  -9.386   6.317
  445    HB   VAL  57           HB       VAL  57  -2.013  -9.892   6.689
  446   HG11  VAL  57          1HG1      VAL  57  -0.826  -8.783   8.554
  447   HG12  VAL  57          2HG1      VAL  57  -1.266  -7.612   7.289
  448   HG13  VAL  57          3HG1      VAL  57  -2.215  -7.697   8.792
  449   HG21  VAL  57          3HG2      VAL  57  -3.698 -11.049   7.990
  450   HG22  VAL  57          1HG2      VAL  57  -2.232 -10.770   8.958
  451   HG23  VAL  57          2HG2      VAL  57  -3.671  -9.755   9.211
  452    H    MET  58           H        MET  58  -5.931  -9.392   7.773
  453    HA   MET  58           HA       MET  58  -7.533  -8.452   9.176
  454    HB2  MET  58           1HB      MET  58  -5.040  -7.157  10.272
  455    HB3  MET  58           2HB      MET  58  -6.646  -7.046  11.029
  456    HG2  MET  58           1HG      MET  58  -6.690  -9.412  11.441
  457    HG3  MET  58           2HG      MET  58  -5.206  -9.656  10.491
  458    HE1  MET  58           3HE      MET  58  -6.780  -8.479  13.859
  459    HE2  MET  58           1HE      MET  58  -5.421  -7.658  14.665
  460    HE3  MET  58           2HE      MET  58  -6.170  -6.934  13.220
  461    H    ASP  59           H        ASP  59  -6.328  -5.564  10.161
  462    HA   ASP  59           HA       ASP  59  -8.033  -4.173   8.117
  463    HB2  ASP  59           1HB      ASP  59  -8.864  -2.718   9.941
  464    HB3  ASP  59           2HB      ASP  59  -9.021  -4.466  10.242
  465    H    PHE  60           H        PHE  60  -5.094  -4.609   8.160
  466    HA   PHE  60           HA       PHE  60  -4.432  -1.774   7.608
  467    HB2  PHE  60           1HB      PHE  60  -2.340  -1.855   8.883
  468    HB3  PHE  60           2HB      PHE  60  -3.709  -2.158   9.976
  469    HD1  PHE  60           HD1      PHE  60  -0.725  -3.539   8.415
  470    HD2  PHE  60           HD2      PHE  60  -4.101  -4.361  10.902
  471    HE1  PHE  60           HE1      PHE  60   0.359  -5.620   9.196
  472    HE2  PHE  60           HE2      PHE  60  -3.018  -6.441  11.686
  473    HZ   PHE  60           HZ       PHE  60  -0.788  -7.071  10.830
  474    H    ILE  61           H        ILE  61  -2.546  -1.483   6.327
  475    HA   ILE  61           HA       ILE  61  -1.884  -3.927   4.707
  476    HB   ILE  61           HB       ILE  61  -2.598  -1.140   3.683
  477   HG12  ILE  61          1HG1      ILE  61  -3.959  -3.781   3.218
  478   HG13  ILE  61          2HG1      ILE  61  -4.494  -2.535   4.370
  479   HG21  ILE  61          1HG2      ILE  61  -2.225  -2.110   1.440
  480   HG22  ILE  61          2HG2      ILE  61  -0.738  -2.162   2.415
  481   HG23  ILE  61          3HG2      ILE  61  -1.703  -3.638   2.188
  482   HD11  ILE  61          3HD1      ILE  61  -4.273  -2.194   1.359
  483   HD12  ILE  61          1HD1      ILE  61  -5.781  -2.418   2.274
  484   HD13  ILE  61          2HD1      ILE  61  -4.807  -0.948   2.510
  485    H    SER  62           H        SER  62   0.116  -4.326   4.364
  486    HA   SER  62           HA       SER  62   2.185  -2.257   5.078
  487    HB2  SER  62           1HB      SER  62   2.386  -4.260   6.214
  488    HB3  SER  62           2HB      SER  62   2.378  -5.183   4.694
  489    HG   SER  62           HG       SER  62   4.490  -4.786   5.480
  490    H    VAL  63           H        VAL  63   2.981  -1.073   3.461
  491    HA   VAL  63           HA       VAL  63   3.191  -2.315   0.719
  492    HB   VAL  63           HB       VAL  63   2.753   0.610   1.450
  493   HG11  VAL  63          1HG1      VAL  63   2.555   0.921  -0.994
  494   HG12  VAL  63          2HG1      VAL  63   4.159   0.286  -0.557
  495   HG13  VAL  63          3HG1      VAL  63   2.927  -0.800  -1.244
  496   HG21  VAL  63          3HG2      VAL  63   0.736  -0.684   1.799
  497   HG22  VAL  63          1HG2      VAL  63   0.578   0.360   0.367
  498   HG23  VAL  63          2HG2      VAL  63   0.879  -1.382   0.167
  499    H    ASP  64           H        ASP  64   5.063  -2.544  -0.129
  500    HA   ASP  64           HA       ASP  64   7.311  -0.874   0.943
  501    HB2  ASP  64           1HB      ASP  64   8.789  -2.858   0.902
  502    HB3  ASP  64           2HB      ASP  64   7.291  -3.060   1.843
  503    H    LYS  65           H        LYS  65   8.989  -0.377  -0.452
  504    HA   LYS  65           HA       LYS  65   8.017  -0.343  -3.292
  505    HB2  LYS  65           1HB      LYS  65   9.073   1.773  -3.532
  506    HB3  LYS  65           2HB      LYS  65   8.002   1.821  -2.110
  507    HG2  LYS  65           1HG      LYS  65   9.915   1.612  -0.617
  508    HG3  LYS  65           2HG      LYS  65  11.013   1.448  -2.006
  509    HD2  LYS  65           1HD      LYS  65  10.546   3.703  -2.725
  510    HD3  LYS  65           2HD      LYS  65   9.265   3.876  -1.501
  511    HE2  LYS  65           1HE      LYS  65  11.173   5.020  -0.655
  512    HE3  LYS  65           2HE      LYS  65  11.031   3.501   0.259
  513    HZ1  LYS  65           3HZ      LYS  65  12.862   3.974  -2.006
  514    HZ2  LYS  65           1HZ      LYS  65  13.298   3.926  -0.415
  515    HZ3  LYS  65           2HZ      LYS  65  12.731   2.566  -1.158
  516    H    GLU  66           H        GLU  66   9.913   0.292  -4.815
  517    HA   GLU  66           HA       GLU  66  12.028  -1.738  -4.477
  518    HB2  GLU  66           1HB      GLU  66  11.499   0.317  -6.627
  519    HB3  GLU  66           2HB      GLU  66  12.789  -0.908  -6.670
  520    HG2  GLU  66           1HG      GLU  66  10.951  -2.710  -6.620
  521    HG3  GLU  66           2HG      GLU  66   9.832  -1.328  -6.654
  522    H    ASN  67           H        ASN  67  14.293  -1.185  -4.883
  523    HA   ASN  67           HA       ASN  67  15.145   0.636  -2.820
  524    HB2  ASN  67           1HB      ASN  67  16.935  -0.768  -4.944
  525    HB3  ASN  67           2HB      ASN  67  17.206   0.383  -3.614
  526   HD21  ASN  67          2HD2      ASN  67  18.089  -2.416  -4.068
  527   HD22  ASN  67          1HD2      ASN  67  17.598  -3.280  -2.648
  528    H    ASP  68           H        ASP  68  14.996   0.895  -6.349
  529    HA   ASP  68           HA       ASP  68  16.385   3.440  -6.454
  530    HB2  ASP  68           1HB      ASP  68  14.526   2.062  -8.485
  531    HB3  ASP  68           2HB      ASP  68  15.352   3.637  -8.601
  532    H    ALA  69           H        ALA  69  12.980   2.495  -6.214
  533    HA   ALA  69           HA       ALA  69  11.936   5.123  -6.691
  534    HB1  ALA  69           3HB      ALA  69  10.728   2.792  -5.164
  535    HB2  ALA  69           1HB      ALA  69   9.849   4.229  -5.731
  536    HB3  ALA  69           2HB      ALA  69  10.562   3.101  -6.908
  537    H    ASN  70           H        ASN  70  10.825   6.506  -5.179
  538    HA   ASN  70           HA       ASN  70  11.870   6.311  -2.374
  539    HB2  ASN  70           1HB      ASN  70  11.624   9.045  -3.834
  540    HB3  ASN  70           2HB      ASN  70  11.934   8.451  -2.185
  541   HD21  ASN  70          2HD2      ASN  70  13.205   8.957  -5.351
  542   HD22  ASN  70          1HD2      ASN  70  14.849   8.538  -5.002
  543    H    TRP  71           H        TRP  71  10.568   7.101  -0.735
  544    HA   TRP  71           HA       TRP  71   7.719   6.758  -1.176
  545    HB2  TRP  71           1HB      TRP  71   9.395   7.675   1.189
  546    HB3  TRP  71           2HB      TRP  71   7.617   7.635   1.237
  547    HD1  TRP  71           HD1      TRP  71  10.363   5.756   2.198
  548    HE1  TRP  71           HE1      TRP  71   9.787   3.135   2.521
  549    HE3  TRP  71           HE3      TRP  71   5.943   5.663  -0.310
  550    HZ2  TRP  71           HZ2      TRP  71   7.720   1.468   1.757
  551    HZ3  TRP  71           HZ3      TRP  71   4.702   3.597  -0.507
  552    HH2  TRP  71           HH2      TRP  71   5.519   1.505   0.488
  553    H    GLU  72           H        GLU  72   9.877   9.448  -1.372
  554    HA   GLU  72           HA       GLU  72   8.082  11.600  -0.895
  555    HB2  GLU  72           1HB      GLU  72  10.390  11.295  -2.819
  556    HB3  GLU  72           2HB      GLU  72   9.518  12.824  -2.549
  557    HG2  GLU  72           1HG      GLU  72  10.259  12.793  -0.131
  558    HG3  GLU  72           2HG      GLU  72  10.981  11.211  -0.501
  559    H    THR  73           H        THR  73   8.561   9.615  -3.791
  560    HA   THR  73           HA       THR  73   6.402  11.069  -5.198
  561    HB   THR  73           HB       THR  73   7.982   8.583  -5.979
  562    HG1  THR  73           HG1      THR  73   9.003  10.108  -7.409
  563   HG21  THR  73          3HG2      THR  73   6.089  10.341  -7.589
  564   HG22  THR  73          1HG2      THR  73   7.049   8.986  -8.230
  565   HG23  THR  73          2HG2      THR  73   5.755   8.680  -7.046
  566    H    VAL  74           H        VAL  74   6.937   7.846  -3.764
  567    HA   VAL  74           HA       VAL  74   4.446   6.793  -4.860
  568    HB   VAL  74           HB       VAL  74   6.313   5.762  -2.686
  569   HG11  VAL  74          1HG1      VAL  74   5.111   3.619  -2.958
  570   HG12  VAL  74          2HG1      VAL  74   4.015   4.899  -2.389
  571   HG13  VAL  74          3HG1      VAL  74   3.984   4.396  -4.095
  572   HG21  VAL  74          3HG2      VAL  74   7.352   5.857  -4.873
  573   HG22  VAL  74          1HG2      VAL  74   7.038   4.172  -4.394
  574   HG23  VAL  74          2HG2      VAL  74   5.980   4.969  -5.582
  575    H    LEU  75           H        LEU  75   5.371   8.018  -1.643
  576    HA   LEU  75           HA       LEU  75   3.157   6.713  -0.365
  577    HB2  LEU  75           1HB      LEU  75   5.072   7.246   0.750
  578    HB3  LEU  75           2HB      LEU  75   4.978   9.010   0.530
  579    HG   LEU  75           HG       LEU  75   2.829   8.963   1.857
  580   HD11  LEU  75          1HD1      LEU  75   2.452   6.956   3.315
  581   HD12  LEU  75          2HD1      LEU  75   2.345   6.531   1.591
  582   HD13  LEU  75          3HD1      LEU  75   3.814   6.138   2.515
  583   HD21  LEU  75          3HD2      LEU  75   4.914   9.705   2.847
  584   HD22  LEU  75          1HD2      LEU  75   3.958   8.805   4.049
  585   HD23  LEU  75          2HD2      LEU  75   5.349   8.028   3.258
  586    HA   PRO  76           HA       PRO  76   1.152  11.217  -0.507
  587    HB2  PRO  76           2HB      PRO  76   1.866  12.932  -2.019
  588    HB3  PRO  76           1HB      PRO  76   2.286  11.777  -3.291
  589    HG2  PRO  76           1HG      PRO  76   4.424  12.367  -2.434
  590    HG3  PRO  76           2HG      PRO  76   3.836  12.478  -0.770
  591    HD2  PRO  76           1HD      PRO  76   4.472   9.991  -2.399
  592    HD3  PRO  76           2HD      PRO  76   4.760  10.296  -0.682
  593    H    LYS  77           H        LYS  77   1.798   9.289  -3.433
  594    HA   LYS  77           HA       LYS  77  -0.918   9.580  -4.414
  595    HB2  LYS  77           1HB      LYS  77   1.305   7.638  -5.048
  596    HB3  LYS  77           2HB      LYS  77  -0.267   7.663  -5.882
  597    HG2  LYS  77           1HG      LYS  77   0.170   9.941  -6.673
  598    HG3  LYS  77           2HG      LYS  77   1.723   9.956  -5.806
  599    HD2  LYS  77           1HD      LYS  77   2.509   8.072  -7.188
  600    HD3  LYS  77           2HD      LYS  77   0.958   8.067  -8.059
  601    HE2  LYS  77           1HE      LYS  77   1.381  10.361  -8.831
  602    HE3  LYS  77           2HE      LYS  77   2.931  10.370  -7.960
  603    HZ1  LYS  77           3HZ      LYS  77   2.226   8.565 -10.183
  604    HZ2  LYS  77           1HZ      LYS  77   3.226   9.872 -10.290
  605    HZ3  LYS  77           2HZ      LYS  77   3.664   8.572  -9.374
  606    H    VAL  78           H        VAL  78   0.794   7.039  -2.607
  607    HA   VAL  78           HA       VAL  78  -1.311   5.099  -2.615
  608    HB   VAL  78           HB       VAL  78   0.822   5.696  -0.524
  609   HG11  VAL  78          1HG1      VAL  78   0.336   3.424   0.323
  610   HG12  VAL  78          2HG1      VAL  78  -1.092   4.479   0.459
  611   HG13  VAL  78          3HG1      VAL  78  -0.997   3.274  -0.847
  612   HG21  VAL  78          3HG2      VAL  78   1.739   5.072  -2.679
  613   HG22  VAL  78          1HG2      VAL  78   1.971   3.768  -1.491
  614   HG23  VAL  78          2HG2      VAL  78   0.696   3.630  -2.726
  615    H    GLU  79           H        GLU  79  -0.620   7.625  -0.192
  616    HA   GLU  79           HA       GLU  79  -2.877   7.083   1.453
  617    HB2  GLU  79           1HB      GLU  79  -0.991   8.562   2.036
  618    HB3  GLU  79           2HB      GLU  79  -1.581   9.745   0.844
  619    HG2  GLU  79           1HG      GLU  79  -3.704  10.010   2.210
  620    HG3  GLU  79           2HG      GLU  79  -3.019   8.757   3.270
  621    H    ALA  80           H        ALA  80  -2.579   9.153  -1.420
  622    HA   ALA  80           HA       ALA  80  -5.176  10.281  -1.309
  623    HB1  ALA  80           3HB      ALA  80  -3.504   9.569  -3.743
  624    HB2  ALA  80           1HB      ALA  80  -4.902  10.668  -3.727
  625    HB3  ALA  80           2HB      ALA  80  -3.427  11.091  -2.826
  626    H    VAL  81           H        VAL  81  -4.067   7.157  -2.526
  627    HA   VAL  81           HA       VAL  81  -6.353   6.431  -4.070
  628    HB   VAL  81           HB       VAL  81  -4.449   4.731  -2.411
  629   HG11  VAL  81          1HG1      VAL  81  -5.334   2.813  -3.694
  630   HG12  VAL  81          2HG1      VAL  81  -6.610   3.570  -2.711
  631   HG13  VAL  81          3HG1      VAL  81  -6.532   3.879  -4.463
  632   HG21  VAL  81          3HG2      VAL  81  -3.386   5.911  -4.241
  633   HG22  VAL  81          1HG2      VAL  81  -3.470   4.166  -4.576
  634   HG23  VAL  81          2HG2      VAL  81  -4.602   5.282  -5.377
  635    H    PHE  82           H        PHE  82  -5.789   6.058  -0.585
  636    HA   PHE  82           HA       PHE  82  -8.282   4.594  -0.212
  637    HB2  PHE  82           1HB      PHE  82  -6.412   5.953   1.777
  638    HB3  PHE  82           2HB      PHE  82  -7.783   4.907   2.212
  639    HD1  PHE  82           HD1      PHE  82  -4.362   5.060   1.022
  640    HD2  PHE  82           HD2      PHE  82  -7.725   2.517   1.710
  641    HE1  PHE  82           HE1      PHE  82  -2.886   3.080   0.898
  642    HE2  PHE  82           HE2      PHE  82  -6.252   0.534   1.587
  643    HZ   PHE  82           HZ       PHE  82  -3.833   0.818   1.180
  644    H    GLU  83           H        GLU  83  -7.536   7.874  -0.659
  645    HA   GLU  83           HA       GLU  83  -9.968   8.788   0.794
  646    HB2  GLU  83           1HB      GLU  83  -7.808  10.261  -0.721
  647    HB3  GLU  83           2HB      GLU  83  -9.215  11.030   0.052
  648    HG2  GLU  83           1HG      GLU  83  -8.368  10.147   2.303
  649    HG3  GLU  83           2HG      GLU  83  -7.026   9.468   1.356
  650    H    LEU  84           H        LEU  84  -9.481   7.287  -2.011
  651    HA   LEU  84           HA       LEU  84 -11.049   8.989  -3.793
  652    HB2  LEU  84           1HB      LEU  84 -10.295   6.143  -3.759
  653    HB3  LEU  84           2HB      LEU  84 -11.126   6.810  -5.184
  654    HG   LEU  84           HG       LEU  84  -8.379   7.609  -4.143
  655   HD11  LEU  84          1HD1      LEU  84  -7.571   6.632  -6.308
  656   HD12  LEU  84          2HD1      LEU  84  -8.412   5.413  -5.322
  657   HD13  LEU  84          3HD1      LEU  84  -9.242   6.167  -6.704
  658   HD21  LEU  84          3HD2      LEU  84  -9.556   9.519  -5.061
  659   HD22  LEU  84          1HD2      LEU  84  -8.243   9.030  -6.159
  660   HD23  LEU  84          2HD2      LEU  84  -9.931   8.612  -6.546
  661    H    GLU  85           H        GLU  85 -11.754   6.647  -1.338
  662    HA   GLU  85           HA       GLU  85 -13.787   5.918  -0.479
  663    HB2  GLU  85           1HB      GLU  85 -14.799   8.363  -1.940
  664    HB3  GLU  85           2HB      GLU  85 -15.700   7.427  -0.722
  665    HG2  GLU  85           1HG      GLU  85 -13.918   8.083   0.996
  666    HG3  GLU  85           2HG      GLU  85 -13.171   8.976  -0.347
  667    H    HIS  86           H        HIS  86 -12.917   4.723  -2.873
  668    HA   HIS  86           HA       HIS  86 -15.329   4.341  -4.521
  669    HB2  HIS  86           1HB      HIS  86 -12.950   4.226  -5.441
  670    HB3  HIS  86           2HB      HIS  86 -12.767   2.698  -4.548
  671    HD1  HIS  86           HD1      HIS  86 -14.316   0.696  -5.306
  672    HD2  HIS  86           HD2      HIS  86 -14.368   4.001  -7.920
  673    HE1  HIS  86           HE1      HIS  86 -15.200  -0.135  -7.426
  674    H    HIS  87           H        HIS  87 -16.654   2.620  -4.606
  675    HA   HIS  87           HA       HIS  87 -17.128   1.149  -2.196
  676    HB2  HIS  87           1HB      HIS  87 -18.912   1.521  -3.856
  677    HB3  HIS  87           2HB      HIS  87 -18.020   0.553  -5.054
  678    HD1  HIS  87           HD1      HIS  87 -19.654   0.137  -1.636
  679    HD2  HIS  87           HD2      HIS  87 -18.780  -2.156  -5.062
  680    HE1  HIS  87           HE1      HIS  87 -20.608  -2.076  -1.229
  681    H    HIS  88           H        HIS  88 -16.322  -0.596  -1.347
  682    HA   HIS  88           HA       HIS  88 -14.796  -2.465  -3.117
  683    HB2  HIS  88           1HB      HIS  88 -13.884  -1.135  -0.558
  684    HB3  HIS  88           2HB      HIS  88 -13.301  -2.763  -0.975
  685    HD1  HIS  88           HD1      HIS  88 -13.363   0.769  -2.380
  686    HD2  HIS  88           HD2      HIS  88 -11.083  -2.758  -2.725
  687    HE1  HIS  88           HE1      HIS  88 -11.484   1.322  -3.841
  688    H    HIS  89           H        HIS  89 -14.538  -4.607  -2.287
  689    HA   HIS  89           HA       HIS  89 -16.143  -5.436   0.014
  690    HB2  HIS  89           1HB      HIS  89 -17.602  -6.981  -1.324
  691    HB3  HIS  89           2HB      HIS  89 -17.956  -5.264  -1.632
  692    HD1  HIS  89           HD1      HIS  89 -16.347  -8.295  -3.211
  693    HD2  HIS  89           HD2      HIS  89 -17.678  -4.465  -4.361
  694    HE1  HIS  89           HE1      HIS  89 -16.164  -8.220  -5.646
  695    H    HIS  90           H        HIS  90 -16.252  -7.920   0.074
  696    HA   HIS  90           HA       HIS  90 -13.483  -8.787   0.052
  697    HB2  HIS  90           1HB      HIS  90 -14.327 -10.856   1.004
  698    HB3  HIS  90           2HB      HIS  90 -15.222  -9.514   1.754
  699    HD1  HIS  90           HD1      HIS  90 -15.619 -12.264  -0.814
  700    HD2  HIS  90           HD2      HIS  90 -18.046  -9.671   1.452
  701    HE1  HIS  90           HE1      HIS  90 -17.925 -12.964  -1.229
  702    H    HIS  91           H        HIS  91 -12.823 -10.912  -0.840
  703    HA   HIS  91           HA       HIS  91 -13.060 -10.876  -3.702
  704    HB2  HIS  91           1HB      HIS  91 -12.038 -13.019  -1.785
  705    HB3  HIS  91           2HB      HIS  91 -11.900 -13.111  -3.557
  706    HD1  HIS  91           HD1      HIS  91  -9.298 -13.290  -2.513
  707    HD2  HIS  91           HD2      HIS  91 -11.066  -9.475  -2.799
  708    HE1  HIS  91           HE1      HIS  91  -7.461 -11.684  -2.381
  Start of MODEL   11
    1    H1   MET   1           1H       MET   1 -12.193   0.315   1.716
    2    H2   MET   1           2H       MET   1 -12.571   0.204   3.164
    3    H3   MET   1           3H       MET   1 -12.795   1.491   2.427
    4    HA   MET   1           HA       MET   1 -10.467   0.874   3.926
    5    HB2  MET   1           1HB      MET   1 -10.031   1.146   0.953
    6    HB3  MET   1           2HB      MET   1  -8.752   1.279   2.184
    7    HG2  MET   1           1HG      MET   1  -9.074  -1.022   2.844
    8    HG3  MET   1           2HG      MET   1 -10.481  -1.176   1.764
    9    HE1  MET   1           3HE      MET   1  -9.478  -3.373   0.664
   10    HE2  MET   1           1HE      MET   1  -7.827  -3.487   0.010
   11    HE3  MET   1           2HE      MET   1  -8.077  -3.268   1.759
   12    H    LYS   2           H        LYS   2  -9.695   2.628   4.838
   13    HA   LYS   2           HA       LYS   2  -9.444   5.131   3.371
   14    HB2  LYS   2           1HB      LYS   2 -11.838   5.162   3.974
   15    HB3  LYS   2           2HB      LYS   2 -11.381   4.997   5.686
   16    HG2  LYS   2           1HG      LYS   2 -10.322   7.155   5.689
   17    HG3  LYS   2           2HG      LYS   2 -10.497   7.302   3.925
   18    HD2  LYS   2           1HD      LYS   2 -12.963   7.292   4.192
   19    HD3  LYS   2           2HD      LYS   2 -12.753   7.214   5.958
   20    HE2  LYS   2           1HE      LYS   2 -11.678   9.364   5.995
   21    HE3  LYS   2           2HE      LYS   2 -11.623   9.422   4.217
   22    HZ1  LYS   2           3HZ      LYS   2 -14.074   9.452   5.859
   23    HZ2  LYS   2           1HZ      LYS   2 -13.414  10.758   5.096
   24    HZ3  LYS   2           2HZ      LYS   2 -14.024   9.506   4.210
   25    H    ILE   3           H        ILE   3  -7.899   6.391   4.163
   26    HA   ILE   3           HA       ILE   3  -6.125   5.090   6.075
   27    HB   ILE   3           HB       ILE   3  -6.024   7.829   4.730
   28   HG12  ILE   3          1HG1      ILE   3  -4.409   5.359   4.172
   29   HG13  ILE   3          2HG1      ILE   3  -5.889   5.809   3.294
   30   HG21  ILE   3          1HG2      ILE   3  -3.666   7.886   5.473
   31   HG22  ILE   3          2HG2      ILE   3  -4.774   7.825   6.863
   32   HG23  ILE   3          3HG2      ILE   3  -3.905   6.358   6.353
   33   HD11  ILE   3          3HD1      ILE   3  -3.339   7.455   3.442
   34   HD12  ILE   3          1HD1      ILE   3  -3.876   6.488   2.050
   35   HD13  ILE   3          2HD1      ILE   3  -4.821   7.906   2.566
   36    H    ILE   4           H        ILE   4  -6.065   5.163   8.154
   37    HA   ILE   4           HA       ILE   4  -7.043   7.650   9.515
   38    HB   ILE   4           HB       ILE   4  -6.240   4.911  10.596
   39   HG12  ILE   4          1HG1      ILE   4  -8.886   6.339  10.608
   40   HG13  ILE   4          2HG1      ILE   4  -8.414   5.037   9.492
   41   HG21  ILE   4          1HG2      ILE   4  -6.895   5.804  12.805
   42   HG22  ILE   4          2HG2      ILE   4  -5.530   6.718  12.124
   43   HG23  ILE   4          3HG2      ILE   4  -7.171   7.404  12.076
   44   HD11  ILE   4          3HD1      ILE   4  -8.639   4.797  12.514
   45   HD12  ILE   4          1HD1      ILE   4  -9.809   4.172  11.330
   46   HD13  ILE   4          2HD1      ILE   4  -8.166   3.493  11.398
   47    H    SER   5           H        SER   5  -4.170   5.596   9.185
   48    HA   SER   5           HA       SER   5  -2.405   7.948   9.637
   49    HB2  SER   5           1HB      SER   5  -2.995   7.559  11.844
   50    HB3  SER   5           2HB      SER   5  -2.568   5.838  11.703
   51    HG   SER   5           HG       SER   5  -0.882   7.100  12.604
   52    H    ILE   6           H        ILE   6  -0.707   7.648   8.344
   53    HA   ILE   6           HA       ILE   6   0.232   4.840   7.814
   54    HB   ILE   6           HB       ILE   6   0.721   7.413   6.244
   55   HG12  ILE   6          1HG1      ILE   6  -0.896   4.973   5.552
   56   HG13  ILE   6          2HG1      ILE   6  -1.539   6.561   6.028
   57   HG21  ILE   6          1HG2      ILE   6   1.837   5.931   4.612
   58   HG22  ILE   6          2HG2      ILE   6   2.652   5.875   6.191
   59   HG23  ILE   6          3HG2      ILE   6   1.581   4.544   5.697
   60   HD11  ILE   6          3HD1      ILE   6   0.127   5.988   3.552
   61   HD12  ILE   6          1HD1      ILE   6  -1.631   6.264   3.585
   62   HD13  ILE   6          2HD1      ILE   6  -0.516   7.578   4.030
   63    H    SER   7           H        SER   7   2.003   4.126   8.604
   64    HA   SER   7           HA       SER   7   3.991   6.106   9.758
   65    HB2  SER   7           1HB      SER   7   4.202   4.916  11.691
   66    HB3  SER   7           2HB      SER   7   2.500   5.383  11.465
   67    HG   SER   7           HG       SER   7   3.641   2.829  10.988
   68    H    GLU   8           H        GLU   8   6.029   4.946  10.370
   69    HA   GLU   8           HA       GLU   8   6.872   3.206   8.129
   70    HB2  GLU   8           1HB      GLU   8   8.379   4.434  10.442
   71    HB3  GLU   8           2HB      GLU   8   9.107   3.464   9.138
   72    HG2  GLU   8           1HG      GLU   8   8.382   5.245   7.470
   73    HG3  GLU   8           2HG      GLU   8   7.657   6.066   8.872
   74    H    THR   9           H        THR   9   8.430   1.417   8.668
   75    HA   THR   9           HA       THR   9   7.381  -0.160  10.992
   76    HB   THR   9           HB       THR   9   7.303  -2.161   9.658
   77    HG1  THR   9           HG1      THR   9   7.937  -0.775   7.284
   78   HG21  THR   9          3HG2      THR   9   6.015   0.119   8.106
   79   HG22  THR   9          1HG2      THR   9   5.572  -1.600   7.988
   80   HG23  THR   9          2HG2      THR   9   5.306  -0.713   9.509
   81    HA   PRO  10           HA       PRO  10  11.441  -1.251  12.143
   82    HB2  PRO  10           2HB      PRO  10  11.357  -3.389  13.189
   83    HB3  PRO  10           1HB      PRO  10  10.683  -4.173  11.753
   84    HG2  PRO  10           1HG      PRO  10   8.774  -4.055  13.151
   85    HG3  PRO  10           2HG      PRO  10   9.262  -2.511  13.861
   86    HD2  PRO  10           1HD      PRO  10   8.003  -3.040  11.140
   87    HD3  PRO  10           2HD      PRO  10   7.694  -1.713  12.266
   88    H    ASN  11           H        ASN  11  10.096  -2.782   9.278
   89    HA   ASN  11           HA       ASN  11  12.860  -3.059   8.177
   90    HB2  ASN  11           1HB      ASN  11  10.235  -4.164   6.923
   91    HB3  ASN  11           2HB      ASN  11  11.936  -4.005   6.427
   92   HD21  ASN  11          2HD2      ASN  11  10.049  -6.306   7.063
   93   HD22  ASN  11          1HD2      ASN  11  10.969  -7.313   8.130
   94    H    HIS  12           H        HIS  12  13.632  -1.958   6.495
   95    HA   HIS  12           HA       HIS  12  12.248   0.594   5.946
   96    HB2  HIS  12           1HB      HIS  12  14.738   0.448   6.476
   97    HB3  HIS  12           2HB      HIS  12  14.948  -0.340   4.895
   98    HD2  HIS  12           HD2      HIS  12  14.116   3.311   6.323
   99    HE1  HIS  12           HE1      HIS  12  14.945   3.451   2.160
  100    HE2  HIS  12           HE2      HIS  12  14.489   4.815   4.361
  101    H    ASN  13           H        ASN  13  12.007   1.468   3.835
  102    HA   ASN  13           HA       ASN  13  11.320   1.359   1.609
  103    HB2  ASN  13           1HB      ASN  13  12.608  -1.473   1.515
  104    HB3  ASN  13           2HB      ASN  13  11.626  -0.498   0.394
  105   HD21  ASN  13          2HD2      ASN  13  14.558  -1.475   0.658
  106   HD22  ASN  13          1HD2      ASN  13  15.471  -0.069   0.221
  107    H    THR  14           H        THR  14   9.934   0.037   4.123
  108    HA   THR  14           HA       THR  14   7.466  -0.379   2.551
  109    HB   THR  14           HB       THR  14   8.224  -2.683   2.740
  110    HG1  THR  14           HG1      THR  14   5.996  -2.284   3.170
  111   HG21  THR  14          3HG2      THR  14   8.463  -2.121   5.723
  112   HG22  THR  14          1HG2      THR  14   8.682  -3.705   4.942
  113   HG23  THR  14          2HG2      THR  14   9.821  -2.378   4.603
  114    H    MET  15           H        MET  15   5.650   0.241   3.541
  115    HA   MET  15           HA       MET  15   5.939   1.255   6.347
  116    HB2  MET  15           1HB      MET  15   4.834   2.687   3.933
  117    HB3  MET  15           2HB      MET  15   4.576   3.210   5.614
  118    HG2  MET  15           1HG      MET  15   7.009   3.473   5.895
  119    HG3  MET  15           2HG      MET  15   7.252   2.975   4.204
  120    HE1  MET  15           3HE      MET  15   6.192   5.791   6.664
  121    HE2  MET  15           1HE      MET  15   5.352   6.954   5.612
  122    HE3  MET  15           2HE      MET  15   4.610   5.375   5.963
  123    H    LYS  16           H        LYS  16   3.910   1.730   7.411
  124    HA   LYS  16           HA       LYS  16   1.919  -0.370   6.628
  125    HB2  LYS  16           1HB      LYS  16   3.145  -0.770   8.720
  126    HB3  LYS  16           2HB      LYS  16   2.568   0.793   9.341
  127    HG2  LYS  16           1HG      LYS  16   0.312   0.031   9.436
  128    HG3  LYS  16           2HG      LYS  16   0.693  -1.428   8.492
  129    HD2  LYS  16           1HD      LYS  16   0.516  -2.166  10.736
  130    HD3  LYS  16           2HD      LYS  16   2.260  -2.079  10.398
  131    HE2  LYS  16           1HE      LYS  16   2.329   0.155  11.462
  132    HE3  LYS  16           2HE      LYS  16   0.601   0.002  11.853
  133    HZ1  LYS  16           3HZ      LYS  16   2.742  -1.775  12.831
  134    HZ2  LYS  16           1HZ      LYS  16   1.989  -0.603  13.716
  135    HZ3  LYS  16           2HZ      LYS  16   1.139  -1.917  13.192
  136    H    ILE  17           H        ILE  17  -0.102   0.111   6.247
  137    HA   ILE  17           HA       ILE  17  -0.968   2.948   6.758
  138    HB   ILE  17           HB       ILE  17  -1.833   1.039   4.538
  139   HG12  ILE  17          1HG1      ILE  17  -0.212   3.564   4.348
  140   HG13  ILE  17          2HG1      ILE  17   0.454   1.915   4.315
  141   HG21  ILE  17          1HG2      ILE  17  -3.057   3.003   3.670
  142   HG22  ILE  17          2HG2      ILE  17  -3.631   2.559   5.294
  143   HG23  ILE  17          3HG2      ILE  17  -2.543   3.951   5.084
  144   HD11  ILE  17          3HD1      ILE  17  -1.509   3.079   2.309
  145   HD12  ILE  17          1HD1      ILE  17   0.231   2.829   2.039
  146   HD13  ILE  17          2HD1      ILE  17  -0.843   1.429   2.276
  147    H    THR  18           H        THR  18  -2.066   2.967   8.539
  148    HA   THR  18           HA       THR  18  -3.888   0.774   9.233
  149    HB   THR  18           HB       THR  18  -3.499   3.520  10.498
  150    HG1  THR  18           HG1      THR  18  -1.652   2.263  10.749
  151   HG21  THR  18          3HG2      THR  18  -4.926   1.029  11.513
  152   HG22  THR  18          1HG2      THR  18  -4.670   2.530  12.434
  153   HG23  THR  18          2HG2      THR  18  -5.713   2.538  10.991
  154    H    LEU  19           H        LEU  19  -5.917   0.530   8.748
  155    HA   LEU  19           HA       LEU  19  -7.291   2.836   7.408
  156    HB2  LEU  19           1HB      LEU  19  -7.583  -0.082   7.104
  157    HB3  LEU  19           2HB      LEU  19  -8.561   1.044   6.134
  158    HG   LEU  19           HG       LEU  19  -5.544   0.676   5.994
  159   HD11  LEU  19          1HD1      LEU  19  -6.024  -0.161   3.678
  160   HD12  LEU  19          2HD1      LEU  19  -6.838  -1.157   4.906
  161   HD13  LEU  19          3HD1      LEU  19  -7.764   0.047   3.981
  162   HD21  LEU  19          3HD2      LEU  19  -6.156   2.995   5.643
  163   HD22  LEU  19          1HD2      LEU  19  -5.631   2.267   4.106
  164   HD23  LEU  19          2HD2      LEU  19  -7.364   2.522   4.424
  165    H    SER  20           H        SER  20  -9.498   3.124   7.689
  166    HA   SER  20           HA       SER  20 -10.542   2.579  10.371
  167    HB2  SER  20           1HB      SER  20 -11.016   4.582   9.276
  168    HB3  SER  20           2HB      SER  20 -11.849   3.710   7.969
  169    HG   SER  20           HG       SER  20 -13.284   4.479   9.579
  170    H    GLU  21           H        GLU  21 -11.531   1.565   7.064
  171    HA   GLU  21           HA       GLU  21 -12.314  -1.087   8.145
  172    HB2  GLU  21           1HB      GLU  21 -14.331   0.286   8.299
  173    HB3  GLU  21           2HB      GLU  21 -14.169   0.710   6.578
  174    HG2  GLU  21           1HG      GLU  21 -14.538  -1.732   5.982
  175    HG3  GLU  21           2HG      GLU  21 -14.601  -2.011   7.738
  176    H    SER  22           H        SER  22 -11.167  -2.439   7.016
  177    HA   SER  22           HA       SER  22 -10.251  -1.750   4.259
  178    HB2  SER  22           1HB      SER  22  -8.757  -2.536   6.002
  179    HB3  SER  22           2HB      SER  22  -9.557  -4.119   5.873
  180    HG   SER  22           HG       SER  22  -7.877  -4.172   4.471
  181    H    ARG  23           H        ARG  23  -9.926  -4.335   3.319
  182    HA   ARG  23           HA       ARG  23 -12.368  -4.766   1.928
  183    HB2  ARG  23           1HB      ARG  23 -11.461  -6.683   1.022
  184    HB3  ARG  23           2HB      ARG  23 -10.183  -5.451   1.137
  185    HG2  ARG  23           1HG      ARG  23  -9.246  -6.581   3.093
  186    HG3  ARG  23           2HG      ARG  23 -10.548  -7.793   3.033
  187    HD2  ARG  23           1HD      ARG  23  -9.733  -8.499   0.839
  188    HD3  ARG  23           2HD      ARG  23  -8.387  -7.346   0.999
  189    HE   ARG  23           HE       ARG  23  -7.339  -8.959   2.553
  190   HH11  ARG  23          1HH1      ARG  23 -10.626  -9.912   1.882
  191   HH12  ARG  23          2HH1      ARG  23 -10.324 -11.482   2.603
  192   HH21  ARG  23          2HH2      ARG  23  -8.246 -11.959   3.462
  193   HH22  ARG  23          1HH2      ARG  23  -6.981 -10.749   3.388
  194    H    GLU  24           H        GLU  24 -13.498  -6.932   1.857
  195    HA   GLU  24           HA       GLU  24 -15.191  -7.004   4.090
  196    HB2  GLU  24           1HB      GLU  24 -15.703  -7.957   1.886
  197    HB3  GLU  24           2HB      GLU  24 -14.538  -9.268   2.197
  198    HG2  GLU  24           1HG      GLU  24 -15.994 -10.049   4.127
  199    HG3  GLU  24           2HG      GLU  24 -17.025  -8.653   3.738
  200    H    GLY  25           H        GLY  25 -12.452  -9.186   3.403
  201    HA2  GLY  25           1HA      GLY  25 -12.780 -10.358   6.111
  202    HA3  GLY  25           2HA      GLY  25 -11.754 -10.987   4.801
  203    H    MET  26           H        MET  26 -11.221 -10.289   7.690
  204    HA   MET  26           HA       MET  26  -9.141  -8.182   7.373
  205    HB2  MET  26           1HB      MET  26 -10.084  -9.743   9.777
  206    HB3  MET  26           2HB      MET  26  -8.862  -8.449   9.789
  207    HG2  MET  26           1HG      MET  26 -11.726  -8.051   8.891
  208    HG3  MET  26           2HG      MET  26 -11.173  -7.774  10.560
  209    HE1  MET  26           3HE      MET  26 -12.250  -5.994   7.618
  210    HE2  MET  26           1HE      MET  26 -10.941  -4.918   7.072
  211    HE3  MET  26           2HE      MET  26 -10.827  -6.673   6.790
  212    H    THR  27           H        THR  27  -9.219 -11.172   6.398
  213    HA   THR  27           HA       THR  27  -6.927 -12.315   7.837
  214    HB   THR  27           HB       THR  27  -7.122 -14.174   6.254
  215    HG1  THR  27           HG1      THR  27  -8.810 -14.008   4.620
  216   HG21  THR  27          3HG2      THR  27  -9.855 -13.193   7.171
  217   HG22  THR  27          1HG2      THR  27  -9.445 -14.867   6.725
  218   HG23  THR  27          2HG2      THR  27  -8.698 -14.118   8.158
  219    H    SER  28           H        SER  28  -5.067 -13.199   6.602
  220    HA   SER  28           HA       SER  28  -3.594 -10.945   5.450
  221    HB2  SER  28           1HB      SER  28  -1.783 -12.326   5.365
  222    HB3  SER  28           2HB      SER  28  -2.623 -12.547   6.918
  223    HG   SER  28           HG       SER  28  -1.972 -14.527   5.971
  224    H    ASP  29           H        ASP  29  -2.750 -10.767   3.377
  225    HA   ASP  29           HA       ASP  29  -3.230 -12.767   1.320
  226    HB2  ASP  29           1HB      ASP  29  -5.501 -11.307   1.617
  227    HB3  ASP  29           2HB      ASP  29  -4.412 -10.148   0.815
  228    H    THR  30           H        THR  30  -2.264 -12.280  -0.687
  229    HA   THR  30           HA       THR  30  -0.157 -10.158  -0.413
  230    HB   THR  30           HB       THR  30   0.061 -12.886  -1.757
  231    HG1  THR  30           HG1      THR  30   1.593 -13.227  -0.039
  232   HG21  THR  30          3HG2      THR  30   2.110 -10.667  -1.367
  233   HG22  THR  30          1HG2      THR  30   2.432 -12.270  -2.071
  234   HG23  THR  30          2HG2      THR  30   1.357 -11.127  -2.912
  235    H    TYR  31           H        TYR  31  -0.015  -8.683  -1.901
  236    HA   TYR  31           HA       TYR  31  -1.457  -9.158  -4.491
  237    HB2  TYR  31           1HB      TYR  31  -1.371  -6.613  -2.862
  238    HB3  TYR  31           2HB      TYR  31  -2.139  -6.824  -4.453
  239    HD1  TYR  31           HD1      TYR  31  -2.778  -6.678  -1.016
  240    HD2  TYR  31           HD2      TYR  31  -3.883  -8.878  -4.498
  241    HE1  TYR  31           HE1      TYR  31  -4.881  -7.369   0.098
  242    HE2  TYR  31           HE2      TYR  31  -5.986  -9.579  -3.402
  243    HH   TYR  31           HH       TYR  31  -6.816  -9.853  -0.902
  244    H    THR  32           H        THR  32   0.080  -9.420  -5.926
  245    HA   THR  32           HA       THR  32   2.220  -7.316  -6.030
  246    HB   THR  32           HB       THR  32   3.699  -8.984  -7.061
  247    HG1  THR  32           HG1      THR  32   2.984 -11.198  -7.081
  248   HG21  THR  32          3HG2      THR  32   2.477  -9.992  -4.461
  249   HG22  THR  32          1HG2      THR  32   4.080 -10.428  -5.094
  250   HG23  THR  32          2HG2      THR  32   3.744  -8.750  -4.601
  251    H    LYS  33           H        LYS  33  -0.310  -9.005  -7.660
  252    HA   LYS  33           HA       LYS  33   0.465  -7.632 -10.217
  253    HB2  LYS  33           1HB      LYS  33  -1.049 -10.207  -9.760
  254    HB3  LYS  33           2HB      LYS  33  -0.871  -9.393 -11.333
  255    HG2  LYS  33           1HG      LYS  33   1.582  -9.678 -11.186
  256    HG3  LYS  33           2HG      LYS  33   1.377 -10.537  -9.642
  257    HD2  LYS  33           1HD      LYS  33   0.044 -12.265 -10.768
  258    HD3  LYS  33           2HD      LYS  33   0.220 -11.402 -12.313
  259    HE2  LYS  33           1HE      LYS  33   2.663 -11.686 -12.185
  260    HE3  LYS  33           2HE      LYS  33   2.475 -12.572 -10.655
  261    HZ1  LYS  33           3HZ      LYS  33   1.390 -13.411 -13.267
  262    HZ2  LYS  33           1HZ      LYS  33   2.708 -14.064 -12.522
  263    HZ3  LYS  33           2HZ      LYS  33   1.213 -14.233 -11.847
  264    H    VAL  34           H        VAL  34  -1.180  -6.815 -11.540
  265    HA   VAL  34           HA       VAL  34  -3.527  -5.818  -9.976
  266    HB   VAL  34           HB       VAL  34  -2.465  -5.077 -12.736
  267   HG11  VAL  34          1HG1      VAL  34  -4.092  -3.220 -12.603
  268   HG12  VAL  34          2HG1      VAL  34  -4.914  -4.797 -12.550
  269   HG13  VAL  34          3HG1      VAL  34  -4.693  -3.857 -11.054
  270   HG21  VAL  34          3HG2      VAL  34  -0.976  -4.359 -10.964
  271   HG22  VAL  34          1HG2      VAL  34  -1.815  -2.968 -11.686
  272   HG23  VAL  34          2HG2      VAL  34  -2.335  -3.596 -10.104
  273    H    ASP  35           H        ASP  35  -5.428  -6.612 -10.061
  274    HA   ASP  35           HA       ASP  35  -6.634  -7.598 -12.490
  275    HB2  ASP  35           1HB      ASP  35  -4.965  -9.556 -11.519
  276    HB3  ASP  35           2HB      ASP  35  -6.395  -9.660 -10.463
  277    H    ASP  36           H        ASP  36  -8.699  -8.921 -11.889
  278    HA   ASP  36           HA       ASP  36 -10.285  -6.974 -10.468
  279    HB2  ASP  36           1HB      ASP  36 -11.008  -9.763 -11.550
  280    HB3  ASP  36           2HB      ASP  36 -12.035  -8.595 -10.684
  281    H    SER  37           H        SER  37  -8.754  -9.967  -9.523
  282    HA   SER  37           HA       SER  37 -10.450 -10.557  -7.214
  283    HB2  SER  37           1HB      SER  37  -8.975 -12.193  -6.686
  284    HB3  SER  37           2HB      SER  37  -9.216 -12.195  -8.448
  285    HG   SER  37           HG       SER  37  -7.184 -10.704  -8.190
  286    H    GLN  38           H        GLN  38  -7.827  -8.348  -7.847
  287    HA   GLN  38           HA       GLN  38  -7.298  -7.945  -4.956
  288    HB2  GLN  38           1HB      GLN  38  -6.274  -6.495  -7.407
  289    HB3  GLN  38           2HB      GLN  38  -5.729  -6.238  -5.731
  290    HG2  GLN  38           1HG      GLN  38  -3.974  -7.888  -6.502
  291    HG3  GLN  38           2HG      GLN  38  -5.402  -8.665  -5.779
  292   HE21  GLN  38          2HE2      GLN  38  -3.244  -9.121  -8.093
  293   HE22  GLN  38          1HE2      GLN  38  -4.213  -9.849  -9.333
  294    HA   PRO  39           HA       PRO  39 -10.214  -4.702  -4.262
  295    HB2  PRO  39           2HB      PRO  39  -9.517  -3.749  -2.194
  296    HB3  PRO  39           1HB      PRO  39  -7.874  -3.452  -2.775
  297    HG2  PRO  39           1HG      PRO  39  -7.521  -5.319  -1.365
  298    HG3  PRO  39           2HG      PRO  39  -9.095  -6.031  -1.741
  299    HD2  PRO  39           1HD      PRO  39  -6.549  -6.049  -3.410
  300    HD3  PRO  39           2HD      PRO  39  -7.740  -7.338  -3.187
  301    H    ALA  40           H        ALA  40 -10.787  -3.000  -5.327
  302    HA   ALA  40           HA       ALA  40  -9.449  -1.991  -7.526
  303    HB1  ALA  40           3HB      ALA  40 -11.252  -0.438  -5.637
  304    HB2  ALA  40           1HB      ALA  40 -10.846   0.026  -7.305
  305    HB3  ALA  40           2HB      ALA  40 -11.785  -1.454  -6.999
  306    H    PHE  41           H        PHE  41  -9.390  -0.500  -4.271
  307    HA   PHE  41           HA       PHE  41  -7.492   1.520  -4.834
  308    HB2  PHE  41           1HB      PHE  41  -8.140  -0.032  -2.304
  309    HB3  PHE  41           2HB      PHE  41  -6.916   1.258  -2.338
  310    HD1  PHE  41           HD1      PHE  41  -9.308   2.148  -4.683
  311    HD2  PHE  41           HD2      PHE  41  -8.706   1.872  -0.462
  312    HE1  PHE  41           HE1      PHE  41 -11.077   3.837  -4.322
  313    HE2  PHE  41           HE2      PHE  41 -10.476   3.560  -0.096
  314    HZ   PHE  41           HZ       PHE  41 -11.661   4.543  -2.028
  315    H    ILE  42           H        ILE  42  -6.937  -1.840  -3.794
  316    HA   ILE  42           HA       ILE  42  -4.082  -1.662  -3.623
  317    HB   ILE  42           HB       ILE  42  -5.949  -3.981  -4.275
  318   HG12  ILE  42          1HG1      ILE  42  -6.104  -3.048  -2.042
  319   HG13  ILE  42          2HG1      ILE  42  -5.499  -4.721  -2.067
  320   HG21  ILE  42          1HG2      ILE  42  -3.996  -5.456  -3.930
  321   HG22  ILE  42          2HG2      ILE  42  -3.744  -4.377  -5.322
  322   HG23  ILE  42          3HG2      ILE  42  -2.945  -4.029  -3.770
  323   HD11  ILE  42          3HD1      ILE  42  -3.806  -2.225  -1.710
  324   HD12  ILE  42          1HD1      ILE  42  -4.274  -3.357  -0.421
  325   HD13  ILE  42          2HD1      ILE  42  -3.201  -3.898  -1.735
  326    H    ASN  43           H        ASN  43  -6.186  -2.282  -6.393
  327    HA   ASN  43           HA       ASN  43  -4.068  -2.853  -8.247
  328    HB2  ASN  43           1HB      ASN  43  -6.903  -1.739  -8.894
  329    HB3  ASN  43           2HB      ASN  43  -5.446  -2.106  -9.850
  330   HD21  ASN  43          2HD2      ASN  43  -8.247  -3.266  -9.604
  331   HD22  ASN  43          1HD2      ASN  43  -7.979  -4.971  -9.456
  332    H    ASP  44           H        ASP  44  -5.710   0.210  -7.438
  333    HA   ASP  44           HA       ASP  44  -4.155   1.896  -9.123
  334    HB2  ASP  44           1HB      ASP  44  -5.448   2.490  -6.393
  335    HB3  ASP  44           2HB      ASP  44  -4.554   3.586  -7.478
  336    H    ILE  45           H        ILE  45  -3.538   0.829  -5.778
  337    HA   ILE  45           HA       ILE  45  -1.149   2.406  -5.444
  338    HB   ILE  45           HB       ILE  45  -2.054  -0.180  -4.101
  339   HG12  ILE  45          1HG1      ILE  45  -2.097   2.632  -3.052
  340   HG13  ILE  45          2HG1      ILE  45  -3.476   1.843  -3.853
  341   HG21  ILE  45          1HG2      ILE  45  -0.373   0.362  -2.371
  342   HG22  ILE  45          2HG2      ILE  45   0.398   0.102  -3.953
  343   HG23  ILE  45          3HG2      ILE  45   0.169   1.754  -3.334
  344   HD11  ILE  45          3HD1      ILE  45  -2.115   0.892  -1.308
  345   HD12  ILE  45          1HD1      ILE  45  -3.684   1.723  -1.401
  346   HD13  ILE  45          2HD1      ILE  45  -3.493   0.102  -2.109
  347    H    LEU  46           H        LEU  46  -1.626  -0.916  -6.582
  348    HA   LEU  46           HA       LEU  46   1.123  -1.556  -6.933
  349    HB2  LEU  46           1HB      LEU  46  -1.357  -2.227  -8.355
  350    HB3  LEU  46           2HB      LEU  46   0.137  -3.051  -8.860
  351    HG   LEU  46           HG       LEU  46  -1.101  -3.178  -6.083
  352   HD11  LEU  46          1HD1      LEU  46  -1.641  -5.553  -6.683
  353   HD12  LEU  46          2HD1      LEU  46  -2.454  -4.409  -7.777
  354   HD13  LEU  46          3HD1      LEU  46  -0.993  -5.272  -8.316
  355   HD21  LEU  46          3HD2      LEU  46   1.313  -3.386  -6.043
  356   HD22  LEU  46          1HD2      LEU  46   0.562  -4.957  -5.674
  357   HD23  LEU  46          2HD2      LEU  46   1.253  -4.656  -7.288
  358    H    LYS  47           H        LYS  47  -1.086   0.307  -8.965
  359    HA   LYS  47           HA       LYS  47   0.806   0.426 -11.195
  360    HB2  LYS  47           1HB      LYS  47  -1.747   1.905 -10.554
  361    HB3  LYS  47           2HB      LYS  47  -0.792   2.160 -12.035
  362    HG2  LYS  47           1HG      LYS  47  -1.126  -0.216 -12.639
  363    HG3  LYS  47           2HG      LYS  47  -2.120  -0.435 -11.180
  364    HD2  LYS  47           1HD      LYS  47  -3.705   1.261 -12.011
  365    HD3  LYS  47           2HD      LYS  47  -2.716   1.462 -13.476
  366    HE2  LYS  47           1HE      LYS  47  -3.082  -0.908 -14.040
  367    HE3  LYS  47           2HE      LYS  47  -4.095  -1.089 -12.588
  368    HZ1  LYS  47           3HZ      LYS  47  -4.664   0.697 -14.864
  369    HZ2  LYS  47           1HZ      LYS  47  -5.420  -0.736 -14.560
  370    HZ3  LYS  47           2HZ      LYS  47  -5.604   0.531 -13.520
  371    H    VAL  48           H        VAL  48   0.313   2.194  -8.274
  372    HA   VAL  48           HA       VAL  48   1.538   4.696  -8.985
  373    HB   VAL  48           HB       VAL  48   1.571   3.128  -6.374
  374   HG11  VAL  48          1HG1      VAL  48   2.257   5.266  -5.337
  375   HG12  VAL  48          2HG1      VAL  48   3.473   4.701  -6.506
  376   HG13  VAL  48          3HG1      VAL  48   2.357   6.015  -6.947
  377   HG21  VAL  48          3HG2      VAL  48  -0.654   3.781  -7.075
  378   HG22  VAL  48          1HG2      VAL  48  -0.129   4.733  -5.667
  379   HG23  VAL  48          2HG2      VAL  48  -0.113   5.463  -7.289
  380    H    GLU  49           H        GLU  49   3.408   5.256  -9.646
  381    HA   GLU  49           HA       GLU  49   5.478   3.348 -10.155
  382    HB2  GLU  49           1HB      GLU  49   5.146   5.496 -11.347
  383    HB3  GLU  49           2HB      GLU  49   5.699   6.350  -9.887
  384    HG2  GLU  49           1HG      GLU  49   7.964   5.229 -10.131
  385    HG3  GLU  49           2HG      GLU  49   7.246   4.382 -11.520
  386    H    GLY  50           H        GLY  50   6.899   2.417  -8.937
  387    HA2  GLY  50           1HA      GLY  50   8.823   2.774  -7.436
  388    HA3  GLY  50           2HA      GLY  50   7.794   3.859  -6.472
  389    H    VAL  51           H        VAL  51   5.467   2.000  -6.843
  390    HA   VAL  51           HA       VAL  51   5.948   0.379  -4.438
  391    HB   VAL  51           HB       VAL  51   3.581   0.494  -6.357
  392   HG11  VAL  51          1HG1      VAL  51   2.358  -0.652  -4.542
  393   HG12  VAL  51          2HG1      VAL  51   3.710  -1.648  -5.128
  394   HG13  VAL  51          3HG1      VAL  51   3.858  -0.758  -3.593
  395   HG21  VAL  51          3HG2      VAL  51   3.953   2.611  -5.240
  396   HG22  VAL  51          1HG2      VAL  51   2.497   1.809  -4.606
  397   HG23  VAL  51          2HG2      VAL  51   4.005   1.793  -3.661
  398    H    LYS  52           H        LYS  52   6.649  -1.550  -4.228
  399    HA   LYS  52           HA       LYS  52   7.132  -3.128  -6.709
  400    HB2  LYS  52           1HB      LYS  52   9.009  -2.699  -5.195
  401    HB3  LYS  52           2HB      LYS  52   8.117  -3.492  -3.875
  402    HG2  LYS  52           1HG      LYS  52   8.159  -5.615  -5.118
  403    HG3  LYS  52           2HG      LYS  52   9.044  -4.823  -6.444
  404    HD2  LYS  52           1HD      LYS  52  10.894  -4.311  -4.888
  405    HD3  LYS  52           2HD      LYS  52  10.011  -5.135  -3.581
  406    HE2  LYS  52           1HE      LYS  52  10.092  -7.238  -4.818
  407    HE3  LYS  52           2HE      LYS  52  10.908  -6.428  -6.174
  408    HZ1  LYS  52           3HZ      LYS  52  11.996  -6.723  -3.448
  409    HZ2  LYS  52           1HZ      LYS  52  12.465  -7.595  -4.767
  410    HZ3  LYS  52           2HZ      LYS  52  12.755  -5.971  -4.706
  411    H    SER  53           H        SER  53   5.941  -3.714  -3.385
  412    HA   SER  53           HA       SER  53   3.967  -5.714  -4.472
  413    HB2  SER  53           1HB      SER  53   4.623  -7.430  -3.106
  414    HB3  SER  53           2HB      SER  53   5.969  -6.943  -4.161
  415    HG   SER  53           HG       SER  53   6.625  -7.315  -1.999
  416    H    ILE  54           H        ILE  54   2.284  -6.159  -3.036
  417    HA   ILE  54           HA       ILE  54   2.180  -4.471  -0.548
  418    HB   ILE  54           HB       ILE  54  -0.131  -5.130  -2.430
  419   HG12  ILE  54          1HG1      ILE  54   1.129  -2.450  -1.936
  420   HG13  ILE  54          2HG1      ILE  54   1.544  -3.507  -3.305
  421   HG21  ILE  54          1HG2      ILE  54  -1.399  -3.570  -0.990
  422   HG22  ILE  54          2HG2      ILE  54  -0.775  -4.947  -0.050
  423   HG23  ILE  54          3HG2      ILE  54   0.033  -3.364   0.047
  424   HD11  ILE  54          3HD1      ILE  54  -1.207  -2.358  -2.714
  425   HD12  ILE  54          1HD1      ILE  54  -0.088  -1.787  -3.971
  426   HD13  ILE  54          2HD1      ILE  54  -0.792  -3.417  -4.082
  427    H    PHE  55           H        PHE  55   1.608  -5.346   1.271
  428    HA   PHE  55           HA       PHE  55   0.323  -8.057   1.150
  429    HB2  PHE  55           1HB      PHE  55   2.637  -8.309   1.950
  430    HB3  PHE  55           2HB      PHE  55   2.367  -7.051   3.178
  431    HD1  PHE  55           HD1      PHE  55   1.103 -10.373   2.062
  432    HD2  PHE  55           HD2      PHE  55   1.683  -7.628   5.283
  433    HE1  PHE  55           HE1      PHE  55   0.359 -12.101   3.666
  434    HE2  PHE  55           HE2      PHE  55   0.942  -9.354   6.890
  435    HZ   PHE  55           HZ       PHE  55   0.278 -11.591   6.080
  436    H    HIS  56           H        HIS  56  -1.570  -8.220   2.039
  437    HA   HIS  56           HA       HIS  56  -2.425  -6.065   3.937
  438    HB2  HIS  56           1HB      HIS  56  -3.834  -6.235   1.914
  439    HB3  HIS  56           2HB      HIS  56  -4.102  -7.965   2.236
  440    HD1  HIS  56           HD1      HIS  56  -5.594  -8.573   4.303
  441    HD2  HIS  56           HD2      HIS  56  -5.520  -4.453   3.418
  442    HE1  HIS  56           HE1      HIS  56  -7.522  -7.602   5.449
  443    H    VAL  57           H        VAL  57  -3.129  -6.479   5.924
  444    HA   VAL  57           HA       VAL  57  -4.089  -9.131   6.713
  445    HB   VAL  57           HB       VAL  57  -1.562  -9.397   6.861
  446   HG11  VAL  57          1HG1      VAL  57  -0.438  -8.252   8.742
  447   HG12  VAL  57          2HG1      VAL  57  -1.033  -7.080   7.542
  448   HG13  VAL  57          3HG1      VAL  57  -1.923  -7.325   9.064
  449   HG21  VAL  57          3HG2      VAL  57  -3.080 -10.775   8.151
  450   HG22  VAL  57          1HG2      VAL  57  -1.621 -10.387   9.094
  451   HG23  VAL  57          2HG2      VAL  57  -3.148  -9.537   9.429
  452    H    MET  58           H        MET  58  -5.225  -9.176   8.556
  453    HA   MET  58           HA       MET  58  -6.708  -8.233  10.081
  454    HB2  MET  58           1HB      MET  58  -4.457  -6.247  10.408
  455    HB3  MET  58           2HB      MET  58  -5.849  -6.445  11.500
  456    HG2  MET  58           1HG      MET  58  -3.683  -8.496  10.951
  457    HG3  MET  58           2HG      MET  58  -3.845  -7.509  12.424
  458    HE1  MET  58           3HE      MET  58  -6.873  -7.487  13.092
  459    HE2  MET  58           1HE      MET  58  -7.039  -8.933  14.115
  460    HE3  MET  58           2HE      MET  58  -5.614  -7.881  14.287
  461    H    ASP  59           H        ASP  59  -6.064  -5.076  10.362
  462    HA   ASP  59           HA       ASP  59  -7.911  -4.331   8.117
  463    HB2  ASP  59           1HB      ASP  59  -8.896  -4.304  10.601
  464    HB3  ASP  59           2HB      ASP  59  -7.724  -2.968  10.707
  465    H    PHE  60           H        PHE  60  -5.131  -4.309   7.863
  466    HA   PHE  60           HA       PHE  60  -4.861  -1.469   7.121
  467    HB2  PHE  60           1HB      PHE  60  -2.698  -1.162   8.217
  468    HB3  PHE  60           2HB      PHE  60  -3.913  -1.574   9.448
  469    HD1  PHE  60           HD1      PHE  60  -0.960  -2.720   7.610
  470    HD2  PHE  60           HD2      PHE  60  -3.832  -3.642  10.637
  471    HE1  PHE  60           HE1      PHE  60   0.481  -4.561   8.415
  472    HE2  PHE  60           HE2      PHE  60  -2.392  -5.482  11.445
  473    HZ   PHE  60           HZ       PHE  60  -0.236  -5.942  10.332
  474    H    ILE  61           H        ILE  61  -2.973  -1.061   5.777
  475    HA   ILE  61           HA       ILE  61  -2.215  -3.529   4.229
  476    HB   ILE  61           HB       ILE  61  -2.746  -0.693   3.234
  477   HG12  ILE  61          1HG1      ILE  61  -4.118  -3.275   2.537
  478   HG13  ILE  61          2HG1      ILE  61  -4.718  -2.087   3.720
  479   HG21  ILE  61          1HG2      ILE  61  -2.208  -1.597   0.998
  480   HG22  ILE  61          2HG2      ILE  61  -0.808  -1.717   2.090
  481   HG23  ILE  61          3HG2      ILE  61  -1.784  -3.162   1.733
  482   HD11  ILE  61          3HD1      ILE  61  -4.262  -1.576   0.760
  483   HD12  ILE  61          1HD1      ILE  61  -5.839  -1.820   1.543
  484   HD13  ILE  61          2HD1      ILE  61  -4.860  -0.388   1.941
  485    H    SER  62           H        SER  62  -0.212  -3.984   3.880
  486    HA   SER  62           HA       SER  62   1.903  -2.008   4.746
  487    HB2  SER  62           1HB      SER  62   1.984  -4.024   5.881
  488    HB3  SER  62           2HB      SER  62   2.016  -4.937   4.355
  489    HG   SER  62           HG       SER  62   4.102  -4.611   5.240
  490    H    VAL  63           H        VAL  63   2.845  -0.872   3.176
  491    HA   VAL  63           HA       VAL  63   2.888  -2.002   0.382
  492    HB   VAL  63           HB       VAL  63   3.029   0.891   1.326
  493   HG11  VAL  63          1HG1      VAL  63   2.906   1.421  -1.085
  494   HG12  VAL  63          2HG1      VAL  63   4.356   0.460  -0.713
  495   HG13  VAL  63          3HG1      VAL  63   2.944  -0.316  -1.468
  496   HG21  VAL  63          3HG2      VAL  63   0.801  -0.019   1.595
  497   HG22  VAL  63          1HG2      VAL  63   0.851   1.144   0.251
  498   HG23  VAL  63          2HG2      VAL  63   0.816  -0.603  -0.086
  499    H    ASP  64           H        ASP  64   4.667  -2.681  -0.401
  500    HA   ASP  64           HA       ASP  64   7.216  -1.630   0.783
  501    HB2  ASP  64           1HB      ASP  64   6.776  -4.150   1.120
  502    HB3  ASP  64           2HB      ASP  64   6.655  -4.145  -0.656
  503    H    LYS  65           H        LYS  65   8.455  -0.436  -0.411
  504    HA   LYS  65           HA       LYS  65   7.812  -0.256  -3.322
  505    HB2  LYS  65           1HB      LYS  65   8.805   1.889  -3.279
  506    HB3  LYS  65           2HB      LYS  65   7.679   1.775  -1.904
  507    HG2  LYS  65           1HG      LYS  65   9.467   1.576  -0.338
  508    HG3  LYS  65           2HG      LYS  65  10.662   1.323  -1.631
  509    HD2  LYS  65           1HD      LYS  65  10.327   3.610  -2.427
  510    HD3  LYS  65           2HD      LYS  65   9.066   3.870  -1.196
  511    HE2  LYS  65           1HE      LYS  65  11.048   4.869  -0.345
  512    HE3  LYS  65           2HE      LYS  65  10.813   3.353   0.553
  513    HZ1  LYS  65           3HZ      LYS  65  12.655   3.734  -1.719
  514    HZ2  LYS  65           1HZ      LYS  65  13.097   3.639  -0.132
  515    HZ3  LYS  65           2HZ      LYS  65  12.441   2.325  -0.886
  516    H    GLU  66           H        GLU  66   9.795   0.528  -4.641
  517    HA   GLU  66           HA       GLU  66  11.959  -1.445  -4.314
  518    HB2  GLU  66           1HB      GLU  66  11.551   0.823  -6.268
  519    HB3  GLU  66           2HB      GLU  66  12.883  -0.356  -6.321
  520    HG2  GLU  66           1HG      GLU  66  11.110  -2.199  -6.640
  521    HG3  GLU  66           2HG      GLU  66   9.953  -0.847  -6.636
  522    H    ASN  67           H        ASN  67  14.164  -0.959  -4.143
  523    HA   ASN  67           HA       ASN  67  14.694   0.878  -1.990
  524    HB2  ASN  67           1HB      ASN  67  16.182  -1.312  -2.707
  525    HB3  ASN  67           2HB      ASN  67  16.587  -0.047  -3.891
  526   HD21  ASN  67          2HD2      ASN  67  18.541   0.627  -3.471
  527   HD22  ASN  67          1HD2      ASN  67  19.150   1.091  -1.918
  528    H    ASP  68           H        ASP  68  15.131   1.098  -5.494
  529    HA   ASP  68           HA       ASP  68  16.522   3.642  -5.404
  530    HB2  ASP  68           1HB      ASP  68  14.973   2.260  -7.678
  531    HB3  ASP  68           2HB      ASP  68  15.806   3.834  -7.677
  532    H    ALA  69           H        ALA  69  13.116   2.702  -5.711
  533    HA   ALA  69           HA       ALA  69  12.094   5.308  -6.220
  534    HB1  ALA  69           3HB      ALA  69  10.798   2.985  -4.752
  535    HB2  ALA  69           1HB      ALA  69   9.951   4.408  -5.400
  536    HB3  ALA  69           2HB      ALA  69  10.756   3.271  -6.507
  537    H    ASN  70           H        ASN  70  10.913   6.730  -4.833
  538    HA   ASN  70           HA       ASN  70  11.871   6.670  -1.987
  539    HB2  ASN  70           1HB      ASN  70  11.511   9.319  -3.573
  540    HB3  ASN  70           2HB      ASN  70  11.837   8.815  -1.896
  541   HD21  ASN  70          2HD2      ASN  70  13.114   9.305  -5.050
  542   HD22  ASN  70          1HD2      ASN  70  14.770   8.955  -4.683
  543    H    TRP  71           H        TRP  71  10.511   7.393  -0.394
  544    HA   TRP  71           HA       TRP  71   7.696   6.866  -0.873
  545    HB2  TRP  71           1HB      TRP  71   9.281   7.887   1.511
  546    HB3  TRP  71           2HB      TRP  71   7.507   7.745   1.538
  547    HD1  TRP  71           HD1      TRP  71  10.301   6.042   2.602
  548    HE1  TRP  71           HE1      TRP  71   9.885   3.387   2.900
  549    HE3  TRP  71           HE3      TRP  71   6.026   5.659  -0.119
  550    HZ2  TRP  71           HZ2      TRP  71   7.974   1.588   2.039
  551    HZ3  TRP  71           HZ3      TRP  71   4.935   3.516  -0.374
  552    HH2  TRP  71           HH2      TRP  71   5.840   1.481   0.663
  553    H    GLU  72           H        GLU  72   9.680   9.728  -0.895
  554    HA   GLU  72           HA       GLU  72   7.649  11.708  -0.610
  555    HB2  GLU  72           1HB      GLU  72  10.188  11.641  -2.242
  556    HB3  GLU  72           2HB      GLU  72   9.154  13.080  -2.074
  557    HG2  GLU  72           1HG      GLU  72   9.601  13.085   0.414
  558    HG3  GLU  72           2HG      GLU  72  10.502  11.578   0.130
  559    H    THR  73           H        THR  73   8.591   9.738  -3.385
  560    HA   THR  73           HA       THR  73   6.628  11.072  -5.131
  561    HB   THR  73           HB       THR  73   8.242   8.516  -5.521
  562    HG1  THR  73           HG1      THR  73   8.614  11.175  -6.513
  563   HG21  THR  73          3HG2      THR  73   6.623  10.183  -7.487
  564   HG22  THR  73          1HG2      THR  73   7.628   8.774  -7.900
  565   HG23  THR  73          2HG2      THR  73   6.181   8.568  -6.884
  566    H    VAL  74           H        VAL  74   6.894   7.960  -3.409
  567    HA   VAL  74           HA       VAL  74   4.571   6.832  -4.754
  568    HB   VAL  74           HB       VAL  74   6.061   6.008  -2.229
  569   HG11  VAL  74          1HG1      VAL  74   4.858   3.861  -2.463
  570   HG12  VAL  74          2HG1      VAL  74   3.723   5.204  -2.195
  571   HG13  VAL  74          3HG1      VAL  74   3.932   4.528  -3.829
  572   HG21  VAL  74          3HG2      VAL  74   7.413   5.868  -4.234
  573   HG22  VAL  74          1HG2      VAL  74   6.991   4.244  -3.642
  574   HG23  VAL  74          2HG2      VAL  74   6.142   4.927  -5.049
  575    H    LEU  75           H        LEU  75   5.011   8.364  -1.564
  576    HA   LEU  75           HA       LEU  75   2.618   7.182  -0.517
  577    HB2  LEU  75           1HB      LEU  75   4.367   9.428   0.166
  578    HB3  LEU  75           2HB      LEU  75   2.956   9.181   1.220
  579    HG   LEU  75           HG       LEU  75   5.230   7.220   0.723
  580   HD11  LEU  75          1HD1      LEU  75   5.696   7.568   3.164
  581   HD12  LEU  75          2HD1      LEU  75   5.813   9.095   2.260
  582   HD13  LEU  75          3HD1      LEU  75   4.364   8.747   3.234
  583   HD21  LEU  75          3HD2      LEU  75   3.121   6.048   0.953
  584   HD22  LEU  75          1HD2      LEU  75   4.118   5.789   2.402
  585   HD23  LEU  75          2HD2      LEU  75   2.756   6.935   2.450
  586    HA   PRO  76           HA       PRO  76   0.692  11.637  -1.445
  587    HB2  PRO  76           2HB      PRO  76   1.623  13.153  -3.058
  588    HB3  PRO  76           1HB      PRO  76   2.228  11.846  -4.086
  589    HG2  PRO  76           1HG      PRO  76   4.210  12.589  -2.997
  590    HG3  PRO  76           2HG      PRO  76   3.374  12.897  -1.469
  591    HD2  PRO  76           1HD      PRO  76   4.258  10.238  -2.653
  592    HD3  PRO  76           2HD      PRO  76   4.273  10.761  -0.964
  593    H    LYS  77           H        LYS  77   1.732   9.397  -4.020
  594    HA   LYS  77           HA       LYS  77  -0.840   9.559  -5.372
  595    HB2  LYS  77           1HB      LYS  77   1.472   7.624  -5.560
  596    HB3  LYS  77           2HB      LYS  77   0.021   7.553  -6.590
  597    HG2  LYS  77           1HG      LYS  77   0.534   9.782  -7.484
  598    HG3  LYS  77           2HG      LYS  77   1.971   9.879  -6.438
  599    HD2  LYS  77           1HD      LYS  77   2.946   7.936  -7.573
  600    HD3  LYS  77           2HD      LYS  77   1.500   7.801  -8.602
  601    HE2  LYS  77           1HE      LYS  77   1.948  10.048  -9.513
  602    HE3  LYS  77           2HE      LYS  77   3.406  10.160  -8.500
  603    HZ1  LYS  77           3HZ      LYS  77   2.945   8.167 -10.625
  604    HZ2  LYS  77           1HZ      LYS  77   3.931   9.485 -10.744
  605    HZ3  LYS  77           2HZ      LYS  77   4.297   8.271  -9.688
  606    H    VAL  78           H        VAL  78   0.688   7.143  -3.242
  607    HA   VAL  78           HA       VAL  78  -1.545   5.317  -3.199
  608    HB   VAL  78           HB       VAL  78   0.611   5.897  -1.125
  609   HG11  VAL  78          1HG1      VAL  78  -0.046   3.727  -0.138
  610   HG12  VAL  78          2HG1      VAL  78  -1.394   4.888  -0.088
  611   HG13  VAL  78          3HG1      VAL  78  -1.378   3.595  -1.311
  612   HG21  VAL  78          3HG2      VAL  78   1.497   5.068  -3.222
  613   HG22  VAL  78          1HG2      VAL  78   1.624   3.832  -1.950
  614   HG23  VAL  78          2HG2      VAL  78   0.354   3.704  -3.189
  615    H    GLU  79           H        GLU  79  -0.731   8.046  -1.063
  616    HA   GLU  79           HA       GLU  79  -2.963   7.823   0.668
  617    HB2  GLU  79           1HB      GLU  79  -1.082   9.356   1.000
  618    HB3  GLU  79           2HB      GLU  79  -1.623  10.314  -0.397
  619    HG2  GLU  79           1HG      GLU  79  -3.762  10.867   0.868
  620    HG3  GLU  79           2HG      GLU  79  -3.100   9.835   2.156
  621    H    ALA  80           H        ALA  80  -2.714   9.426  -2.496
  622    HA   ALA  80           HA       ALA  80  -5.298  10.571  -2.527
  623    HB1  ALA  80           3HB      ALA  80  -3.695   9.436  -4.843
  624    HB2  ALA  80           1HB      ALA  80  -5.080  10.543  -4.980
  625    HB3  ALA  80           2HB      ALA  80  -3.579  11.091  -4.198
  626    H    VAL  81           H        VAL  81  -4.246   7.278  -3.277
  627    HA   VAL  81           HA       VAL  81  -6.540   6.315  -4.630
  628    HB   VAL  81           HB       VAL  81  -4.734   4.901  -2.625
  629   HG11  VAL  81          1HG1      VAL  81  -5.620   2.812  -3.607
  630   HG12  VAL  81          2HG1      VAL  81  -6.915   3.755  -2.834
  631   HG13  VAL  81          3HG1      VAL  81  -6.748   3.759  -4.606
  632   HG21  VAL  81          3HG2      VAL  81  -3.552   5.725  -4.571
  633   HG22  VAL  81          1HG2      VAL  81  -3.675   3.951  -4.611
  634   HG23  VAL  81          2HG2      VAL  81  -4.734   4.940  -5.647
  635    H    PHE  82           H        PHE  82  -6.010   6.492  -1.116
  636    HA   PHE  82           HA       PHE  82  -8.731   5.479  -0.626
  637    HB2  PHE  82           1HB      PHE  82  -6.714   6.647   1.338
  638    HB3  PHE  82           2HB      PHE  82  -8.153   5.676   1.726
  639    HD1  PHE  82           HD1      PHE  82  -4.760   5.611   0.312
  640    HD2  PHE  82           HD2      PHE  82  -8.145   3.317   1.550
  641    HE1  PHE  82           HE1      PHE  82  -3.395   3.552   0.227
  642    HE2  PHE  82           HE2      PHE  82  -6.783   1.257   1.468
  643    HZ   PHE  82           HZ       PHE  82  -4.405   1.375   0.804
  644    H    GLU  83           H        GLU  83  -7.048   8.583  -0.598
  645    HA   GLU  83           HA       GLU  83  -9.090  10.003   0.857
  646    HB2  GLU  83           1HB      GLU  83  -6.883  10.855  -1.008
  647    HB3  GLU  83           2HB      GLU  83  -7.999  12.012  -0.245
  648    HG2  GLU  83           1HG      GLU  83  -6.051  10.158   1.255
  649    HG3  GLU  83           2HG      GLU  83  -5.944  11.902   0.928
  650    H    LEU  84           H        LEU  84  -8.691   9.178  -2.523
  651    HA   LEU  84           HA       LEU  84 -10.636  11.009  -3.578
  652    HB2  LEU  84           1HB      LEU  84  -9.638   8.350  -4.329
  653    HB3  LEU  84           2HB      LEU  84 -10.780   9.152  -5.433
  654    HG   LEU  84           HG       LEU  84  -8.058  10.239  -4.614
  655   HD11  LEU  84          1HD1      LEU  84  -7.395   9.721  -6.978
  656   HD12  LEU  84          2HD1      LEU  84  -7.868   8.247  -6.101
  657   HD13  LEU  84          3HD1      LEU  84  -8.998   8.998  -7.252
  658   HD21  LEU  84          3HD2      LEU  84  -9.664  11.990  -5.097
  659   HD22  LEU  84          1HD2      LEU  84  -8.449  11.906  -6.394
  660   HD23  LEU  84          2HD2      LEU  84 -10.075  11.226  -6.650
  661    H    GLU  85           H        GLU  85 -10.929   7.944  -1.913
  662    HA   GLU  85           HA       GLU  85 -12.795   6.650  -1.388
  663    HB2  GLU  85           1HB      GLU  85 -14.086   9.383  -1.389
  664    HB3  GLU  85           2HB      GLU  85 -14.768   7.903  -0.671
  665    HG2  GLU  85           1HG      GLU  85 -12.799   7.858   0.955
  666    HG3  GLU  85           2HG      GLU  85 -12.256   9.325   0.110
  667    H    HIS  86           H        HIS  86 -12.224   6.803  -4.137
  668    HA   HIS  86           HA       HIS  86 -14.822   7.059  -5.507
  669    HB2  HIS  86           1HB      HIS  86 -13.588   6.436  -7.518
  670    HB3  HIS  86           2HB      HIS  86 -12.638   7.652  -6.632
  671    HD1  HIS  86           HD1      HIS  86 -12.699   3.996  -7.531
  672    HD2  HIS  86           HD2      HIS  86 -10.040   6.768  -5.796
  673    HE1  HIS  86           HE1      HIS  86 -10.560   2.835  -7.314
  674    H    HIS  87           H        HIS  87 -15.221   5.153  -7.141
  675    HA   HIS  87           HA       HIS  87 -16.420   3.102  -5.643
  676    HB2  HIS  87           1HB      HIS  87 -17.021   3.537  -7.994
  677    HB3  HIS  87           2HB      HIS  87 -15.414   2.983  -8.522
  678    HD2  HIS  87           HD2      HIS  87 -15.377   0.258  -9.217
  679    HE1  HIS  87           HE1      HIS  87 -18.941  -0.744  -7.134
  680    HE2  HIS  87           HE2      HIS  87 -17.017  -1.563  -8.727
  681    H    HIS  88           H        HIS  88 -15.866   1.264  -4.741
  682    HA   HIS  88           HA       HIS  88 -13.173   0.130  -5.268
  683    HB2  HIS  88           1HB      HIS  88 -12.725   1.740  -3.471
  684    HB3  HIS  88           2HB      HIS  88 -14.089   1.100  -2.524
  685    HD2  HIS  88           HD2      HIS  88 -13.348  -0.949  -0.731
  686    HE1  HIS  88           HE1      HIS  88  -9.569  -1.690  -2.526
  687    HE2  HIS  88           HE2      HIS  88 -11.210  -2.234  -0.545
  688    H    HIS  89           H        HIS  89 -13.146  -1.975  -5.270
  689    HA   HIS  89           HA       HIS  89 -14.949  -3.540  -3.569
  690    HB2  HIS  89           1HB      HIS  89 -16.116  -4.690  -5.385
  691    HB3  HIS  89           2HB      HIS  89 -16.422  -2.943  -5.527
  692    HD2  HIS  89           HD2      HIS  89 -14.841  -5.870  -7.659
  693    HE1  HIS  89           HE1      HIS  89 -14.400  -2.182  -9.720
  694    HE2  HIS  89           HE2      HIS  89 -14.197  -4.801  -9.827
  695    H    HIS  90           H        HIS  90 -14.714  -5.913  -4.018
  696    HA   HIS  90           HA       HIS  90 -12.248  -6.711  -5.402
  697    HB2  HIS  90           1HB      HIS  90 -11.164  -7.687  -3.433
  698    HB3  HIS  90           2HB      HIS  90 -11.409  -5.945  -3.158
  699    HD1  HIS  90           HD1      HIS  90 -12.475  -9.332  -1.982
  700    HD2  HIS  90           HD2      HIS  90 -13.225  -5.306  -0.987
  701    HE1  HIS  90           HE1      HIS  90 -13.715  -9.377   0.123
  702    H    HIS  91           H        HIS  91 -11.871  -9.054  -5.281
  703    HA   HIS  91           HA       HIS  91 -14.485 -10.502  -4.998
  704    HB2  HIS  91           1HB      HIS  91 -12.309 -10.888  -7.103
  705    HB3  HIS  91           2HB      HIS  91 -13.731 -11.937  -6.896
  706    HD1  HIS  91           HD1      HIS  91 -12.674  -8.553  -8.124
  707    HD2  HIS  91           HD2      HIS  91 -16.177 -10.893  -8.018
  708    HE1  HIS  91           HE1      HIS  91 -14.309  -7.383  -9.512
  Start of MODEL   12
    1    H1   MET   1           1H       MET   1 -14.809   1.781   3.272
    2    H2   MET   1           2H       MET   1 -14.807   1.780   4.772
    3    H3   MET   1           3H       MET   1 -14.807   3.080   4.023
    4    HA   MET   1           HA       MET   1 -12.477   1.735   4.927
    5    HB2  MET   1           1HB      MET   1 -12.853   1.820   1.938
    6    HB3  MET   1           2HB      MET   1 -11.261   1.673   2.724
    7    HG2  MET   1           1HG      MET   1 -11.971  -0.424   3.779
    8    HG3  MET   1           2HG      MET   1 -13.570  -0.275   3.012
    9    HE1  MET   1           3HE      MET   1  -9.846  -1.272   2.630
   10    HE2  MET   1           1HE      MET   1  -9.595  -1.277   0.867
   11    HE3  MET   1           2HE      MET   1  -9.839   0.262   1.728
   12    H    LYS   2           H        LYS   2 -11.771   3.443   5.965
   13    HA   LYS   2           HA       LYS   2 -10.806   5.694   4.259
   14    HB2  LYS   2           1HB      LYS   2 -12.938   6.357   5.333
   15    HB3  LYS   2           2HB      LYS   2 -12.202   6.024   6.919
   16    HG2  LYS   2           1HG      LYS   2 -10.526   7.774   6.520
   17    HG3  LYS   2           2HG      LYS   2 -11.238   8.100   4.922
   18    HD2  LYS   2           1HD      LYS   2 -13.353   8.753   5.982
   19    HD3  LYS   2           2HD      LYS   2 -12.668   8.398   7.586
   20    HE2  LYS   2           1HE      LYS   2 -10.982  10.135   7.280
   21    HE3  LYS   2           2HE      LYS   2 -11.594  10.465   5.643
   22    HZ1  LYS   2           3HZ      LYS   2 -13.108  10.841   8.146
   23    HZ2  LYS   2           1HZ      LYS   2 -12.437  12.046   7.241
   24    HZ3  LYS   2           2HZ      LYS   2 -13.676  11.146   6.628
   25    H    ILE   3           H        ILE   3  -8.791   6.218   4.580
   26    HA   ILE   3           HA       ILE   3  -7.155   4.726   6.449
   27    HB   ILE   3           HB       ILE   3  -6.408   5.819   4.219
   28   HG12  ILE   3          1HG1      ILE   3  -4.715   6.422   6.626
   29   HG13  ILE   3          2HG1      ILE   3  -4.974   4.786   5.975
   30   HG21  ILE   3          1HG2      ILE   3  -5.585   8.140   4.426
   31   HG22  ILE   3          2HG2      ILE   3  -7.345   8.061   4.672
   32   HG23  ILE   3          3HG2      ILE   3  -6.258   8.234   6.070
   33   HD11  ILE   3          3HD1      ILE   3  -3.732   7.120   4.476
   34   HD12  ILE   3          1HD1      ILE   3  -2.850   5.739   5.168
   35   HD13  ILE   3          2HD1      ILE   3  -3.992   5.485   3.826
   36    H    ILE   4           H        ILE   4  -6.142   5.231   8.283
   37    HA   ILE   4           HA       ILE   4  -7.152   7.686   9.692
   38    HB   ILE   4           HB       ILE   4  -5.896   5.125  10.781
   39   HG12  ILE   4          1HG1      ILE   4  -8.681   6.207  11.114
   40   HG13  ILE   4          2HG1      ILE   4  -8.206   4.927   9.973
   41   HG21  ILE   4          1HG2      ILE   4  -6.372   6.096  13.003
   42   HG22  ILE   4          2HG2      ILE   4  -5.239   7.118  12.088
   43   HG23  ILE   4          3HG2      ILE   4  -6.949   7.589  12.228
   44   HD11  ILE   4          3HD1      ILE   4  -7.961   4.793  12.998
   45   HD12  ILE   4          1HD1      ILE   4  -9.196   3.973  12.016
   46   HD13  ILE   4          2HD1      ILE   4  -7.484   3.514  11.857
   47    H    SER   5           H        SER   5  -4.166   5.761   9.358
   48    HA   SER   5           HA       SER   5  -2.565   8.224   8.942
   49    HB2  SER   5           1HB      SER   5  -1.278   8.183  10.819
   50    HB3  SER   5           2HB      SER   5  -2.986   8.356  11.282
   51    HG   SER   5           HG       SER   5  -1.855   6.862  12.599
   52    H    ILE   6           H        ILE   6  -0.341   7.731   8.536
   53    HA   ILE   6           HA       ILE   6   0.250   4.813   8.094
   54    HB   ILE   6           HB       ILE   6   1.236   7.211   6.481
   55   HG12  ILE   6          1HG1      ILE   6  -0.615   4.979   5.685
   56   HG13  ILE   6          2HG1      ILE   6  -1.098   6.648   6.070
   57   HG21  ILE   6          1HG2      ILE   6   2.290   5.498   5.044
   58   HG22  ILE   6          2HG2      ILE   6   2.920   5.416   6.705
   59   HG23  ILE   6          3HG2      ILE   6   1.724   4.223   6.148
   60   HD11  ILE   6          3HD1      ILE   6   0.724   5.803   3.790
   61   HD12  ILE   6          1HD1      ILE   6  -0.977   6.295   3.634
   62   HD13  ILE   6          2HD1      ILE   6   0.243   7.473   4.174
   63    H    SER   7           H        SER   7   1.778   3.969   9.188
   64    HA   SER   7           HA       SER   7   3.707   5.790  10.645
   65    HB2  SER   7           1HB      SER   7   3.960   4.134  12.220
   66    HB3  SER   7           2HB      SER   7   2.247   4.568  12.032
   67    HG   SER   7           HG       SER   7   2.579   2.307  12.175
   68    H    GLU   8           H        GLU   8   5.868   4.974  10.931
   69    HA   GLU   8           HA       GLU   8   6.880   3.585   8.504
   70    HB2  GLU   8           1HB      GLU   8   8.281   4.981  10.789
   71    HB3  GLU   8           2HB      GLU   8   9.090   4.223   9.396
   72    HG2  GLU   8           1HG      GLU   8   7.921   5.900   7.872
   73    HG3  GLU   8           2HG      GLU   8   7.169   6.513   9.362
   74    H    THR   9           H        THR   9   8.739   2.079   8.821
   75    HA   THR   9           HA       THR   9   8.307   0.315  11.198
   76    HB   THR   9           HB       THR   9   8.213  -1.659   9.873
   77    HG1  THR   9           HG1      THR   9   8.371  -0.358   7.402
   78   HG21  THR   9          3HG2      THR   9   6.534   0.449   8.458
   79   HG22  THR   9          1HG2      THR   9   6.258  -1.307   8.407
   80   HG23  THR   9          2HG2      THR   9   6.076  -0.422   9.940
   81    HA   PRO  10           HA       PRO  10  12.605  -0.169  11.625
   82    HB2  PRO  10           2HB      PRO  10  13.046  -2.342  12.506
   83    HB3  PRO  10           1HB      PRO  10  12.255  -3.158  11.151
   84    HG2  PRO  10           1HG      PRO  10  10.630  -3.411  12.857
   85    HG3  PRO  10           2HG      PRO  10  10.994  -1.837  13.579
   86    HD2  PRO  10           1HD      PRO  10   9.363  -2.456  11.086
   87    HD3  PRO  10           2HD      PRO  10   9.072  -1.231  12.327
   88    H    ASN  11           H        ASN  11  11.132  -1.913   8.925
   89    HA   ASN  11           HA       ASN  11  13.604  -1.346   7.339
   90    HB2  ASN  11           1HB      ASN  11  12.417  -3.774   7.162
   91    HB3  ASN  11           2HB      ASN  11  11.182  -2.636   6.572
   92   HD21  ASN  11          2HD2      ASN  11  12.437  -4.870   5.215
   93   HD22  ASN  11          1HD2      ASN  11  13.188  -4.221   3.794
   94    H    HIS  12           H        HIS  12  13.720   0.524   6.389
   95    HA   HIS  12           HA       HIS  12  11.392   2.246   6.261
   96    HB2  HIS  12           1HB      HIS  12  12.914   3.917   5.376
   97    HB3  HIS  12           2HB      HIS  12  13.776   3.033   6.658
   98    HD2  HIS  12           HD2      HIS  12  14.170   3.820   2.816
   99    HE1  HIS  12           HE1      HIS  12  17.200   1.106   4.038
  100    HE2  HIS  12           HE2      HIS  12  16.299   2.691   2.145
  101    H    ASN  13           H        ASN  13  12.525  -0.179   4.215
  102    HA   ASN  13           HA       ASN  13  11.720   1.020   1.681
  103    HB2  ASN  13           1HB      ASN  13  12.272  -1.986   2.267
  104    HB3  ASN  13           2HB      ASN  13  11.726  -1.036   0.863
  105   HD21  ASN  13          2HD2      ASN  13  14.139  -2.656   1.290
  106   HD22  ASN  13          1HD2      ASN  13  15.476  -1.597   0.982
  107    H    THR  14           H        THR  14  10.039  -0.376   4.313
  108    HA   THR  14           HA       THR  14   7.543  -0.332   2.664
  109    HB   THR  14           HB       THR  14   8.166  -2.705   2.987
  110    HG1  THR  14           HG1      THR  14   6.005  -1.885   4.673
  111   HG21  THR  14          3HG2      THR  14   8.032  -2.023   5.950
  112   HG22  THR  14          1HG2      THR  14   8.224  -3.653   5.266
  113   HG23  THR  14          2HG2      THR  14   9.506  -2.438   5.046
  114    H    MET  15           H        MET  15   5.679   0.285   3.670
  115    HA   MET  15           HA       MET  15   6.037   1.460   6.406
  116    HB2  MET  15           1HB      MET  15   4.695   2.697   4.003
  117    HB3  MET  15           2HB      MET  15   4.640   3.341   5.662
  118    HG2  MET  15           1HG      MET  15   7.079   3.646   5.620
  119    HG3  MET  15           2HG      MET  15   7.130   3.009   3.959
  120    HE1  MET  15           3HE      MET  15   6.384   6.023   6.280
  121    HE2  MET  15           1HE      MET  15   5.393   7.095   5.261
  122    HE3  MET  15           2HE      MET  15   4.720   5.555   5.850
  123    H    LYS  16           H        LYS  16   4.108   1.817   7.602
  124    HA   LYS  16           HA       LYS  16   2.156  -0.373   7.000
  125    HB2  LYS  16           1HB      LYS  16   3.502  -0.636   9.031
  126    HB3  LYS  16           2HB      LYS  16   2.909   0.935   9.618
  127    HG2  LYS  16           1HG      LYS  16   0.596   0.021   9.613
  128    HG3  LYS  16           2HG      LYS  16   1.251  -1.561   9.132
  129    HD2  LYS  16           1HD      LYS  16   2.586  -1.642  11.194
  130    HD3  LYS  16           2HD      LYS  16   1.953  -0.051  11.672
  131    HE2  LYS  16           1HE      LYS  16  -0.326  -0.968  11.718
  132    HE3  LYS  16           2HE      LYS  16   0.304  -2.560  11.237
  133    HZ1  LYS  16           3HZ      LYS  16   0.974  -1.133  13.730
  134    HZ2  LYS  16           1HZ      LYS  16  -0.048  -2.422  13.608
  135    HZ3  LYS  16           2HZ      LYS  16   1.560  -2.609  13.284
  136    H    ILE  17           H        ILE  17   0.135   0.037   6.597
  137    HA   ILE  17           HA       ILE  17  -0.826   2.854   7.031
  138    HB   ILE  17           HB       ILE  17  -1.734   0.767   4.996
  139   HG12  ILE  17          1HG1      ILE  17  -0.257   3.343   4.534
  140   HG13  ILE  17          2HG1      ILE  17   0.501   1.735   4.600
  141   HG21  ILE  17          1HG2      ILE  17  -3.092   2.615   4.073
  142   HG22  ILE  17          2HG2      ILE  17  -3.556   2.257   5.753
  143   HG23  ILE  17          3HG2      ILE  17  -2.545   3.677   5.392
  144   HD11  ILE  17          3HD1      ILE  17  -1.618   2.623   2.611
  145   HD12  ILE  17          1HD1      ILE  17   0.119   2.445   2.271
  146   HD13  ILE  17          2HD1      ILE  17  -0.860   1.014   2.676
  147    H    THR  18           H        THR  18  -2.192   3.209   8.526
  148    HA   THR  18           HA       THR  18  -3.788   0.920   9.579
  149    HB   THR  18           HB       THR  18  -3.364   3.734  10.671
  150    HG1  THR  18           HG1      THR  18  -2.124   2.556  12.249
  151   HG21  THR  18          3HG2      THR  18  -4.748   1.307  11.880
  152   HG22  THR  18          1HG2      THR  18  -4.458   2.857  12.705
  153   HG23  THR  18          2HG2      THR  18  -5.555   2.784  11.305
  154    H    LEU  19           H        LEU  19  -5.792   0.598   9.082
  155    HA   LEU  19           HA       LEU  19  -7.299   2.859   7.816
  156    HB2  LEU  19           1HB      LEU  19  -7.582  -0.069   7.620
  157    HB3  LEU  19           2HB      LEU  19  -8.635   1.019   6.688
  158    HG   LEU  19           HG       LEU  19  -5.633   0.655   6.350
  159   HD11  LEU  19          1HD1      LEU  19  -6.271  -0.232   4.092
  160   HD12  LEU  19          2HD1      LEU  19  -6.998  -1.198   5.395
  161   HD13  LEU  19          3HD1      LEU  19  -7.987  -0.015   4.509
  162   HD21  LEU  19          3HD2      LEU  19  -6.267   2.967   5.989
  163   HD22  LEU  19          1HD2      LEU  19  -5.848   2.203   4.437
  164   HD23  LEU  19          2HD2      LEU  19  -7.556   2.468   4.868
  165    H    SER  20           H        SER  20  -9.435   3.223   8.313
  166    HA   SER  20           HA       SER  20 -10.413   2.374  10.971
  167    HB2  SER  20           1HB      SER  20 -12.234   3.693  10.583
  168    HB3  SER  20           2HB      SER  20 -10.755   4.571  10.131
  169    HG   SER  20           HG       SER  20 -12.690   4.612   8.667
  170    H    GLU  21           H        GLU  21 -11.299   1.815   7.533
  171    HA   GLU  21           HA       GLU  21 -12.433  -0.820   8.397
  172    HB2  GLU  21           1HB      GLU  21 -13.528   1.040   6.282
  173    HB3  GLU  21           2HB      GLU  21 -14.091  -0.616   6.603
  174    HG2  GLU  21           1HG      GLU  21 -14.885   0.110   8.885
  175    HG3  GLU  21           2HG      GLU  21 -14.151   1.686   8.507
  176    H    SER  22           H        SER  22 -11.952  -2.559   7.204
  177    HA   SER  22           HA       SER  22 -10.220  -2.164   4.751
  178    HB2  SER  22           1HB      SER  22 -10.418  -4.352   6.714
  179    HB3  SER  22           2HB      SER  22  -9.720  -4.537   5.088
  180    HG   SER  22           HG       SER  22  -8.873  -2.865   7.199
  181    H    ARG  23           H        ARG  23 -10.519  -4.201   3.286
  182    HA   ARG  23           HA       ARG  23 -13.089  -4.312   2.110
  183    HB2  ARG  23           1HB      ARG  23 -10.941  -6.385   2.122
  184    HB3  ARG  23           2HB      ARG  23 -12.413  -6.420   1.123
  185    HG2  ARG  23           1HG      ARG  23 -11.735  -4.426  -0.051
  186    HG3  ARG  23           2HG      ARG  23 -10.345  -4.204   1.040
  187    HD2  ARG  23           1HD      ARG  23 -10.731  -6.493  -0.863
  188    HD3  ARG  23           2HD      ARG  23  -9.721  -5.055  -1.147
  189    HE   ARG  23           HE       ARG  23  -8.544  -6.192   1.129
  190   HH11  ARG  23          1HH1      ARG  23  -9.502  -7.595  -1.915
  191   HH12  ARG  23          2HH1      ARG  23  -8.204  -8.766  -1.791
  192   HH21  ARG  23          2HH2      ARG  23  -6.811  -8.732   0.038
  193   HH22  ARG  23          1HH2      ARG  23  -7.058  -7.531   1.290
  194    H    GLU  24           H        GLU  24 -14.609  -6.067   2.000
  195    HA   GLU  24           HA       GLU  24 -15.915  -6.658   4.362
  196    HB2  GLU  24           1HB      GLU  24 -16.738  -7.150   2.087
  197    HB3  GLU  24           2HB      GLU  24 -15.619  -8.531   2.008
  198    HG2  GLU  24           1HG      GLU  24 -16.871  -9.611   3.932
  199    HG3  GLU  24           2HG      GLU  24 -17.855  -8.132   3.950
  200    H    GLY  25           H        GLY  25 -13.550  -8.862   2.820
  201    HA2  GLY  25           1HA      GLY  25 -13.289 -10.363   5.335
  202    HA3  GLY  25           2HA      GLY  25 -12.425 -10.670   3.811
  203    H    MET  26           H        MET  26 -11.753 -10.128   6.838
  204    HA   MET  26           HA       MET  26  -9.602  -8.103   6.332
  205    HB2  MET  26           1HB      MET  26 -11.013  -9.108   8.777
  206    HB3  MET  26           2HB      MET  26  -9.386  -8.395   8.897
  207    HG2  MET  26           1HG      MET  26 -10.911  -6.641   9.371
  208    HG3  MET  26           2HG      MET  26 -10.317  -6.361   7.716
  209    HE1  MET  26           3HE      MET  26 -12.326  -4.668   7.261
  210    HE2  MET  26           1HE      MET  26 -14.038  -5.071   7.540
  211    HE3  MET  26           2HE      MET  26 -12.920  -4.933   8.919
  212    H    THR  27           H        THR  27  -9.739 -11.040   5.544
  213    HA   THR  27           HA       THR  27  -7.679 -12.301   7.206
  214    HB   THR  27           HB       THR  27  -7.770 -14.126   5.577
  215    HG1  THR  27           HG1      THR  27  -9.170 -13.877   3.735
  216   HG21  THR  27          3HG2      THR  27 -10.545 -13.024   6.176
  217   HG22  THR  27          1HG2      THR  27 -10.165 -14.709   5.751
  218   HG23  THR  27          2HG2      THR  27  -9.562 -14.017   7.277
  219    H    SER  28           H        SER  28  -5.719 -13.237   6.216
  220    HA   SER  28           HA       SER  28  -4.035 -11.039   5.249
  221    HB2  SER  28           1HB      SER  28  -2.274 -12.463   5.427
  222    HB3  SER  28           2HB      SER  28  -3.324 -12.667   6.847
  223    HG   SER  28           HG       SER  28  -2.594 -14.660   5.989
  224    H    ASP  29           H        ASP  29  -3.178 -10.723   3.245
  225    HA   ASP  29           HA       ASP  29  -2.984 -12.891   1.321
  226    HB2  ASP  29           1HB      ASP  29  -5.466 -11.778   1.109
  227    HB3  ASP  29           2HB      ASP  29  -4.418 -10.546   0.363
  228    H    THR  30           H        THR  30  -1.743 -12.388  -0.515
  229    HA   THR  30           HA       THR  30  -0.151  -9.865  -0.174
  230    HB   THR  30           HB       THR  30   0.829 -12.590  -1.123
  231    HG1  THR  30           HG1      THR  30   2.053 -12.462   0.851
  232   HG21  THR  30          3HG2      THR  30   2.303  -9.967  -0.660
  233   HG22  THR  30          1HG2      THR  30   3.052 -11.516  -1.111
  234   HG23  THR  30          2HG2      THR  30   1.953 -10.697  -2.244
  235    H    TYR  31           H        TYR  31   0.050  -8.558  -1.817
  236    HA   TYR  31           HA       TYR  31  -0.819  -9.558  -4.509
  237    HB2  TYR  31           1HB      TYR  31  -1.426  -6.853  -3.303
  238    HB3  TYR  31           2HB      TYR  31  -1.920  -7.454  -4.904
  239    HD1  TYR  31           HD1      TYR  31  -2.812  -7.206  -1.431
  240    HD2  TYR  31           HD2      TYR  31  -3.488  -9.486  -4.971
  241    HE1  TYR  31           HE1      TYR  31  -4.895  -8.109  -0.442
  242    HE2  TYR  31           HE2      TYR  31  -5.569 -10.398  -3.998
  243    HH   TYR  31           HH       TYR  31  -6.497 -10.765  -1.522
  244    H    THR  32           H        THR  32   0.813  -9.541  -5.825
  245    HA   THR  32           HA       THR  32   2.784  -7.287  -5.598
  246    HB   THR  32           HB       THR  32   4.483  -8.828  -6.495
  247    HG1  THR  32           HG1      THR  32   3.914 -11.077  -6.654
  248   HG21  THR  32          3HG2      THR  32   3.022  -9.981  -4.086
  249   HG22  THR  32          1HG2      THR  32   4.715 -10.304  -4.529
  250   HG23  THR  32          2HG2      THR  32   4.219  -8.665  -4.044
  251    H    LYS  33           H        LYS  33   0.642  -9.094  -7.630
  252    HA   LYS  33           HA       LYS  33   1.576  -7.467  -9.973
  253    HB2  LYS  33           1HB      LYS  33   0.513 -10.294  -9.902
  254    HB3  LYS  33           2HB      LYS  33   0.767  -9.338 -11.381
  255    HG2  LYS  33           1HG      LYS  33   3.181  -9.204 -10.863
  256    HG3  LYS  33           2HG      LYS  33   2.913 -10.201  -9.412
  257    HD2  LYS  33           1HD      LYS  33   2.085 -12.038 -10.829
  258    HD3  LYS  33           2HD      LYS  33   2.363 -11.043 -12.278
  259    HE2  LYS  33           1HE      LYS  33   4.761 -10.939 -11.745
  260    HE3  LYS  33           2HE      LYS  33   4.483 -11.943 -10.304
  261    HZ1  LYS  33           3HZ      LYS  33   3.997 -12.777 -13.092
  262    HZ2  LYS  33           1HZ      LYS  33   5.271 -13.249 -12.157
  263    HZ3  LYS  33           2HZ      LYS  33   3.738 -13.707 -11.755
  264    H    VAL  34           H        VAL  34   0.116  -6.496 -11.238
  265    HA   VAL  34           HA       VAL  34  -2.463  -5.853 -10.090
  266    HB   VAL  34           HB       VAL  34  -1.405  -5.500 -12.926
  267   HG11  VAL  34          1HG1      VAL  34  -3.227  -3.845 -13.156
  268   HG12  VAL  34          2HG1      VAL  34  -3.876  -5.471 -12.835
  269   HG13  VAL  34          3HG1      VAL  34  -3.812  -4.262 -11.529
  270   HG21  VAL  34          3HG2      VAL  34  -0.069  -4.318 -11.286
  271   HG22  VAL  34          1HG2      VAL  34  -1.027  -3.179 -12.261
  272   HG23  VAL  34          2HG2      VAL  34  -1.534  -3.574 -10.601
  273    H    ASP  35           H        ASP  35  -4.306  -6.785 -10.082
  274    HA   ASP  35           HA       ASP  35  -5.142  -8.513 -12.311
  275    HB2  ASP  35           1HB      ASP  35  -3.743  -9.916 -10.419
  276    HB3  ASP  35           2HB      ASP  35  -5.325  -9.652  -9.642
  277    H    ASP  36           H        ASP  36  -7.333  -9.519 -11.791
  278    HA   ASP  36           HA       ASP  36  -9.037  -7.236 -11.088
  279    HB2  ASP  36           1HB      ASP  36  -9.733 -10.076 -12.050
  280    HB3  ASP  36           2HB      ASP  36 -10.817  -8.745 -11.575
  281    H    SER  37           H        SER  37  -7.597  -9.697  -9.328
  282    HA   SER  37           HA       SER  37  -9.750 -10.379  -7.462
  283    HB2  SER  37           1HB      SER  37  -8.186 -11.476  -6.235
  284    HB3  SER  37           2HB      SER  37  -7.901 -11.808  -7.959
  285    HG   SER  37           HG       SER  37  -6.415  -9.763  -7.443
  286    H    GLN  38           H        GLN  38  -7.456  -7.747  -7.809
  287    HA   GLN  38           HA       GLN  38  -7.972  -6.823  -5.027
  288    HB2  GLN  38           1HB      GLN  38  -6.247  -5.640  -7.212
  289    HB3  GLN  38           2HB      GLN  38  -6.321  -5.112  -5.515
  290    HG2  GLN  38           1HG      GLN  38  -4.434  -6.697  -5.166
  291    HG3  GLN  38           2HG      GLN  38  -5.927  -7.653  -5.316
  292   HE21  GLN  38          2HE2      GLN  38  -2.805  -7.157  -6.485
  293   HE22  GLN  38          1HE2      GLN  38  -2.927  -8.057  -7.960
  294    HA   PRO  39           HA       PRO  39 -10.904  -3.603  -6.086
  295    HB2  PRO  39           2HB      PRO  39 -10.826  -2.155  -4.209
  296    HB3  PRO  39           1HB      PRO  39  -9.083  -1.895  -4.368
  297    HG2  PRO  39           1HG      PRO  39  -9.152  -3.306  -2.472
  298    HG3  PRO  39           2HG      PRO  39 -10.557  -4.204  -3.060
  299    HD2  PRO  39           1HD      PRO  39  -7.644  -4.443  -3.938
  300    HD3  PRO  39           2HD      PRO  39  -8.819  -5.730  -3.640
  301    H    ALA  40           H        ALA  40 -11.038  -2.047  -7.532
  302    HA   ALA  40           HA       ALA  40  -9.032  -1.701  -9.458
  303    HB1  ALA  40           3HB      ALA  40 -11.205   0.262  -8.652
  304    HB2  ALA  40           1HB      ALA  40 -10.289   0.293 -10.177
  305    HB3  ALA  40           2HB      ALA  40 -11.376  -1.069  -9.819
  306    H    PHE  41           H        PHE  41  -9.649   0.224  -6.537
  307    HA   PHE  41           HA       PHE  41  -7.689   2.259  -7.280
  308    HB2  PHE  41           1HB      PHE  41  -8.143   3.153  -5.013
  309    HB3  PHE  41           2HB      PHE  41  -9.656   2.816  -5.881
  310    HD1  PHE  41           HD1      PHE  41  -7.371   1.599  -3.246
  311    HD2  PHE  41           HD2      PHE  41 -11.227   1.293  -5.060
  312    HE1  PHE  41           HE1      PHE  41  -8.155   0.225  -1.345
  313    HE2  PHE  41           HE2      PHE  41 -12.015  -0.078  -3.159
  314    HZ   PHE  41           HZ       PHE  41 -10.476  -0.612  -1.301
  315    H    ILE  42           H        ILE  42  -7.591  -0.774  -5.591
  316    HA   ILE  42           HA       ILE  42  -4.868  -0.346  -4.564
  317    HB   ILE  42           HB       ILE  42  -6.512  -2.872  -5.047
  318   HG12  ILE  42          1HG1      ILE  42  -7.447  -1.503  -3.342
  319   HG13  ILE  42          2HG1      ILE  42  -6.700  -2.956  -2.639
  320   HG21  ILE  42          1HG2      ILE  42  -4.777  -4.016  -3.708
  321   HG22  ILE  42          2HG2      ILE  42  -4.086  -3.326  -5.195
  322   HG23  ILE  42          3HG2      ILE  42  -3.837  -2.505  -3.637
  323   HD11  ILE  42          3HD1      ILE  42  -5.490  -0.169  -2.661
  324   HD12  ILE  42          1HD1      ILE  42  -6.243  -0.966  -1.261
  325   HD13  ILE  42          2HD1      ILE  42  -4.743  -1.623  -1.958
  326    H    ASN  43           H        ASN  43  -6.305  -1.611  -7.518
  327    HA   ASN  43           HA       ASN  43  -3.832  -2.490  -8.701
  328    HB2  ASN  43           1HB      ASN  43  -6.419  -1.577 -10.175
  329    HB3  ASN  43           2HB      ASN  43  -4.793  -2.096 -10.682
  330   HD21  ASN  43          2HD2      ASN  43  -7.535  -3.264 -10.980
  331   HD22  ASN  43          1HD2      ASN  43  -7.382  -4.893 -10.407
  332    H    ASP  44           H        ASP  44  -5.485   0.657  -8.678
  333    HA   ASP  44           HA       ASP  44  -3.691   2.105 -10.310
  334    HB2  ASP  44           1HB      ASP  44  -5.181   3.021  -7.777
  335    HB3  ASP  44           2HB      ASP  44  -4.155   3.967  -8.884
  336    H    ILE  45           H        ILE  45  -3.434   1.426  -6.816
  337    HA   ILE  45           HA       ILE  45  -0.922   2.773  -6.448
  338    HB   ILE  45           HB       ILE  45  -2.186   0.415  -4.982
  339   HG12  ILE  45          1HG1      ILE  45  -1.916   3.294  -4.164
  340   HG13  ILE  45          2HG1      ILE  45  -3.357   2.591  -4.936
  341   HG21  ILE  45          1HG2      ILE  45  -0.532   0.864  -3.201
  342   HG22  ILE  45          2HG2      ILE  45   0.271   0.390  -4.716
  343   HG23  ILE  45          3HG2      ILE  45   0.236   2.100  -4.226
  344   HD11  ILE  45          3HD1      ILE  45  -2.174   1.741  -2.269
  345   HD12  ILE  45          1HD1      ILE  45  -3.635   2.730  -2.492
  346   HD13  ILE  45          2HD1      ILE  45  -3.613   1.036  -3.041
  347    H    LEU  46           H        LEU  46  -1.612  -0.629  -7.215
  348    HA   LEU  46           HA       LEU  46   1.094  -1.484  -7.344
  349    HB2  LEU  46           1HB      LEU  46  -1.366  -2.199  -8.781
  350    HB3  LEU  46           2HB      LEU  46   0.085  -3.184  -9.075
  351    HG   LEU  46           HG       LEU  46  -1.286  -2.811  -6.384
  352   HD11  LEU  46          1HD1      LEU  46  -1.963  -5.212  -6.658
  353   HD12  LEU  46          2HD1      LEU  46  -2.640  -4.197  -7.953
  354   HD13  LEU  46          3HD1      LEU  46  -1.220  -5.220  -8.275
  355   HD21  LEU  46          3HD2      LEU  46   1.104  -3.163  -6.176
  356   HD22  LEU  46          1HD2      LEU  46   0.228  -4.610  -5.624
  357   HD23  LEU  46          2HD2      LEU  46   1.013  -4.600  -7.221
  358    H    LYS  47           H        LYS  47  -0.885   0.233  -9.705
  359    HA   LYS  47           HA       LYS  47   1.052  -0.148 -11.863
  360    HB2  LYS  47           1HB      LYS  47  -1.374   1.614 -11.520
  361    HB3  LYS  47           2HB      LYS  47  -0.363   1.599 -12.986
  362    HG2  LYS  47           1HG      LYS  47  -0.893  -0.763 -13.350
  363    HG3  LYS  47           2HG      LYS  47  -1.864  -0.787 -11.859
  364    HD2  LYS  47           1HD      LYS  47  -3.383   0.896 -12.816
  365    HD3  LYS  47           2HD      LYS  47  -2.411   0.924 -14.307
  366    HE2  LYS  47           1HE      LYS  47  -2.902  -1.462 -14.665
  367    HE3  LYS  47           2HE      LYS  47  -3.887  -1.476 -13.185
  368    HZ1  LYS  47           3HZ      LYS  47  -4.430   0.143 -15.590
  369    HZ2  LYS  47           1HZ      LYS  47  -5.241  -1.224 -15.153
  370    HZ3  LYS  47           2HZ      LYS  47  -5.345   0.131 -14.217
  371    H    VAL  48           H        VAL  48   0.614   2.129  -9.285
  372    HA   VAL  48           HA       VAL  48   2.298   4.247 -10.316
  373    HB   VAL  48           HB       VAL  48   1.798   3.288  -7.468
  374   HG11  VAL  48          1HG1      VAL  48   2.708   5.487  -6.797
  375   HG12  VAL  48          2HG1      VAL  48   3.929   4.523  -7.659
  376   HG13  VAL  48          3HG1      VAL  48   3.088   5.849  -8.497
  377   HG21  VAL  48          3HG2      VAL  48  -0.214   4.070  -8.570
  378   HG22  VAL  48          1HG2      VAL  48   0.313   5.225  -7.322
  379   HG23  VAL  48          2HG2      VAL  48   0.607   5.577  -9.042
  380    H    GLU  49           H        GLU  49   4.264   4.253 -10.920
  381    HA   GLU  49           HA       GLU  49   6.022   2.028 -10.656
  382    HB2  GLU  49           1HB      GLU  49   6.208   3.833 -12.335
  383    HB3  GLU  49           2HB      GLU  49   6.722   4.944 -11.042
  384    HG2  GLU  49           1HG      GLU  49   8.777   3.494 -10.669
  385    HG3  GLU  49           2HG      GLU  49   8.100   2.446 -11.935
  386    H    GLY  50           H        GLY  50   7.113   1.224  -9.062
  387    HA2  GLY  50           1HA      GLY  50   8.951   1.818  -7.445
  388    HA3  GLY  50           2HA      GLY  50   7.840   3.047  -6.799
  389    H    VAL  51           H        VAL  51   5.487   1.294  -7.125
  390    HA   VAL  51           HA       VAL  51   5.626  -0.034  -4.515
  391    HB   VAL  51           HB       VAL  51   3.490  -0.094  -6.688
  392   HG11  VAL  51          1HG1      VAL  51   2.020  -0.926  -4.885
  393   HG12  VAL  51          2HG1      VAL  51   3.373  -2.043  -5.175
  394   HG13  VAL  51          3HG1      VAL  51   3.403  -0.954  -3.769
  395   HG21  VAL  51          3HG2      VAL  51   3.850   2.145  -5.833
  396   HG22  VAL  51          1HG2      VAL  51   2.296   1.494  -5.266
  397   HG23  VAL  51          2HG2      VAL  51   3.690   1.553  -4.163
  398    H    LYS  52           H        LYS  52   6.297  -1.915  -4.006
  399    HA   LYS  52           HA       LYS  52   6.847  -3.833  -6.235
  400    HB2  LYS  52           1HB      LYS  52   8.757  -3.098  -4.890
  401    HB3  LYS  52           2HB      LYS  52   7.940  -3.682  -3.420
  402    HG2  LYS  52           1HG      LYS  52   8.017  -5.983  -4.287
  403    HG3  LYS  52           2HG      LYS  52   8.824  -5.403  -5.762
  404    HD2  LYS  52           1HD      LYS  52  10.699  -4.558  -4.373
  405    HD3  LYS  52           2HD      LYS  52   9.902  -5.223  -2.928
  406    HE2  LYS  52           1HE      LYS  52  10.051  -7.476  -3.849
  407    HE3  LYS  52           2HE      LYS  52  10.774  -6.838  -5.344
  408    HZ1  LYS  52           3HZ      LYS  52  11.975  -6.679  -2.653
  409    HZ2  LYS  52           1HZ      LYS  52  12.441  -7.712  -3.851
  410    HZ3  LYS  52           2HZ      LYS  52  12.646  -6.086  -4.038
  411    H    SER  53           H        SER  53   5.546  -3.710  -2.915
  412    HA   SER  53           HA       SER  53   3.929  -6.193  -3.489
  413    HB2  SER  53           1HB      SER  53   5.952  -7.030  -2.696
  414    HB3  SER  53           2HB      SER  53   5.867  -5.978  -1.266
  415    HG   SER  53           HG       SER  53   5.069  -8.086  -0.866
  416    H    ILE  54           H        ILE  54   1.936  -5.987  -2.680
  417    HA   ILE  54           HA       ILE  54   1.535  -4.199  -0.293
  418    HB   ILE  54           HB       ILE  54  -0.434  -4.858  -2.531
  419   HG12  ILE  54          1HG1      ILE  54   0.837  -2.228  -1.822
  420   HG13  ILE  54          2HG1      ILE  54   1.361  -3.294  -3.146
  421   HG21  ILE  54          1HG2      ILE  54  -1.920  -3.263  -1.365
  422   HG22  ILE  54          2HG2      ILE  54  -1.510  -4.641  -0.316
  423   HG23  ILE  54          3HG2      ILE  54  -0.705  -3.072  -0.079
  424   HD11  ILE  54          3HD1      ILE  54  -1.372  -1.988  -2.889
  425   HD12  ILE  54          1HD1      ILE  54  -0.070  -1.471  -3.984
  426   HD13  ILE  54          2HD1      ILE  54  -0.848  -3.055  -4.213
  427    H    PHE  55           H        PHE  55   1.054  -5.113   1.485
  428    HA   PHE  55           HA       PHE  55  -0.190  -7.843   1.365
  429    HB2  PHE  55           1HB      PHE  55   2.137  -7.875   2.242
  430    HB3  PHE  55           2HB      PHE  55   1.673  -6.696   3.489
  431    HD1  PHE  55           HD1      PHE  55   0.649 -10.042   2.181
  432    HD2  PHE  55           HD2      PHE  55   1.104  -7.457   5.552
  433    HE1  PHE  55           HE1      PHE  55  -0.004 -11.892   3.685
  434    HE2  PHE  55           HE2      PHE  55   0.454  -9.305   7.060
  435    HZ   PHE  55           HZ       PHE  55  -0.101 -11.523   6.125
  436    H    HIS  56           H        HIS  56  -2.108  -8.094   2.170
  437    HA   HIS  56           HA       HIS  56  -3.121  -5.992   4.058
  438    HB2  HIS  56           1HB      HIS  56  -4.212  -5.989   1.769
  439    HB3  HIS  56           2HB      HIS  56  -4.781  -7.642   2.105
  440    HD2  HIS  56           HD2      HIS  56  -5.138  -5.202   5.188
  441    HE1  HIS  56           HE1      HIS  56  -8.888  -5.611   3.233
  442    HE2  HIS  56           HE2      HIS  56  -7.589  -4.720   5.336
  443    H    VAL  57           H        VAL  57  -3.410  -6.639   6.025
  444    HA   VAL  57           HA       VAL  57  -4.797  -9.225   6.523
  445    HB   VAL  57           HB       VAL  57  -2.317  -9.726   6.653
  446   HG11  VAL  57          1HG1      VAL  57  -1.084  -8.812   8.591
  447   HG12  VAL  57          2HG1      VAL  57  -1.576  -7.515   7.477
  448   HG13  VAL  57          3HG1      VAL  57  -2.476  -7.778   8.990
  449   HG21  VAL  57          3HG2      VAL  57  -3.946 -11.044   7.870
  450   HG22  VAL  57          1HG2      VAL  57  -2.453 -10.851   8.819
  451   HG23  VAL  57          2HG2      VAL  57  -3.896  -9.890   9.225
  452    H    MET  58           H        MET  58  -6.057  -9.288   8.242
  453    HA   MET  58           HA       MET  58  -7.510  -8.331   9.788
  454    HB2  MET  58           1HB      MET  58  -5.010  -6.800  10.506
  455    HB3  MET  58           2HB      MET  58  -6.502  -6.862  11.475
  456    HG2  MET  58           1HG      MET  58  -4.704  -9.213  10.807
  457    HG3  MET  58           2HG      MET  58  -4.769  -8.362  12.369
  458    HE1  MET  58           3HE      MET  58  -7.770  -7.827  12.919
  459    HE2  MET  58           1HE      MET  58  -8.266  -9.312  13.767
  460    HE3  MET  58           2HE      MET  58  -6.680  -8.578  14.110
  461    H    ASP  59           H        ASP  59  -6.402  -5.365  10.514
  462    HA   ASP  59           HA       ASP  59  -8.015  -4.072   8.337
  463    HB2  ASP  59           1HB      ASP  59  -9.183  -4.176  10.681
  464    HB3  ASP  59           2HB      ASP  59  -7.755  -3.219  11.145
  465    H    PHE  60           H        PHE  60  -5.214  -4.467   8.252
  466    HA   PHE  60           HA       PHE  60  -4.531  -1.633   7.786
  467    HB2  PHE  60           1HB      PHE  60  -2.414  -1.721   8.992
  468    HB3  PHE  60           2HB      PHE  60  -3.729  -2.096  10.130
  469    HD1  PHE  60           HD1      PHE  60  -0.796  -3.359   8.374
  470    HD2  PHE  60           HD2      PHE  60  -4.021  -4.329  11.003
  471    HE1  PHE  60           HE1      PHE  60   0.364  -5.442   9.026
  472    HE2  PHE  60           HE2      PHE  60  -2.862  -6.413  11.659
  473    HZ   PHE  60           HZ       PHE  60  -0.670  -6.969  10.668
  474    H    ILE  61           H        ILE  61  -2.707  -1.324   6.436
  475    HA   ILE  61           HA       ILE  61  -2.009  -3.763   4.822
  476    HB   ILE  61           HB       ILE  61  -2.780  -0.988   3.803
  477   HG12  ILE  61          1HG1      ILE  61  -4.041  -3.675   3.317
  478   HG13  ILE  61          2HG1      ILE  61  -4.644  -2.433   4.438
  479   HG21  ILE  61          1HG2      ILE  61  -2.340  -1.922   1.557
  480   HG22  ILE  61          2HG2      ILE  61  -0.866  -1.931   2.553
  481   HG23  ILE  61          3HG2      ILE  61  -1.774  -3.438   2.296
  482   HD11  ILE  61          3HD1      ILE  61  -4.361  -2.125   1.428
  483   HD12  ILE  61          1HD1      ILE  61  -5.883  -2.387   2.310
  484   HD13  ILE  61          2HD1      ILE  61  -4.963  -0.882   2.550
  485    H    SER  62           H        SER  62  -0.006  -4.118   4.410
  486    HA   SER  62           HA       SER  62   2.029  -1.996   5.099
  487    HB2  SER  62           1HB      SER  62   2.264  -3.945   6.320
  488    HB3  SER  62           2HB      SER  62   2.284  -4.930   4.838
  489    HG   SER  62           HG       SER  62   4.383  -4.466   5.599
  490    H    VAL  63           H        VAL  63   2.917  -0.914   3.463
  491    HA   VAL  63           HA       VAL  63   2.936  -2.178   0.722
  492    HB   VAL  63           HB       VAL  63   2.874   0.769   1.497
  493   HG11  VAL  63          1HG1      VAL  63   2.647   1.142  -0.936
  494   HG12  VAL  63          2HG1      VAL  63   4.177   0.317  -0.554
  495   HG13  VAL  63          3HG1      VAL  63   2.810  -0.606  -1.220
  496   HG21  VAL  63          3HG2      VAL  63   0.730  -0.289   1.885
  497   HG22  VAL  63          1HG2      VAL  63   0.656   0.791   0.474
  498   HG23  VAL  63          2HG2      VAL  63   0.747  -0.970   0.242
  499    H    ASP  64           H        ASP  64   4.755  -2.828   0.013
  500    HA   ASP  64           HA       ASP  64   7.230  -1.436   0.984
  501    HB2  ASP  64           1HB      ASP  64   6.997  -3.967   1.533
  502    HB3  ASP  64           2HB      ASP  64   6.907  -4.101  -0.240
  503    H    LYS  65           H        LYS  65   8.502  -0.424  -0.361
  504    HA   LYS  65           HA       LYS  65   7.738  -0.476  -3.250
  505    HB2  LYS  65           1HB      LYS  65   8.779   1.634  -3.440
  506    HB3  LYS  65           2HB      LYS  65   7.718   1.676  -2.012
  507    HG2  LYS  65           1HG      LYS  65   9.602   1.503  -0.521
  508    HG3  LYS  65           2HG      LYS  65  10.713   1.213  -1.881
  509    HD2  LYS  65           1HD      LYS  65  10.305   3.460  -2.737
  510    HD3  LYS  65           2HD      LYS  65   9.111   3.756  -1.451
  511    HE2  LYS  65           1HE      LYS  65  11.121   4.815  -0.753
  512    HE3  LYS  65           2HE      LYS  65  10.957   3.335   0.220
  513    HZ1  LYS  65           3HZ      LYS  65  12.668   3.638  -2.165
  514    HZ2  LYS  65           1HZ      LYS  65  13.196   3.616  -0.602
  515    HZ3  LYS  65           2HZ      LYS  65  12.517   2.266  -1.263
  516    H    GLU  66           H        GLU  66   9.708   0.168  -4.686
  517    HA   GLU  66           HA       GLU  66  11.769  -1.916  -4.279
  518    HB2  GLU  66           1HB      GLU  66  11.313   0.103  -6.481
  519    HB3  GLU  66           2HB      GLU  66  12.588  -1.138  -6.471
  520    HG2  GLU  66           1HG      GLU  66  10.730  -2.917  -6.428
  521    HG3  GLU  66           2HG      GLU  66   9.626  -1.525  -6.506
  522    H    ASN  67           H        ASN  67  14.041  -1.444  -4.568
  523    HA   ASN  67           HA       ASN  67  14.859   0.477  -2.579
  524    HB2  ASN  67           1HB      ASN  67  16.695  -1.113  -4.525
  525    HB3  ASN  67           2HB      ASN  67  16.943   0.108  -3.254
  526   HD21  ASN  67          2HD2      ASN  67  17.753  -2.736  -3.493
  527   HD22  ASN  67          1HD2      ASN  67  17.168  -3.496  -2.051
  528    H    ASP  68           H        ASP  68  14.827   0.530  -6.115
  529    HA   ASP  68           HA       ASP  68  16.428   2.942  -6.317
  530    HB2  ASP  68           1HB      ASP  68  14.575   1.565  -8.353
  531    HB3  ASP  68           2HB      ASP  68  15.532   3.056  -8.529
  532    H    ALA  69           H        ALA  69  12.944   2.281  -6.273
  533    HA   ALA  69           HA       ALA  69  12.223   5.019  -6.864
  534    HB1  ALA  69           3HB      ALA  69  10.604   2.779  -5.604
  535    HB2  ALA  69           1HB      ALA  69   9.951   4.313  -6.224
  536    HB3  ALA  69           2HB      ALA  69  10.705   3.152  -7.341
  537    H    ASN  70           H        ASN  70  10.877   6.352  -5.398
  538    HA   ASN  70           HA       ASN  70  11.811   6.132  -2.554
  539    HB2  ASN  70           1HB      ASN  70  11.564   8.879  -3.984
  540    HB3  ASN  70           2HB      ASN  70  11.864   8.259  -2.342
  541   HD21  ASN  70          2HD2      ASN  70  13.173   8.908  -5.453
  542   HD22  ASN  70          1HD2      ASN  70  14.814   8.475  -5.104
  543    H    TRP  71           H        TRP  71  10.468   7.139  -0.976
  544    HA   TRP  71           HA       TRP  71   7.639   6.638  -1.453
  545    HB2  TRP  71           1HB      TRP  71   9.217   7.789   0.878
  546    HB3  TRP  71           2HB      TRP  71   7.440   7.671   0.885
  547    HD1  TRP  71           HD1      TRP  71  10.236   5.993   2.051
  548    HE1  TRP  71           HE1      TRP  71   9.768   3.379   2.548
  549    HE3  TRP  71           HE3      TRP  71   5.900   5.518  -0.558
  550    HZ2  TRP  71           HZ2      TRP  71   7.800   1.567   1.855
  551    HZ3  TRP  71           HZ3      TRP  71   4.758   3.388  -0.636
  552    HH2  TRP  71           HH2      TRP  71   5.637   1.413   0.530
  553    H    GLU  72           H        GLU  72   9.712   9.352  -1.860
  554    HA   GLU  72           HA       GLU  72   7.953  11.517  -1.412
  555    HB2  GLU  72           1HB      GLU  72  10.342  11.719  -1.942
  556    HB3  GLU  72           2HB      GLU  72  10.004  11.186  -3.607
  557    HG2  GLU  72           1HG      GLU  72   8.599  13.273  -3.950
  558    HG3  GLU  72           2HG      GLU  72   8.961  13.634  -2.246
  559    H    THR  73           H        THR  73   8.233   9.405  -4.250
  560    HA   THR  73           HA       THR  73   6.017  10.834  -5.590
  561    HB   THR  73           HB       THR  73   7.532   8.305  -6.367
  562    HG1  THR  73           HG1      THR  73   8.501   9.773  -7.890
  563   HG21  THR  73          3HG2      THR  73   5.584  10.037  -7.940
  564   HG22  THR  73          1HG2      THR  73   6.498   8.653  -8.582
  565   HG23  THR  73          2HG2      THR  73   5.258   8.398  -7.331
  566    H    VAL  74           H        VAL  74   6.589   7.644  -4.093
  567    HA   VAL  74           HA       VAL  74   4.022   6.607  -5.028
  568    HB   VAL  74           HB       VAL  74   6.005   5.575  -2.959
  569   HG11  VAL  74          1HG1      VAL  74   4.762   3.445  -3.136
  570   HG12  VAL  74          2HG1      VAL  74   3.719   4.747  -2.517
  571   HG13  VAL  74          3HG1      VAL  74   3.580   4.225  -4.213
  572   HG21  VAL  74          3HG2      VAL  74   6.913   5.633  -5.204
  573   HG22  VAL  74          1HG2      VAL  74   6.609   3.958  -4.688
  574   HG23  VAL  74          2HG2      VAL  74   5.492   4.756  -5.822
  575    H    LEU  75           H        LEU  75   5.162   7.882  -1.901
  576    HA   LEU  75           HA       LEU  75   3.030   6.591  -0.467
  577    HB2  LEU  75           1HB      LEU  75   5.069   7.133   0.465
  578    HB3  LEU  75           2HB      LEU  75   4.890   8.897   0.324
  579    HG   LEU  75           HG       LEU  75   2.866   8.714   1.828
  580   HD11  LEU  75          1HD1      LEU  75   2.700   6.644   3.235
  581   HD12  LEU  75          2HD1      LEU  75   2.458   6.275   1.512
  582   HD13  LEU  75          3HD1      LEU  75   4.017   5.914   2.289
  583   HD21  LEU  75          3HD2      LEU  75   5.000   9.510   2.661
  584   HD22  LEU  75          1HD2      LEU  75   4.188   8.531   3.907
  585   HD23  LEU  75          2HD2      LEU  75   5.536   7.841   2.968
  586    HA   PRO  76           HA       PRO  76   1.083  11.111  -0.467
  587    HB2  PRO  76           2HB      PRO  76   1.717  12.832  -2.010
  588    HB3  PRO  76           1HB      PRO  76   2.013  11.683  -3.323
  589    HG2  PRO  76           1HG      PRO  76   4.222  12.226  -2.627
  590    HG3  PRO  76           2HG      PRO  76   3.769  12.324  -0.921
  591    HD2  PRO  76           1HD      PRO  76   4.220   9.847  -2.630
  592    HD3  PRO  76           2HD      PRO  76   4.663  10.125  -0.941
  593    H    LYS  77           H        LYS  77   1.485   9.179  -3.429
  594    HA   LYS  77           HA       LYS  77  -1.284   9.523  -4.228
  595    HB2  LYS  77           1HB      LYS  77   0.828   7.500  -4.984
  596    HB3  LYS  77           2HB      LYS  77  -0.786   7.597  -5.728
  597    HG2  LYS  77           1HG      LYS  77  -0.291   9.859  -6.538
  598    HG3  LYS  77           2HG      LYS  77   1.313   9.792  -5.771
  599    HD2  LYS  77           1HD      LYS  77   1.902   7.860  -7.198
  600    HD3  LYS  77           2HD      LYS  77   0.309   7.972  -7.986
  601    HE2  LYS  77           1HE      LYS  77   0.853  10.256  -8.741
  602    HE3  LYS  77           2HE      LYS  77   2.452  10.120  -7.977
  603    HZ1  LYS  77           3HZ      LYS  77   1.455   8.426 -10.176
  604    HZ2  LYS  77           1HZ      LYS  77   2.548   9.650 -10.329
  605    HZ3  LYS  77           2HZ      LYS  77   2.938   8.299  -9.466
  606    H    VAL  78           H        VAL  78   0.485   6.898  -2.589
  607    HA   VAL  78           HA       VAL  78  -1.714   5.067  -2.407
  608    HB   VAL  78           HB       VAL  78   0.666   5.497  -0.555
  609   HG11  VAL  78          1HG1      VAL  78   0.150   3.234   0.296
  610   HG12  VAL  78          2HG1      VAL  78  -1.193   4.359   0.611
  611   HG13  VAL  78          3HG1      VAL  78  -1.309   3.185  -0.721
  612   HG21  VAL  78          3HG2      VAL  78   1.305   4.881  -2.809
  613   HG22  VAL  78          1HG2      VAL  78   1.593   3.536  -1.680
  614   HG23  VAL  78          2HG2      VAL  78   0.186   3.497  -2.768
  615    H    GLU  79           H        GLU  79  -0.632   7.521  -0.057
  616    HA   GLU  79           HA       GLU  79  -2.676   7.074   1.854
  617    HB2  GLU  79           1HB      GLU  79  -0.718   8.514   2.193
  618    HB3  GLU  79           2HB      GLU  79  -1.389   9.682   1.030
  619    HG2  GLU  79           1HG      GLU  79  -3.357  10.046   2.608
  620    HG3  GLU  79           2HG      GLU  79  -2.573   8.827   3.638
  621    H    ALA  80           H        ALA  80  -2.699   9.180  -1.016
  622    HA   ALA  80           HA       ALA  80  -5.282  10.275  -0.594
  623    HB1  ALA  80           3HB      ALA  80  -3.866   9.664  -3.211
  624    HB2  ALA  80           1HB      ALA  80  -5.265  10.743  -3.014
  625    HB3  ALA  80           2HB      ALA  80  -3.709  11.159  -2.258
  626    H    VAL  81           H        VAL  81  -4.272   7.221  -2.062
  627    HA   VAL  81           HA       VAL  81  -6.777   6.566  -3.322
  628    HB   VAL  81           HB       VAL  81  -4.523   4.824  -2.247
  629   HG11  VAL  81          1HG1      VAL  81  -5.568   2.985  -3.525
  630   HG12  VAL  81          2HG1      VAL  81  -6.650   3.566  -2.239
  631   HG13  VAL  81          3HG1      VAL  81  -6.939   4.044  -3.929
  632   HG21  VAL  81          3HG2      VAL  81  -3.900   6.235  -4.116
  633   HG22  VAL  81          1HG2      VAL  81  -3.978   4.527  -4.610
  634   HG23  VAL  81          2HG2      VAL  81  -5.292   5.642  -5.052
  635    H    PHE  82           H        PHE  82  -5.581   5.935  -0.046
  636    HA   PHE  82           HA       PHE  82  -8.068   4.476   0.606
  637    HB2  PHE  82           1HB      PHE  82  -5.651   5.249   2.299
  638    HB3  PHE  82           2HB      PHE  82  -7.015   4.252   2.853
  639    HD1  PHE  82           HD1      PHE  82  -3.790   4.232   1.473
  640    HD2  PHE  82           HD2      PHE  82  -7.517   2.144   1.400
  641    HE1  PHE  82           HE1      PHE  82  -2.637   2.203   0.657
  642    HE2  PHE  82           HE2      PHE  82  -6.367   0.114   0.586
  643    HZ   PHE  82           HZ       PHE  82  -3.925   0.145   0.214
  644    H    GLU  83           H        GLU  83  -7.582   7.605   0.085
  645    HA   GLU  83           HA       GLU  83  -9.606   8.321   2.176
  646    HB2  GLU  83           1HB      GLU  83  -8.012  10.025   0.256
  647    HB3  GLU  83           2HB      GLU  83  -9.272  10.629   1.358
  648    HG2  GLU  83           1HG      GLU  83  -7.831   9.819   3.321
  649    HG3  GLU  83           2HG      GLU  83  -6.680   9.320   2.060
  650    H    LEU  84           H        LEU  84  -9.509   6.962  -0.785
  651    HA   LEU  84           HA       LEU  84 -11.468   8.544  -2.215
  652    HB2  LEU  84           1HB      LEU  84 -10.548   5.751  -2.336
  653    HB3  LEU  84           2HB      LEU  84 -11.674   6.338  -3.582
  654    HG   LEU  84           HG       LEU  84  -8.869   7.395  -3.060
  655   HD11  LEU  84          1HD1      LEU  84  -8.344   6.393  -5.299
  656   HD12  LEU  84          2HD1      LEU  84  -8.881   5.151  -4.145
  657   HD13  LEU  84          3HD1      LEU  84 -10.003   5.757  -5.385
  658   HD21  LEU  84          3HD2      LEU  84 -10.367   9.142  -3.821
  659   HD22  LEU  84          1HD2      LEU  84  -9.216   8.723  -5.113
  660   HD23  LEU  84          2HD2      LEU  84 -10.895   8.134  -5.189
  661    H    GLU  85           H        GLU  85 -11.670   5.862   0.063
  662    HA   GLU  85           HA       GLU  85 -13.499   4.713   0.923
  663    HB2  GLU  85           1HB      GLU  85 -14.955   7.265   0.215
  664    HB3  GLU  85           2HB      GLU  85 -15.531   5.986   1.310
  665    HG2  GLU  85           1HG      GLU  85 -13.566   6.524   2.860
  666    HG3  GLU  85           2HG      GLU  85 -13.151   7.762   1.653
  667    H    HIS  86           H        HIS  86 -12.845   4.327  -1.829
  668    HA   HIS  86           HA       HIS  86 -15.554   3.880  -3.025
  669    HB2  HIS  86           1HB      HIS  86 -12.783   4.015  -4.295
  670    HB3  HIS  86           2HB      HIS  86 -14.264   3.553  -5.167
  671    HD2  HIS  86           HD2      HIS  86 -15.829   6.321  -3.363
  672    HE1  HIS  86           HE1      HIS  86 -13.436   8.247  -6.298
  673    HE2  HIS  86           HE2      HIS  86 -15.406   8.470  -4.571
  674    H    HIS  87           H        HIS  87 -15.545   2.141  -1.259
  675    HA   HIS  87           HA       HIS  87 -14.010  -0.217  -1.479
  676    HB2  HIS  87           1HB      HIS  87 -15.743   0.364   0.322
  677    HB3  HIS  87           2HB      HIS  87 -16.982  -0.180  -0.832
  678    HD1  HIS  87           HD1      HIS  87 -16.667  -2.746  -1.677
  679    HD2  HIS  87           HD2      HIS  87 -14.621  -1.722   1.862
  680    HE1  HIS  87           HE1      HIS  87 -16.209  -4.854  -0.529
  681    H    HIS  88           H        HIS  88 -13.938  -1.944  -2.724
  682    HA   HIS  88           HA       HIS  88 -14.931  -1.741  -5.398
  683    HB2  HIS  88           1HB      HIS  88 -14.060  -4.005  -5.699
  684    HB3  HIS  88           2HB      HIS  88 -12.913  -3.084  -4.695
  685    HD1  HIS  88           HD1      HIS  88 -15.502  -5.825  -4.492
  686    HD2  HIS  88           HD2      HIS  88 -12.412  -4.215  -2.120
  687    HE1  HIS  88           HE1      HIS  88 -15.293  -7.307  -2.560
  688    H    HIS  89           H        HIS  89 -16.332  -3.173  -6.543
  689    HA   HIS  89           HA       HIS  89 -18.847  -3.560  -5.044
  690    HB2  HIS  89           1HB      HIS  89 -19.877  -3.870  -7.199
  691    HB3  HIS  89           2HB      HIS  89 -18.720  -2.532  -7.390
  692    HD1  HIS  89           HD1      HIS  89 -19.311  -6.120  -8.343
  693    HD2  HIS  89           HD2      HIS  89 -16.610  -3.025  -9.282
  694    HE1  HIS  89           HE1      HIS  89 -17.974  -6.938 -10.218
  695    H    HIS  90           H        HIS  90 -20.161  -5.552  -5.754
  696    HA   HIS  90           HA       HIS  90 -18.395  -7.957  -5.436
  697    HB2  HIS  90           1HB      HIS  90 -21.143  -7.482  -4.194
  698    HB3  HIS  90           2HB      HIS  90 -20.169  -8.964  -4.047
  699    HD1  HIS  90           HD1      HIS  90 -17.782  -8.612  -2.800
  700    HD2  HIS  90           HD2      HIS  90 -20.626  -5.564  -2.181
  701    HE1  HIS  90           HE1      HIS  90 -17.094  -7.451  -0.763
  702    H    HIS  91           H        HIS  91 -19.711 -10.017  -5.896
  703    HA   HIS  91           HA       HIS  91 -21.086  -9.571  -8.525
  704    HB2  HIS  91           1HB      HIS  91 -19.417 -11.949  -7.588
  705    HB3  HIS  91           2HB      HIS  91 -20.260 -11.826  -9.150
  706    HD1  HIS  91           HD1      HIS  91 -19.287 -10.191 -10.913
  707    HD2  HIS  91           HD2      HIS  91 -16.917 -10.493  -7.441
  708    HE1  HIS  91           HE1      HIS  91 -17.101  -9.276 -11.508
  Start of MODEL   13
    1    H1   MET   1           1H       MET   1 -13.260   1.972   1.394
    2    H2   MET   1           2H       MET   1 -13.545   1.838   2.860
    3    H3   MET   1           3H       MET   1 -13.348   3.197   2.255
    4    HA   MET   1           HA       MET   1 -11.292   1.642   3.442
    5    HB2  MET   1           1HB      MET   1 -11.106   1.994   0.458
    6    HB3  MET   1           2HB      MET   1  -9.683   1.730   1.493
    7    HG2  MET   1           1HG      MET   1 -10.546  -0.427   2.196
    8    HG3  MET   1           2HG      MET   1 -12.047  -0.157   1.279
    9    HE1  MET   1           3HE      MET   1  -8.312  -1.198   1.196
   10    HE2  MET   1           1HE      MET   1  -7.884  -1.059  -0.525
   11    HE3  MET   1           2HE      MET   1  -8.198   0.406   0.434
   12    H    LYS   2           H        LYS   2 -10.925   3.290   4.775
   13    HA   LYS   2           HA       LYS   2  -9.907   5.820   3.530
   14    HB2  LYS   2           1HB      LYS   2 -12.214   6.113   4.316
   15    HB3  LYS   2           2HB      LYS   2 -11.723   5.554   5.933
   16    HG2  LYS   2           1HG      LYS   2 -10.233   7.486   6.166
   17    HG3  LYS   2           2HG      LYS   2 -10.674   8.038   4.532
   18    HD2  LYS   2           1HD      LYS   2 -13.017   8.288   5.246
   19    HD3  LYS   2           2HD      LYS   2 -12.578   7.735   6.880
   20    HE2  LYS   2           1HE      LYS   2 -11.085   9.652   7.148
   21    HE3  LYS   2           2HE      LYS   2 -11.462  10.195   5.497
   22    HZ1  LYS   2           3HZ      LYS   2 -13.394   9.990   7.718
   23    HZ2  LYS   2           1HZ      LYS   2 -12.741  11.391   7.141
   24    HZ3  LYS   2           2HZ      LYS   2 -13.744  10.493   6.186
   25    H    ILE   3           H        ILE   3  -8.242   6.834   4.488
   26    HA   ILE   3           HA       ILE   3  -6.541   5.130   6.160
   27    HB   ILE   3           HB       ILE   3  -6.232   8.003   5.174
   28   HG12  ILE   3          1HG1      ILE   3  -4.801   5.518   4.281
   29   HG13  ILE   3          2HG1      ILE   3  -6.258   6.166   3.495
   30   HG21  ILE   3          1HG2      ILE   3  -3.876   7.783   5.888
   31   HG22  ILE   3          2HG2      ILE   3  -4.981   7.626   7.272
   32   HG23  ILE   3          3HG2      ILE   3  -4.230   6.176   6.566
   33   HD11  ILE   3          3HD1      ILE   3  -3.607   7.620   3.797
   34   HD12  ILE   3          1HD1      ILE   3  -4.219   6.869   2.305
   35   HD13  ILE   3          2HD1      ILE   3  -5.067   8.268   3.012
   36    H    ILE   4           H        ILE   4  -6.234   5.057   8.220
   37    HA   ILE   4           HA       ILE   4  -7.397   7.257   9.901
   38    HB   ILE   4           HB       ILE   4  -6.477   4.438  10.625
   39   HG12  ILE   4          1HG1      ILE   4  -9.217   5.674  10.669
   40   HG13  ILE   4          2HG1      ILE   4  -8.593   4.575   9.417
   41   HG21  ILE   4          1HG2      ILE   4  -7.308   4.974  12.890
   42   HG22  ILE   4          2HG2      ILE   4  -5.980   6.060  12.421
   43   HG23  ILE   4          3HG2      ILE   4  -7.662   6.637  12.367
   44   HD11  ILE   4          3HD1      ILE   4  -8.954   3.899  12.357
   45   HD12  ILE   4          1HD1      ILE   4 -10.014   3.371  11.030
   46   HD13  ILE   4          2HD1      ILE   4  -8.330   2.800  11.104
   47    H    SER   5           H        SER   5  -4.434   5.345   9.458
   48    HA   SER   5           HA       SER   5  -2.775   7.685  10.259
   49    HB2  SER   5           1HB      SER   5  -3.453   7.022  12.373
   50    HB3  SER   5           2HB      SER   5  -2.959   5.343  12.055
   51    HG   SER   5           HG       SER   5  -1.364   6.539  13.181
   52    H    ILE   6           H        ILE   6  -0.998   7.589   9.044
   53    HA   ILE   6           HA       ILE   6  -0.009   4.905   8.120
   54    HB   ILE   6           HB       ILE   6   0.562   7.715   7.067
   55   HG12  ILE   6          1HG1      ILE   6  -0.920   5.440   5.776
   56   HG13  ILE   6          2HG1      ILE   6  -1.680   6.828   6.589
   57   HG21  ILE   6          1HG2      ILE   6   1.802   6.547   5.277
   58   HG22  ILE   6          2HG2      ILE   6   2.515   6.213   6.872
   59   HG23  ILE   6          3HG2      ILE   6   1.497   4.989   6.080
   60   HD11  ILE   6          3HD1      ILE   6   0.128   6.969   4.151
   61   HD12  ILE   6          1HD1      ILE   6  -1.641   7.141   4.145
   62   HD13  ILE   6          2HD1      ILE   6  -0.633   8.355   4.965
   63    H    SER   7           H        SER   7   1.793   4.072   8.739
   64    HA   SER   7           HA       SER   7   3.714   5.775  10.348
   65    HB2  SER   7           1HB      SER   7   3.881   4.209  12.015
   66    HB3  SER   7           2HB      SER   7   2.201   4.767  11.859
   67    HG   SER   7           HG       SER   7   2.360   2.499  12.133
   68    H    GLU   8           H        GLU   8   5.804   4.780  10.586
   69    HA   GLU   8           HA       GLU   8   6.578   3.266   8.154
   70    HB2  GLU   8           1HB      GLU   8   8.186   4.562  10.359
   71    HB3  GLU   8           2HB      GLU   8   8.875   3.710   8.954
   72    HG2  GLU   8           1HG      GLU   8   7.815   5.455   7.436
   73    HG3  GLU   8           2HG      GLU   8   7.153   6.154   8.931
   74    H    THR   9           H        THR   9   8.346   1.624   8.432
   75    HA   THR   9           HA       THR   9   7.722  -0.146  10.771
   76    HB   THR   9           HB       THR   9   7.637  -2.080   9.375
   77    HG1  THR   9           HG1      THR   9   7.953  -0.717   6.959
   78   HG21  THR   9          3HG2      THR   9   6.112   0.146   7.963
   79   HG22  THR   9          1HG2      THR   9   5.771  -1.594   7.830
   80   HG23  THR   9          2HG2      THR   9   5.547  -0.760   9.386
   81    HA   PRO  10           HA       PRO  10  11.945  -0.874  11.479
   82    HB2  PRO  10           2HB      PRO  10  12.215  -3.098  12.303
   83    HB3  PRO  10           1HB      PRO  10  11.469  -3.825  10.872
   84    HG2  PRO  10           1HG      PRO  10   9.728  -4.039  12.464
   85    HG3  PRO  10           2HG      PRO  10  10.129  -2.513  13.263
   86    HD2  PRO  10           1HD      PRO  10   8.626  -2.959  10.656
   87    HD3  PRO  10           2HD      PRO  10   8.331  -1.755  11.915
   88    H    ASN  11           H        ASN  11  10.588  -2.474   8.627
   89    HA   ASN  11           HA       ASN  11  13.177  -1.911   7.229
   90    HB2  ASN  11           1HB      ASN  11  12.011  -4.336   6.929
   91    HB3  ASN  11           2HB      ASN  11  10.814  -3.189   6.280
   92   HD21  ASN  11          2HD2      ASN  11  12.160  -5.396   4.966
   93   HD22  ASN  11          1HD2      ASN  11  12.999  -4.719   3.609
   94    H    HIS  12           H        HIS  12  13.353  -0.021   6.331
   95    HA   HIS  12           HA       HIS  12  11.079   1.733   6.099
   96    HB2  HIS  12           1HB      HIS  12  12.642   3.372   5.293
   97    HB3  HIS  12           2HB      HIS  12  13.527   2.410   6.500
   98    HD2  HIS  12           HD2      HIS  12  13.796   3.355   2.681
   99    HE1  HIS  12           HE1      HIS  12  16.801   0.521   3.671
  100    HE2  HIS  12           HE2      HIS  12  15.869   2.207   1.883
  101    H    ASN  13           H        ASN  13  12.285  -0.688   4.043
  102    HA   ASN  13           HA       ASN  13  11.628   0.480   1.490
  103    HB2  ASN  13           1HB      ASN  13  11.872  -2.543   2.185
  104    HB3  ASN  13           2HB      ASN  13  11.435  -1.611   0.733
  105   HD21  ASN  13          2HD2      ASN  13  13.695  -3.412   1.287
  106   HD22  ASN  13          1HD2      ASN  13  15.121  -2.484   0.959
  107    H    THR  14           H        THR  14   9.715  -1.043   3.980
  108    HA   THR  14           HA       THR  14   7.305  -0.602   2.245
  109    HB   THR  14           HB       THR  14   7.580  -3.008   2.567
  110    HG1  THR  14           HG1      THR  14   5.588  -3.355   3.751
  111   HG21  THR  14          3HG2      THR  14   7.633  -2.357   5.542
  112   HG22  THR  14          1HG2      THR  14   7.604  -3.989   4.834
  113   HG23  THR  14          2HG2      THR  14   9.014  -2.934   4.579
  114    H    MET  15           H        MET  15   5.419   0.112   3.219
  115    HA   MET  15           HA       MET  15   5.849   1.414   5.887
  116    HB2  MET  15           1HB      MET  15   6.167   3.028   4.082
  117    HB3  MET  15           2HB      MET  15   4.570   2.601   3.424
  118    HG2  MET  15           1HG      MET  15   3.478   3.463   5.418
  119    HG3  MET  15           2HG      MET  15   5.057   3.802   6.166
  120    HE1  MET  15           3HE      MET  15   6.855   5.142   4.133
  121    HE2  MET  15           1HE      MET  15   6.392   6.857   4.245
  122    HE3  MET  15           2HE      MET  15   6.494   5.865   5.721
  123    H    LYS  16           H        LYS  16   4.119   1.637   7.219
  124    HA   LYS  16           HA       LYS  16   1.942  -0.304   6.596
  125    HB2  LYS  16           1HB      LYS  16   3.213  -0.696   8.617
  126    HB3  LYS  16           2HB      LYS  16   2.876   0.957   9.178
  127    HG2  LYS  16           1HG      LYS  16   0.464   0.411   9.284
  128    HG3  LYS  16           2HG      LYS  16   0.835  -1.254   8.779
  129    HD2  LYS  16           1HD      LYS  16   2.160  -1.614  10.783
  130    HD3  LYS  16           2HD      LYS  16   1.941   0.084  11.269
  131    HE2  LYS  16           1HE      LYS  16  -0.477  -0.275  11.466
  132    HE3  LYS  16           2HE      LYS  16  -0.274  -1.967  10.958
  133    HZ1  LYS  16           3HZ      LYS  16   0.867  -0.761  13.398
  134    HZ2  LYS  16           1HZ      LYS  16  -0.438  -1.769  13.346
  135    HZ3  LYS  16           2HZ      LYS  16   1.056  -2.330  12.926
  136    H    ILE  17           H        ILE  17  -0.064   0.229   6.246
  137    HA   ILE  17           HA       ILE  17  -0.928   3.030   6.927
  138    HB   ILE  17           HB       ILE  17  -1.752   1.343   4.518
  139   HG12  ILE  17          1HG1      ILE  17  -0.141   3.880   4.595
  140   HG13  ILE  17          2HG1      ILE  17   0.534   2.245   4.409
  141   HG21  ILE  17          1HG2      ILE  17  -2.976   3.377   3.830
  142   HG22  ILE  17          2HG2      ILE  17  -3.565   2.774   5.396
  143   HG23  ILE  17          3HG2      ILE  17  -2.483   4.183   5.336
  144   HD11  ILE  17          3HD1      ILE  17  -1.411   3.593   2.503
  145   HD12  ILE  17          1HD1      ILE  17   0.332   3.377   2.230
  146   HD13  ILE  17          2HD1      ILE  17  -0.737   1.958   2.317
  147    H    THR  18           H        THR  18  -2.134   2.948   8.614
  148    HA   THR  18           HA       THR  18  -3.930   0.663   9.088
  149    HB   THR  18           HB       THR  18  -3.611   3.297  10.589
  150    HG1  THR  18           HG1      THR  18  -2.462   1.915  12.068
  151   HG21  THR  18          3HG2      THR  18  -5.034   0.714  11.346
  152   HG22  THR  18          1HG2      THR  18  -4.826   2.133  12.398
  153   HG23  THR  18          2HG2      THR  18  -5.825   2.250  10.928
  154    H    LEU  19           H        LEU  19  -5.899   0.431   8.418
  155    HA   LEU  19           HA       LEU  19  -7.272   2.854   7.303
  156    HB2  LEU  19           1HB      LEU  19  -7.427  -0.003   6.595
  157    HB3  LEU  19           2HB      LEU  19  -8.401   1.208   5.728
  158    HG   LEU  19           HG       LEU  19  -5.366   0.994   5.725
  159   HD11  LEU  19          1HD1      LEU  19  -5.669   0.425   3.300
  160   HD12  LEU  19          2HD1      LEU  19  -6.489  -0.753   4.349
  161   HD13  LEU  19          3HD1      LEU  19  -7.433   0.505   3.518
  162   HD21  LEU  19          3HD2      LEU  19  -6.090   3.305   5.617
  163   HD22  LEU  19          1HD2      LEU  19  -5.441   2.798   4.039
  164   HD23  LEU  19          2HD2      LEU  19  -7.201   2.923   4.279
  165    H    SER  20           H        SER  20  -9.545   2.983   7.437
  166    HA   SER  20           HA       SER  20 -10.852   1.719   9.762
  167    HB2  SER  20           1HB      SER  20 -12.764   2.834   9.102
  168    HB3  SER  20           2HB      SER  20 -11.360   3.924   9.143
  169    HG   SER  20           HG       SER  20 -12.867   4.034   7.271
  170    H    GLU  21           H        GLU  21 -11.471   1.643   6.207
  171    HA   GLU  21           HA       GLU  21 -12.115  -1.271   6.506
  172    HB2  GLU  21           1HB      GLU  21 -12.766   0.692   4.303
  173    HB3  GLU  21           2HB      GLU  21 -13.101  -1.055   4.254
  174    HG2  GLU  21           1HG      GLU  21 -14.760  -0.829   6.085
  175    HG3  GLU  21           2HG      GLU  21 -14.139   0.820   6.331
  176    H    SER  22           H        SER  22 -10.818  -2.745   5.754
  177    HA   SER  22           HA       SER  22  -8.341  -1.910   4.271
  178    HB2  SER  22           1HB      SER  22  -7.385  -3.826   4.906
  179    HB3  SER  22           2HB      SER  22  -8.242  -3.200   6.333
  180    HG   SER  22           HG       SER  22  -9.586  -5.004   4.690
  181    H    ARG  23           H        ARG  23  -7.666  -4.070   2.875
  182    HA   ARG  23           HA       ARG  23  -9.227  -4.722   0.688
  183    HB2  ARG  23           1HB      ARG  23  -7.067  -5.642   1.043
  184    HB3  ARG  23           2HB      ARG  23  -7.688  -6.639   2.381
  185    HG2  ARG  23           1HG      ARG  23  -9.195  -7.786   0.768
  186    HG3  ARG  23           2HG      ARG  23  -8.448  -6.848  -0.548
  187    HD2  ARG  23           1HD      ARG  23  -7.532  -9.033  -0.505
  188    HD3  ARG  23           2HD      ARG  23  -6.293  -7.865   0.009
  189    HE   ARG  23           HE       ARG  23  -6.337  -8.967   2.236
  190   HH11  ARG  23          1HH1      ARG  23  -8.855 -10.235   0.184
  191   HH12  ARG  23          2HH1      ARG  23  -9.076 -11.586   1.281
  192   HH21  ARG  23          2HH2      ARG  23  -7.783 -11.738   3.175
  193   HH22  ARG  23          1HH2      ARG  23  -6.584 -10.501   3.505
  194    H    GLU  24           H        GLU  24 -10.793  -6.219   0.148
  195    HA   GLU  24           HA       GLU  24 -13.139  -6.067   1.603
  196    HB2  GLU  24           1HB      GLU  24 -12.903  -6.933  -0.699
  197    HB3  GLU  24           2HB      GLU  24 -12.248  -8.448  -0.030
  198    HG2  GLU  24           1HG      GLU  24 -14.484  -8.810   1.158
  199    HG3  GLU  24           2HG      GLU  24 -14.964  -7.275   0.397
  200    H    GLY  25           H        GLY  25 -11.036  -8.965   1.659
  201    HA2  GLY  25           1HA      GLY  25 -12.314  -9.887   4.127
  202    HA3  GLY  25           2HA      GLY  25 -10.955 -10.657   3.273
  203    H    MET  26           H        MET  26 -11.170 -10.292   6.106
  204    HA   MET  26           HA       MET  26  -9.045  -8.243   6.625
  205    HB2  MET  26           1HB      MET  26 -10.946  -9.667   8.487
  206    HB3  MET  26           2HB      MET  26  -9.681  -8.516   8.982
  207    HG2  MET  26           1HG      MET  26 -12.014  -7.854   7.161
  208    HG3  MET  26           2HG      MET  26 -11.974  -7.530   8.909
  209    HE1  MET  26           3HE      MET  26 -12.669  -4.993   7.873
  210    HE2  MET  26           1HE      MET  26 -11.543  -4.049   6.868
  211    HE3  MET  26           2HE      MET  26 -12.319  -5.509   6.205
  212    H    THR  27           H        THR  27  -9.012 -11.219   5.625
  213    HA   THR  27           HA       THR  27  -7.135 -12.342   7.612
  214    HB   THR  27           HB       THR  27  -6.929 -14.221   6.059
  215    HG1  THR  27           HG1      THR  27  -8.110 -14.134   4.065
  216   HG21  THR  27          3HG2      THR  27  -9.817 -13.294   6.310
  217   HG22  THR  27          1HG2      THR  27  -9.284 -14.961   5.997
  218   HG23  THR  27          2HG2      THR  27  -8.900 -14.180   7.549
  219    H    SER  28           H        SER  28  -5.037 -13.229   6.790
  220    HA   SER  28           HA       SER  28  -3.393 -11.053   5.656
  221    HB2  SER  28           1HB      SER  28  -1.585 -12.373   6.053
  222    HB3  SER  28           2HB      SER  28  -2.665 -12.426   7.466
  223    HG   SER  28           HG       SER  28  -1.844 -14.487   6.897
  224    H    ASP  29           H        ASP  29  -2.441 -10.985   3.675
  225    HA   ASP  29           HA       ASP  29  -2.349 -13.245   1.864
  226    HB2  ASP  29           1HB      ASP  29  -4.864 -12.153   1.763
  227    HB3  ASP  29           2HB      ASP  29  -3.875 -11.002   0.832
  228    H    THR  30           H        THR  30  -1.311 -12.788  -0.135
  229    HA   THR  30           HA       THR  30   0.206 -10.200  -0.089
  230    HB   THR  30           HB       THR  30   1.313 -12.946  -0.808
  231    HG1  THR  30           HG1      THR  30   2.589 -12.570   1.100
  232   HG21  THR  30          3HG2      THR  30   2.637 -10.211  -0.634
  233   HG22  THR  30          1HG2      THR  30   3.465 -11.749  -0.973
  234   HG23  THR  30          2HG2      THR  30   2.281 -11.101  -2.134
  235    H    TYR  31           H        TYR  31   0.178  -9.057  -1.853
  236    HA   TYR  31           HA       TYR  31  -0.430 -10.451  -4.437
  237    HB2  TYR  31           1HB      TYR  31  -1.520  -7.809  -3.450
  238    HB3  TYR  31           2HB      TYR  31  -1.684  -8.435  -5.108
  239    HD1  TYR  31           HD1      TYR  31  -2.899  -8.659  -1.666
  240    HD2  TYR  31           HD2      TYR  31  -3.116 -10.407  -5.550
  241    HE1  TYR  31           HE1      TYR  31  -4.952  -9.875  -0.996
  242    HE2  TYR  31           HE2      TYR  31  -5.164 -11.628  -4.897
  243    HH   TYR  31           HH       TYR  31  -6.187 -12.063  -1.773
  244    H    THR  32           H        THR  32   0.619  -9.794  -6.219
  245    HA   THR  32           HA       THR  32   2.611  -7.580  -5.856
  246    HB   THR  32           HB       THR  32   4.171  -8.830  -7.295
  247    HG1  THR  32           HG1      THR  32   3.646 -11.044  -7.774
  248   HG21  THR  32          3HG2      THR  32   3.183 -10.483  -4.938
  249   HG22  THR  32          1HG2      THR  32   4.780 -10.620  -5.706
  250   HG23  THR  32          2HG2      THR  32   4.331  -9.128  -4.847
  251    H    LYS  33           H        LYS  33   0.183  -9.094  -7.796
  252    HA   LYS  33           HA       LYS  33   0.749  -7.121  -9.990
  253    HB2  LYS  33           1HB      LYS  33  -0.311  -9.945 -10.164
  254    HB3  LYS  33           2HB      LYS  33  -0.268  -8.785 -11.514
  255    HG2  LYS  33           1HG      LYS  33   2.200  -8.693 -11.332
  256    HG3  LYS  33           2HG      LYS  33   2.135  -9.898 -10.023
  257    HD2  LYS  33           1HD      LYS  33   1.112 -11.522 -11.555
  258    HD3  LYS  33           2HD      LYS  33   1.148 -10.319 -12.864
  259    HE2  LYS  33           1HE      LYS  33   3.606 -10.226 -12.699
  260    HE3  LYS  33           2HE      LYS  33   3.557 -11.454 -11.413
  261    HZ1  LYS  33           3HZ      LYS  33   2.640 -11.844 -14.189
  262    HZ2  LYS  33           1HZ      LYS  33   4.046 -12.428 -13.553
  263    HZ3  LYS  33           2HZ      LYS  33   2.595 -12.983 -12.997
  264    H    VAL  34           H        VAL  34  -0.955  -6.177 -11.047
  265    HA   VAL  34           HA       VAL  34  -3.324  -5.651  -9.457
  266    HB   VAL  34           HB       VAL  34  -2.693  -5.131 -12.392
  267   HG11  VAL  34          1HG1      VAL  34  -4.638  -3.605 -12.332
  268   HG12  VAL  34          2HG1      VAL  34  -5.131  -5.287 -12.014
  269   HG13  VAL  34          3HG1      VAL  34  -4.997  -4.127 -10.669
  270   HG21  VAL  34          3HG2      VAL  34  -1.255  -3.917 -10.864
  271   HG22  VAL  34          1HG2      VAL  34  -2.398  -2.816 -11.668
  272   HG23  VAL  34          2HG2      VAL  34  -2.677  -3.309  -9.981
  273    H    ASP  35           H        ASP  35  -5.312  -6.376  -9.456
  274    HA   ASP  35           HA       ASP  35  -6.186  -8.424 -11.371
  275    HB2  ASP  35           1HB      ASP  35  -4.636  -9.594  -9.519
  276    HB3  ASP  35           2HB      ASP  35  -6.046  -9.136  -8.533
  277    H    ASP  36           H        ASP  36  -8.338  -8.817 -11.357
  278    HA   ASP  36           HA       ASP  36  -9.947  -6.651 -10.336
  279    HB2  ASP  36           1HB      ASP  36 -10.759  -9.337 -11.602
  280    HB3  ASP  36           2HB      ASP  36 -11.793  -8.016 -11.004
  281    H    SER  37           H        SER  37  -8.995  -9.704  -9.015
  282    HA   SER  37           HA       SER  37 -11.166 -10.094  -7.112
  283    HB2  SER  37           1HB      SER  37  -9.823 -11.640  -6.084
  284    HB3  SER  37           2HB      SER  37  -9.745 -11.836  -7.849
  285    HG   SER  37           HG       SER  37  -7.717 -10.993  -7.850
  286    H    GLN  38           H        GLN  38  -8.489  -7.887  -7.298
  287    HA   GLN  38           HA       GLN  38  -8.583  -7.346  -4.372
  288    HB2  GLN  38           1HB      GLN  38  -6.878  -6.165  -6.575
  289    HB3  GLN  38           2HB      GLN  38  -6.732  -5.815  -4.838
  290    HG2  GLN  38           1HG      GLN  38  -6.004  -8.394  -4.534
  291    HG3  GLN  38           2HG      GLN  38  -6.416  -8.310  -6.263
  292   HE21  GLN  38          2HE2      GLN  38  -4.688  -8.298  -7.528
  293   HE22  GLN  38          1HE2      GLN  38  -3.164  -7.555  -7.168
  294    HA   PRO  39           HA       PRO  39 -11.097  -3.668  -4.563
  295    HB2  PRO  39           2HB      PRO  39 -10.558  -2.496  -2.564
  296    HB3  PRO  39           1HB      PRO  39  -8.824  -2.503  -2.915
  297    HG2  PRO  39           1HG      PRO  39  -8.951  -4.144  -1.213
  298    HG3  PRO  39           2HG      PRO  39 -10.541  -4.715  -1.738
  299    HD2  PRO  39           1HD      PRO  39  -7.811  -5.291  -2.964
  300    HD3  PRO  39           2HD      PRO  39  -9.176  -6.390  -2.734
  301    H    ALA  40           H        ALA  40 -11.244  -2.135  -5.976
  302    HA   ALA  40           HA       ALA  40  -9.315  -1.490  -7.893
  303    HB1  ALA  40           3HB      ALA  40 -11.430   0.334  -6.701
  304    HB2  ALA  40           1HB      ALA  40 -10.577   0.596  -8.239
  305    HB3  ALA  40           2HB      ALA  40 -11.664  -0.799  -8.052
  306    H    PHE  41           H        PHE  41  -9.774  -0.066  -4.675
  307    HA   PHE  41           HA       PHE  41  -7.789   1.946  -4.782
  308    HB2  PHE  41           1HB      PHE  41  -8.670   0.124  -2.509
  309    HB3  PHE  41           2HB      PHE  41  -7.540   1.481  -2.298
  310    HD1  PHE  41           HD1      PHE  41 -10.976   0.625  -3.417
  311    HD2  PHE  41           HD2      PHE  41  -8.311   3.628  -1.958
  312    HE1  PHE  41           HE1      PHE  41 -12.885   2.164  -3.102
  313    HE2  PHE  41           HE2      PHE  41 -10.217   5.169  -1.638
  314    HZ   PHE  41           HZ       PHE  41 -12.505   4.437  -2.212
  315    H    ILE  42           H        ILE  42  -7.383  -1.480  -3.848
  316    HA   ILE  42           HA       ILE  42  -4.523  -1.237  -3.465
  317    HB   ILE  42           HB       ILE  42  -6.267  -3.677  -4.039
  318   HG12  ILE  42          1HG1      ILE  42  -6.902  -2.567  -2.022
  319   HG13  ILE  42          2HG1      ILE  42  -6.101  -4.119  -1.678
  320   HG21  ILE  42          1HG2      ILE  42  -4.355  -4.980  -3.169
  321   HG22  ILE  42          2HG2      ILE  42  -3.898  -4.069  -4.627
  322   HG23  ILE  42          3HG2      ILE  42  -3.403  -3.484  -3.021
  323   HD11  ILE  42          3HD1      ILE  42  -4.826  -1.371  -1.451
  324   HD12  ILE  42          1HD1      ILE  42  -5.382  -2.375  -0.093
  325   HD13  ILE  42          2HD1      ILE  42  -4.024  -2.922  -1.107
  326    H    ASN  43           H        ASN  43  -6.506  -1.962  -6.267
  327    HA   ASN  43           HA       ASN  43  -4.325  -2.857  -7.934
  328    HB2  ASN  43           1HB      ASN  43  -7.080  -1.724  -8.838
  329    HB3  ASN  43           2HB      ASN  43  -5.593  -2.238  -9.675
  330   HD21  ASN  43          2HD2      ASN  43  -8.462  -3.264  -9.411
  331   HD22  ASN  43          1HD2      ASN  43  -8.261  -4.954  -9.088
  332    H    ASP  44           H        ASP  44  -5.890   0.328  -7.549
  333    HA   ASP  44           HA       ASP  44  -4.188   1.762  -9.323
  334    HB2  ASP  44           1HB      ASP  44  -5.625   2.695  -6.768
  335    HB3  ASP  44           2HB      ASP  44  -4.615   3.639  -7.889
  336    H    ILE  45           H        ILE  45  -3.782   1.016  -5.868
  337    HA   ILE  45           HA       ILE  45  -1.354   2.511  -5.516
  338    HB   ILE  45           HB       ILE  45  -2.399   0.017  -4.103
  339   HG12  ILE  45          1HG1      ILE  45  -2.340   2.860  -3.142
  340   HG13  ILE  45          2HG1      ILE  45  -3.723   2.134  -3.997
  341   HG21  ILE  45          1HG2      ILE  45  -0.754   0.558  -2.340
  342   HG22  ILE  45          2HG2      ILE  45   0.056   0.200  -3.882
  343   HG23  ILE  45          3HG2      ILE  45  -0.118   1.886  -3.340
  344   HD11  ILE  45          3HD1      ILE  45  -2.549   1.166  -1.364
  345   HD12  ILE  45          1HD1      ILE  45  -4.059   2.085  -1.556
  346   HD13  ILE  45          2HD1      ILE  45  -3.929   0.439  -2.219
  347    H    LEU  46           H        LEU  46  -1.870  -0.863  -6.490
  348    HA   LEU  46           HA       LEU  46   0.873  -1.549  -6.791
  349    HB2  LEU  46           1HB      LEU  46  -1.600  -2.257  -8.210
  350    HB3  LEU  46           2HB      LEU  46  -0.111  -3.125  -8.646
  351    HG   LEU  46           HG       LEU  46  -1.379  -3.090  -5.881
  352   HD11  LEU  46          1HD1      LEU  46  -1.979  -5.476  -6.369
  353   HD12  LEU  46          2HD1      LEU  46  -2.757  -4.364  -7.521
  354   HD13  LEU  46          3HD1      LEU  46  -1.318  -5.290  -8.010
  355   HD21  LEU  46          3HD2      LEU  46   1.029  -3.362  -5.819
  356   HD22  LEU  46          1HD2      LEU  46   0.235  -4.892  -5.379
  357   HD23  LEU  46          2HD2      LEU  46   0.940  -4.689  -7.001
  358    H    LYS  47           H        LYS  47  -1.299   0.250  -8.916
  359    HA   LYS  47           HA       LYS  47   0.609   0.232 -11.139
  360    HB2  LYS  47           1HB      LYS  47  -1.933   1.774 -10.602
  361    HB3  LYS  47           2HB      LYS  47  -0.971   1.915 -12.093
  362    HG2  LYS  47           1HG      LYS  47  -1.343  -0.481 -12.550
  363    HG3  LYS  47           2HG      LYS  47  -2.326  -0.604 -11.071
  364    HD2  LYS  47           1HD      LYS  47  -3.911   1.044 -11.984
  365    HD3  LYS  47           2HD      LYS  47  -2.928   1.167 -13.465
  366    HE2  LYS  47           1HE      LYS  47  -3.307  -1.227 -13.906
  367    HE3  LYS  47           2HE      LYS  47  -4.306  -1.334 -12.441
  368    HZ1  LYS  47           3HZ      LYS  47  -4.893   0.341 -14.796
  369    HZ2  LYS  47           1HZ      LYS  47  -5.648  -1.073 -14.415
  370    HZ3  LYS  47           2HZ      LYS  47  -5.822   0.243 -13.437
  371    H    VAL  48           H        VAL  48   0.155   2.117  -8.302
  372    HA   VAL  48           HA       VAL  48   1.394   4.580  -9.125
  373    HB   VAL  48           HB       VAL  48   1.428   3.112  -6.456
  374   HG11  VAL  48          1HG1      VAL  48   2.170   5.271  -5.504
  375   HG12  VAL  48          2HG1      VAL  48   3.364   4.635  -6.660
  376   HG13  VAL  48          3HG1      VAL  48   2.272   5.957  -7.142
  377   HG21  VAL  48          3HG2      VAL  48  -0.788   3.789  -7.161
  378   HG22  VAL  48          1HG2      VAL  48  -0.230   4.780  -5.794
  379   HG23  VAL  48          2HG2      VAL  48  -0.213   5.450  -7.442
  380    H    GLU  49           H        GLU  49   3.260   5.084  -9.837
  381    HA   GLU  49           HA       GLU  49   5.324   3.170 -10.289
  382    HB2  GLU  49           1HB      GLU  49   5.034   5.302 -11.506
  383    HB3  GLU  49           2HB      GLU  49   5.557   6.174 -10.044
  384    HG2  GLU  49           1HG      GLU  49   7.823   5.039 -10.227
  385    HG3  GLU  49           2HG      GLU  49   7.134   4.193 -11.631
  386    H    GLY  50           H        GLY  50   6.731   2.236  -9.056
  387    HA2  GLY  50           1HA      GLY  50   8.641   2.584  -7.535
  388    HA3  GLY  50           2HA      GLY  50   7.608   3.677  -6.583
  389    H    VAL  51           H        VAL  51   5.253   1.909  -6.887
  390    HA   VAL  51           HA       VAL  51   5.763   0.180  -4.562
  391    HB   VAL  51           HB       VAL  51   3.322   0.469  -6.364
  392   HG11  VAL  51          1HG1      VAL  51   2.130  -0.683  -4.532
  393   HG12  VAL  51          2HG1      VAL  51   3.409  -1.714  -5.212
  394   HG13  VAL  51          3HG1      VAL  51   3.665  -0.885  -3.658
  395   HG21  VAL  51          3HG2      VAL  51   3.838   2.531  -5.198
  396   HG22  VAL  51          1HG2      VAL  51   2.377   1.770  -4.524
  397   HG23  VAL  51          2HG2      VAL  51   3.923   1.656  -3.651
  398    H    LYS  52           H        LYS  52   6.372  -1.790  -4.456
  399    HA   LYS  52           HA       LYS  52   6.584  -3.311  -7.021
  400    HB2  LYS  52           1HB      LYS  52   7.990  -3.434  -4.368
  401    HB3  LYS  52           2HB      LYS  52   8.011  -4.814  -5.491
  402    HG2  LYS  52           1HG      LYS  52   8.933  -3.235  -7.243
  403    HG3  LYS  52           2HG      LYS  52   9.123  -2.031  -5.947
  404    HD2  LYS  52           1HD      LYS  52  10.705  -3.368  -4.792
  405    HD3  LYS  52           2HD      LYS  52  10.304  -4.808  -5.754
  406    HE2  LYS  52           1HE      LYS  52  11.302  -3.862  -7.724
  407    HE3  LYS  52           2HE      LYS  52  11.521  -2.292  -6.919
  408    HZ1  LYS  52           3HZ      LYS  52  12.874  -4.804  -6.170
  409    HZ2  LYS  52           1HZ      LYS  52  13.566  -3.548  -6.987
  410    HZ3  LYS  52           2HZ      LYS  52  13.077  -3.347  -5.424
  411    H    SER  53           H        SER  53   5.553  -3.721  -3.629
  412    HA   SER  53           HA       SER  53   3.680  -5.921  -4.496
  413    HB2  SER  53           1HB      SER  53   4.425  -7.434  -2.950
  414    HB3  SER  53           2HB      SER  53   5.747  -6.990  -4.053
  415    HG   SER  53           HG       SER  53   6.412  -7.082  -1.863
  416    H    ILE  54           H        ILE  54   2.007  -6.287  -3.031
  417    HA   ILE  54           HA       ILE  54   1.878  -4.484  -0.630
  418    HB   ILE  54           HB       ILE  54  -0.398  -5.192  -2.540
  419   HG12  ILE  54          1HG1      ILE  54   0.894  -2.543  -1.941
  420   HG13  ILE  54          2HG1      ILE  54   1.125  -3.515  -3.413
  421   HG21  ILE  54          1HG2      ILE  54  -1.763  -3.734  -1.081
  422   HG22  ILE  54          2HG2      ILE  54  -1.114  -5.120  -0.175
  423   HG23  ILE  54          3HG2      ILE  54  -0.368  -3.514   0.001
  424   HD11  ILE  54          3HD1      ILE  54  -1.498  -2.300  -2.478
  425   HD12  ILE  54          1HD1      ILE  54  -0.478  -1.684  -3.799
  426   HD13  ILE  54          2HD1      ILE  54  -1.267  -3.272  -3.951
  427    H    PHE  55           H        PHE  55   1.767  -5.472   1.173
  428    HA   PHE  55           HA       PHE  55   0.452  -8.168   1.224
  429    HB2  PHE  55           1HB      PHE  55   2.758  -8.324   1.969
  430    HB3  PHE  55           2HB      PHE  55   2.550  -6.936   3.060
  431    HD1  PHE  55           HD1      PHE  55   1.223 -10.360   2.411
  432    HD2  PHE  55           HD2      PHE  55   2.055  -7.288   5.261
  433    HE1  PHE  55           HE1      PHE  55   0.609 -11.899   4.246
  434    HE2  PHE  55           HE2      PHE  55   1.444  -8.824   7.098
  435    HZ   PHE  55           HZ       PHE  55   0.720 -11.130   6.590
  436    H    HIS  56           H        HIS  56  -1.383  -8.425   2.211
  437    HA   HIS  56           HA       HIS  56  -2.322  -6.218   4.011
  438    HB2  HIS  56           1HB      HIS  56  -3.809  -6.394   2.122
  439    HB3  HIS  56           2HB      HIS  56  -3.856  -8.170   2.244
  440    HD2  HIS  56           HD2      HIS  56  -5.364  -5.024   4.277
  441    HE1  HIS  56           HE1      HIS  56  -7.503  -8.599   5.111
  442    HE2  HIS  56           HE2      HIS  56  -7.345  -5.998   5.457
  443    H    VAL  57           H        VAL  57  -3.023  -6.593   6.006
  444    HA   VAL  57           HA       VAL  57  -3.629  -9.314   6.957
  445    HB   VAL  57           HB       VAL  57  -1.127  -9.262   7.122
  446   HG11  VAL  57          1HG1      VAL  57  -0.096  -7.732   8.768
  447   HG12  VAL  57          2HG1      VAL  57  -0.855  -6.826   7.438
  448   HG13  VAL  57          3HG1      VAL  57  -1.670  -6.940   9.017
  449   HG21  VAL  57          3HG2      VAL  57  -2.440 -10.594   8.662
  450   HG22  VAL  57          1HG2      VAL  57  -1.013  -9.910   9.476
  451   HG23  VAL  57          2HG2      VAL  57  -2.619  -9.196   9.749
  452    H    MET  58           H        MET  58  -4.738  -9.414   8.816
  453    HA   MET  58           HA       MET  58  -6.403  -8.607  10.231
  454    HB2  MET  58           1HB      MET  58  -4.330  -7.882  11.398
  455    HB3  MET  58           2HB      MET  58  -4.475  -6.311  10.575
  456    HG2  MET  58           1HG      MET  58  -6.663  -5.963  11.664
  457    HG3  MET  58           2HG      MET  58  -6.471  -7.513  12.517
  458    HE1  MET  58           3HE      MET  58  -3.547  -7.676  13.446
  459    HE2  MET  58           1HE      MET  58  -3.595  -6.843  15.018
  460    HE3  MET  58           2HE      MET  58  -4.929  -7.922  14.543
  461    H    ASP  59           H        ASP  59  -5.648  -5.293   9.961
  462    HA   ASP  59           HA       ASP  59  -7.705  -4.856   7.855
  463    HB2  ASP  59           1HB      ASP  59  -9.050  -3.364   9.295
  464    HB3  ASP  59           2HB      ASP  59  -8.798  -5.003   9.949
  465    H    PHE  60           H        PHE  60  -4.828  -4.536   7.938
  466    HA   PHE  60           HA       PHE  60  -4.816  -1.698   7.063
  467    HB2  PHE  60           1HB      PHE  60  -2.767  -1.178   8.283
  468    HB3  PHE  60           2HB      PHE  60  -4.007  -1.701   9.446
  469    HD1  PHE  60           HD1      PHE  60  -0.851  -2.555   7.799
  470    HD2  PHE  60           HD2      PHE  60  -3.797  -3.752  10.653
  471    HE1  PHE  60           HE1      PHE  60   0.712  -4.245   8.703
  472    HE2  PHE  60           HE2      PHE  60  -2.235  -5.439  11.562
  473    HZ   PHE  60           HZ       PHE  60   0.020  -5.688  10.584
  474    H    ILE  61           H        ILE  61  -2.763  -1.145   5.929
  475    HA   ILE  61           HA       ILE  61  -2.062  -3.504   4.195
  476    HB   ILE  61           HB       ILE  61  -2.335  -0.561   3.424
  477   HG12  ILE  61          1HG1      ILE  61  -4.469  -1.627   3.904
  478   HG13  ILE  61          2HG1      ILE  61  -4.272  -1.146   2.203
  479   HG21  ILE  61          1HG2      ILE  61  -2.012  -1.397   1.120
  480   HG22  ILE  61          2HG2      ILE  61  -0.603  -1.771   2.139
  481   HG23  ILE  61          3HG2      ILE  61  -1.782  -3.045   1.750
  482   HD11  ILE  61          3HD1      ILE  61  -3.978  -3.965   3.298
  483   HD12  ILE  61          1HD1      ILE  61  -5.370  -3.343   2.383
  484   HD13  ILE  61          2HD1      ILE  61  -3.779  -3.482   1.597
  485    H    SER  62           H        SER  62  -0.073  -4.050   3.886
  486    HA   SER  62           HA       SER  62   2.125  -2.145   4.712
  487    HB2  SER  62           1HB      SER  62   2.196  -4.159   5.847
  488    HB3  SER  62           2HB      SER  62   2.142  -5.076   4.325
  489    HG   SER  62           HG       SER  62   4.271  -4.789   5.154
  490    H    VAL  63           H        VAL  63   2.684  -0.896   3.003
  491    HA   VAL  63           HA       VAL  63   2.727  -2.125   0.259
  492    HB   VAL  63           HB       VAL  63   2.812   0.794   1.124
  493   HG11  VAL  63          1HG1      VAL  63   2.516   1.253  -1.286
  494   HG12  VAL  63          2HG1      VAL  63   4.023   0.355  -0.984
  495   HG13  VAL  63          3HG1      VAL  63   2.594  -0.491  -1.628
  496   HG21  VAL  63          3HG2      VAL  63   0.640  -0.186   1.560
  497   HG22  VAL  63          1HG2      VAL  63   0.562   0.940   0.187
  498   HG23  VAL  63          2HG2      VAL  63   0.570  -0.815  -0.102
  499    H    ASP  64           H        ASP  64   4.498  -2.833  -0.520
  500    HA   ASP  64           HA       ASP  64   7.058  -1.759   0.607
  501    HB2  ASP  64           1HB      ASP  64   6.576  -4.300   0.836
  502    HB3  ASP  64           2HB      ASP  64   6.514  -4.211  -0.940
  503    H    LYS  65           H        LYS  65   8.229  -0.468  -0.549
  504    HA   LYS  65           HA       LYS  65   7.607  -0.254  -3.465
  505    HB2  LYS  65           1HB      LYS  65   8.559   1.929  -3.358
  506    HB3  LYS  65           2HB      LYS  65   7.347   1.750  -2.068
  507    HG2  LYS  65           1HG      LYS  65   8.989   1.662  -0.376
  508    HG3  LYS  65           2HG      LYS  65  10.294   1.341  -1.542
  509    HD2  LYS  65           1HD      LYS  65   9.971   3.613  -2.489
  510    HD3  LYS  65           2HD      LYS  65   8.730   3.929  -1.252
  511    HE2  LYS  65           1HE      LYS  65  10.846   4.899  -0.559
  512    HE3  LYS  65           2HE      LYS  65  10.409   3.549   0.513
  513    HZ1  LYS  65           3HZ      LYS  65  12.338   3.411  -1.712
  514    HZ2  LYS  65           1HZ      LYS  65  12.726   3.472  -0.111
  515    HZ3  LYS  65           2HZ      LYS  65  11.934   2.159  -0.718
  516    H    GLU  66           H        GLU  66   9.566   0.629  -4.752
  517    HA   GLU  66           HA       GLU  66  11.792  -1.236  -4.555
  518    HB2  GLU  66           1HB      GLU  66  11.000  -0.229  -6.668
  519    HB3  GLU  66           2HB      GLU  66  11.543   1.361  -6.080
  520    HG2  GLU  66           1HG      GLU  66  13.926   0.521  -6.067
  521    HG3  GLU  66           2HG      GLU  66  13.243  -1.056  -6.524
  522    H    ASN  67           H        ASN  67  13.776  -1.029  -3.757
  523    HA   ASN  67           HA       ASN  67  14.172   0.732  -1.534
  524    HB2  ASN  67           1HB      ASN  67  15.531  -1.536  -1.900
  525    HB3  ASN  67           2HB      ASN  67  16.097  -0.510  -3.240
  526   HD21  ASN  67          2HD2      ASN  67  15.626  -0.111   0.263
  527   HD22  ASN  67          1HD2      ASN  67  17.205   0.526   0.581
  528    H    ASP  68           H        ASP  68  15.243   0.932  -4.910
  529    HA   ASP  68           HA       ASP  68  16.808   3.330  -4.550
  530    HB2  ASP  68           1HB      ASP  68  15.475   2.159  -7.065
  531    HB3  ASP  68           2HB      ASP  68  16.457   3.634  -6.894
  532    H    ALA  69           H        ALA  69  13.412   2.767  -5.419
  533    HA   ALA  69           HA       ALA  69  12.774   5.516  -5.884
  534    HB1  ALA  69           3HB      ALA  69  11.000   3.248  -4.915
  535    HB2  ALA  69           1HB      ALA  69  10.436   4.808  -5.559
  536    HB3  ALA  69           2HB      ALA  69  11.320   3.678  -6.611
  537    H    ASN  70           H        ASN  70  11.364   6.875  -4.574
  538    HA   ASN  70           HA       ASN  70  12.015   6.611  -1.654
  539    HB2  ASN  70           1HB      ASN  70  11.798   9.358  -3.087
  540    HB3  ASN  70           2HB      ASN  70  12.002   8.736  -1.432
  541   HD21  ASN  70          2HD2      ASN  70  13.508   9.485  -4.415
  542   HD22  ASN  70          1HD2      ASN  70  15.130   9.074  -3.967
  543    H    TRP  71           H        TRP  71  10.521   7.334  -0.150
  544    HA   TRP  71           HA       TRP  71   7.743   6.928  -0.875
  545    HB2  TRP  71           1HB      TRP  71   9.172   7.867   1.633
  546    HB3  TRP  71           2HB      TRP  71   7.396   7.864   1.513
  547    HD1  TRP  71           HD1      TRP  71  10.045   5.920   2.677
  548    HE1  TRP  71           HE1      TRP  71   9.370   3.321   2.988
  549    HE3  TRP  71           HE3      TRP  71   5.769   5.939  -0.071
  550    HZ2  TRP  71           HZ2      TRP  71   7.296   1.711   2.126
  551    HZ3  TRP  71           HZ3      TRP  71   4.477   3.912  -0.318
  552    HH2  TRP  71           HH2      TRP  71   5.170   1.805   0.736
  553    H    GLU  72           H        GLU  72   9.842   9.678  -0.851
  554    HA   GLU  72           HA       GLU  72   7.927  11.777  -0.680
  555    HB2  GLU  72           1HB      GLU  72  10.484  11.510  -2.263
  556    HB3  GLU  72           2HB      GLU  72   9.534  13.012  -2.158
  557    HG2  GLU  72           1HG      GLU  72   9.939  13.067   0.338
  558    HG3  GLU  72           2HG      GLU  72  10.759  11.503   0.114
  559    H    THR  73           H        THR  73   8.834   9.700  -3.399
  560    HA   THR  73           HA       THR  73   6.859  11.039  -5.148
  561    HB   THR  73           HB       THR  73   8.553   8.542  -5.579
  562    HG1  THR  73           HG1      THR  73   9.734  10.005  -6.948
  563   HG21  THR  73          3HG2      THR  73   6.866  10.177  -7.517
  564   HG22  THR  73          1HG2      THR  73   7.916   8.807  -7.950
  565   HG23  THR  73          2HG2      THR  73   6.483   8.542  -6.928
  566    H    VAL  74           H        VAL  74   7.230   7.907  -3.479
  567    HA   VAL  74           HA       VAL  74   4.914   6.759  -4.836
  568    HB   VAL  74           HB       VAL  74   6.481   5.862  -2.382
  569   HG11  VAL  74          1HG1      VAL  74   5.363   3.684  -2.730
  570   HG12  VAL  74          2HG1      VAL  74   4.178   4.964  -2.378
  571   HG13  VAL  74          3HG1      VAL  74   4.399   4.389  -4.048
  572   HG21  VAL  74          3HG2      VAL  74   7.820   5.889  -4.401
  573   HG22  VAL  74          1HG2      VAL  74   7.468   4.219  -3.898
  574   HG23  VAL  74          2HG2      VAL  74   6.579   4.944  -5.259
  575    H    LEU  75           H        LEU  75   5.404   8.156  -1.592
  576    HA   LEU  75           HA       LEU  75   3.054   6.861  -0.558
  577    HB2  LEU  75           1HB      LEU  75   4.834   7.457   0.756
  578    HB3  LEU  75           2HB      LEU  75   4.718   9.213   0.494
  579    HG   LEU  75           HG       LEU  75   2.475   9.179   1.589
  580   HD11  LEU  75          1HD1      LEU  75   1.856   7.155   2.934
  581   HD12  LEU  75          2HD1      LEU  75   1.950   6.774   1.199
  582   HD13  LEU  75          3HD1      LEU  75   3.279   6.307   2.284
  583   HD21  LEU  75          3HD2      LEU  75   4.444   9.824   2.849
  584   HD22  LEU  75          1HD2      LEU  75   3.317   8.932   3.899
  585   HD23  LEU  75          2HD2      LEU  75   4.771   8.124   3.264
  586    HA   PRO  76           HA       PRO  76   1.077  11.347  -1.113
  587    HB2  PRO  76           2HB      PRO  76   1.965  13.001  -2.601
  588    HB3  PRO  76           1HB      PRO  76   2.535  11.795  -3.763
  589    HG2  PRO  76           1HG      PRO  76   4.555  12.435  -2.682
  590    HG3  PRO  76           2HG      PRO  76   3.772  12.610  -1.105
  591    HD2  PRO  76           1HD      PRO  76   4.601  10.062  -2.544
  592    HD3  PRO  76           2HD      PRO  76   4.681  10.438  -0.819
  593    H    LYS  77           H        LYS  77   2.070   9.299  -3.855
  594    HA   LYS  77           HA       LYS  77  -0.518   9.543  -5.158
  595    HB2  LYS  77           1HB      LYS  77   1.773   7.602  -5.476
  596    HB3  LYS  77           2HB      LYS  77   0.312   7.600  -6.492
  597    HG2  LYS  77           1HG      LYS  77   0.837   9.870  -7.269
  598    HG3  LYS  77           2HG      LYS  77   2.287   9.894  -6.237
  599    HD2  LYS  77           1HD      LYS  77   3.202   7.975  -7.491
  600    HD3  LYS  77           2HD      LYS  77   1.757   7.974  -8.531
  601    HE2  LYS  77           1HE      LYS  77   2.295  10.260  -9.271
  602    HE3  LYS  77           2HE      LYS  77   3.748  10.246  -8.246
  603    HZ1  LYS  77           3HZ      LYS  77   3.232   8.433 -10.516
  604    HZ2  LYS  77           1HZ      LYS  77   4.267   9.717 -10.531
  605    HZ3  LYS  77           2HZ      LYS  77   4.580   8.419  -9.564
  606    H    VAL  78           H        VAL  78   1.014   7.016  -3.166
  607    HA   VAL  78           HA       VAL  78  -1.213   5.184  -3.230
  608    HB   VAL  78           HB       VAL  78   0.926   5.643  -1.109
  609   HG11  VAL  78          1HG1      VAL  78   0.295   3.394  -0.297
  610   HG12  VAL  78          2HG1      VAL  78  -1.072   4.527  -0.177
  611   HG13  VAL  78          3HG1      VAL  78  -1.019   3.330  -1.494
  612   HG21  VAL  78          3HG2      VAL  78   1.849   4.990  -3.253
  613   HG22  VAL  78          1HG2      VAL  78   1.984   3.663  -2.075
  614   HG23  VAL  78          2HG2      VAL  78   0.729   3.609  -3.336
  615    H    GLU  79           H        GLU  79  -0.370   7.694  -0.841
  616    HA   GLU  79           HA       GLU  79  -2.677   7.405   0.781
  617    HB2  GLU  79           1HB      GLU  79  -0.750   8.810   1.333
  618    HB3  GLU  79           2HB      GLU  79  -1.191   9.922   0.015
  619    HG2  GLU  79           1HG      GLU  79  -3.359  10.445   1.249
  620    HG3  GLU  79           2HG      GLU  79  -2.787   9.271   2.456
  621    H    ALA  80           H        ALA  80  -2.239   9.240  -2.226
  622    HA   ALA  80           HA       ALA  80  -4.736  10.568  -2.213
  623    HB1  ALA  80           3HB      ALA  80  -3.147   9.524  -4.582
  624    HB2  ALA  80           1HB      ALA  80  -4.449  10.733  -4.655
  625    HB3  ALA  80           2HB      ALA  80  -2.938  11.105  -3.793
  626    H    VAL  81           H        VAL  81  -3.892   7.284  -3.218
  627    HA   VAL  81           HA       VAL  81  -6.280   6.620  -4.634
  628    HB   VAL  81           HB       VAL  81  -4.462   4.900  -2.900
  629   HG11  VAL  81          1HG1      VAL  81  -5.513   2.976  -4.045
  630   HG12  VAL  81          2HG1      VAL  81  -6.710   3.890  -3.096
  631   HG13  VAL  81          3HG1      VAL  81  -6.640   4.082  -4.866
  632   HG21  VAL  81          3HG2      VAL  81  -3.346   5.875  -4.815
  633   HG22  VAL  81          1HG2      VAL  81  -3.568   4.124  -5.037
  634   HG23  VAL  81          2HG2      VAL  81  -4.626   5.270  -5.893
  635    H    PHE  82           H        PHE  82  -5.604   6.369  -1.150
  636    HA   PHE  82           HA       PHE  82  -8.219   5.248  -0.569
  637    HB2  PHE  82           1HB      PHE  82  -6.182   6.621   1.239
  638    HB3  PHE  82           2HB      PHE  82  -7.610   5.716   1.791
  639    HD1  PHE  82           HD1      PHE  82  -4.183   5.548   0.790
  640    HD2  PHE  82           HD2      PHE  82  -7.769   3.268   1.232
  641    HE1  PHE  82           HE1      PHE  82  -2.852   3.464   0.808
  642    HE2  PHE  82           HE2      PHE  82  -6.441   1.182   1.251
  643    HZ   PHE  82           HZ       PHE  82  -3.982   1.281   1.038
  644    H    GLU  83           H        GLU  83  -7.116   8.414  -1.256
  645    HA   GLU  83           HA       GLU  83  -9.397   9.706   0.121
  646    HB2  GLU  83           1HB      GLU  83  -7.215  10.763  -1.684
  647    HB3  GLU  83           2HB      GLU  83  -8.493  11.757  -0.940
  648    HG2  GLU  83           1HG      GLU  83  -7.589  11.134   1.351
  649    HG3  GLU  83           2HG      GLU  83  -6.419  10.128   0.468
  650    H    LEU  84           H        LEU  84  -9.055   7.940  -2.635
  651    HA   LEU  84           HA       LEU  84 -10.814   9.578  -4.336
  652    HB2  LEU  84           1HB      LEU  84  -9.871   6.790  -4.462
  653    HB3  LEU  84           2HB      LEU  84 -10.717   7.526  -5.842
  654    HG   LEU  84           HG       LEU  84  -7.988   8.293  -4.735
  655   HD11  LEU  84          1HD1      LEU  84  -7.186   7.582  -7.005
  656   HD12  LEU  84          2HD1      LEU  84  -7.999   6.244  -6.157
  657   HD13  LEU  84          3HD1      LEU  84  -8.854   7.139  -7.437
  658   HD21  LEU  84          3HD2      LEU  84  -9.201  10.277  -5.419
  659   HD22  LEU  84          1HD2      LEU  84  -7.892   9.937  -6.577
  660   HD23  LEU  84          2HD2      LEU  84  -9.576   9.540  -6.995
  661    H    GLU  85           H        GLU  85 -12.917   9.297  -4.787
  662    HA   GLU  85           HA       GLU  85 -14.422   7.450  -2.989
  663    HB2  GLU  85           1HB      GLU  85 -15.308   9.687  -4.817
  664    HB3  GLU  85           2HB      GLU  85 -16.399   8.659  -3.857
  665    HG2  GLU  85           1HG      GLU  85 -15.301   9.563  -1.740
  666    HG3  GLU  85           2HG      GLU  85 -14.267  10.496  -2.846
  667    H    HIS  86           H        HIS  86 -12.890   7.125  -5.797
  668    HA   HIS  86           HA       HIS  86 -15.097   5.953  -7.375
  669    HB2  HIS  86           1HB      HIS  86 -12.098   6.113  -7.934
  670    HB3  HIS  86           2HB      HIS  86 -13.345   5.561  -9.077
  671    HD2  HIS  86           HD2      HIS  86 -11.541   8.862  -8.155
  672    HE1  HIS  86           HE1      HIS  86 -15.108   9.831 -10.249
  673    HE2  HIS  86           HE2      HIS  86 -12.804  10.685  -9.312
  674    H    HIS  87           H        HIS  87 -15.466   4.474  -5.444
  675    HA   HIS  87           HA       HIS  87 -13.726   2.132  -5.305
  676    HB2  HIS  87           1HB      HIS  87 -15.138   2.768  -3.374
  677    HB3  HIS  87           2HB      HIS  87 -16.601   2.537  -4.361
  678    HD2  HIS  87           HD2      HIS  87 -17.576  -0.135  -4.404
  679    HE1  HIS  87           HE1      HIS  87 -14.223  -1.760  -2.365
  680    HE2  HIS  87           HE2      HIS  87 -16.628  -2.188  -3.335
  681    H    HIS  88           H        HIS  88 -13.583   0.507  -6.616
  682    HA   HIS  88           HA       HIS  88 -15.990  -0.266  -8.206
  683    HB2  HIS  88           1HB      HIS  88 -13.163  -0.012  -9.329
  684    HB3  HIS  88           2HB      HIS  88 -14.588  -0.623 -10.201
  685    HD1  HIS  88           HD1      HIS  88 -16.594   1.206 -10.463
  686    HD2  HIS  88           HD2      HIS  88 -12.777   2.774  -9.599
  687    HE1  HIS  88           HE1      HIS  88 -16.651   3.546 -11.166
  688    H    HIS  89           H        HIS  89 -15.949  -1.698  -6.229
  689    HA   HIS  89           HA       HIS  89 -14.889  -4.284  -7.134
  690    HB2  HIS  89           1HB      HIS  89 -12.955  -3.394  -5.843
  691    HB3  HIS  89           2HB      HIS  89 -14.019  -3.145  -4.438
  692    HD2  HIS  89           HD2      HIS  89 -14.144  -5.377  -2.716
  693    HE1  HIS  89           HE1      HIS  89 -12.454  -8.111  -5.495
  694    HE2  HIS  89           HE2      HIS  89 -13.322  -7.716  -3.046
  695    H    HIS  90           H        HIS  90 -16.128  -5.929  -6.593
  696    HA   HIS  90           HA       HIS  90 -17.883  -5.836  -4.253
  697    HB2  HIS  90           1HB      HIS  90 -20.001  -5.976  -5.479
  698    HB3  HIS  90           2HB      HIS  90 -19.173  -4.463  -5.921
  699    HD2  HIS  90           HD2      HIS  90 -20.545  -7.721  -7.674
  700    HE1  HIS  90           HE1      HIS  90 -18.496  -5.315 -10.515
  701    HE2  HIS  90           HE2      HIS  90 -20.057  -7.391 -10.105
  702    H    HIS  91           H        HIS  91 -19.280  -7.775  -4.113
  703    HA   HIS  91           HA       HIS  91 -18.606 -10.069  -5.778
  704    HB2  HIS  91           1HB      HIS  91 -16.553  -9.949  -4.351
  705    HB3  HIS  91           2HB      HIS  91 -17.583 -10.053  -2.904
  706    HD2  HIS  91           HD2      HIS  91 -18.023 -12.700  -2.042
  707    HE1  HIS  91           HE1      HIS  91 -16.812 -14.512  -5.690
  708    HE2  HIS  91           HE2      HIS  91 -17.585 -14.872  -3.202
  Start of MODEL   14
    1    H1   MET   1           1H       MET   1 -13.836   2.278   2.145
    2    H2   MET   1           2H       MET   1 -14.144   2.245   3.613
    3    H3   MET   1           3H       MET   1 -13.943   3.560   2.918
    4    HA   MET   1           HA       MET   1 -11.898   2.103   4.240
    5    HB2  MET   1           1HB      MET   1 -11.606   2.302   1.245
    6    HB3  MET   1           2HB      MET   1 -10.256   1.996   2.364
    7    HG2  MET   1           1HG      MET   1 -11.309  -0.081   3.099
    8    HG3  MET   1           2HG      MET   1 -12.704   0.233   2.041
    9    HE1  MET   1           3HE      MET   1  -9.044  -1.019   2.336
   10    HE2  MET   1           1HE      MET   1  -8.457  -0.971   0.657
   11    HE3  MET   1           2HE      MET   1  -8.768   0.545   1.533
   12    H    LYS   2           H        LYS   2 -11.197   3.688   5.424
   13    HA   LYS   2           HA       LYS   2 -10.153   6.116   4.033
   14    HB2  LYS   2           1HB      LYS   2 -12.422   6.588   4.903
   15    HB3  LYS   2           2HB      LYS   2 -11.855   6.143   6.531
   16    HG2  LYS   2           1HG      LYS   2 -10.275   7.997   6.528
   17    HG3  LYS   2           2HG      LYS   2 -10.729   8.413   4.858
   18    HD2  LYS   2           1HD      LYS   2 -13.011   8.922   5.581
   19    HD3  LYS   2           2HD      LYS   2 -12.604   8.449   7.248
   20    HE2  LYS   2           1HE      LYS   2 -10.958  10.253   7.378
   21    HE3  LYS   2           2HE      LYS   2 -11.308  10.711   5.695
   22    HZ1  LYS   2           3HZ      LYS   2 -13.226  10.813   7.934
   23    HZ2  LYS   2           1HZ      LYS   2 -12.471  12.114   7.259
   24    HZ3  LYS   2           2HZ      LYS   2 -13.551  11.237   6.373
   25    H    ILE   3           H        ILE   3  -8.253   6.794   4.687
   26    HA   ILE   3           HA       ILE   3  -6.770   5.069   6.532
   27    HB   ILE   3           HB       ILE   3  -6.024   7.648   5.081
   28   HG12  ILE   3          1HG1      ILE   3  -5.218   4.800   4.553
   29   HG13  ILE   3          2HG1      ILE   3  -6.487   5.690   3.680
   30   HG21  ILE   3          1HG2      ILE   3  -3.699   7.101   5.714
   31   HG22  ILE   3          2HG2      ILE   3  -4.708   7.371   7.154
   32   HG23  ILE   3          3HG2      ILE   3  -4.283   5.715   6.664
   33   HD11  ILE   3          3HD1      ILE   3  -3.542   6.433   3.782
   34   HD12  ILE   3          1HD1      ILE   3  -4.376   5.672   2.407
   35   HD13  ILE   3          2HD1      ILE   3  -4.812   7.323   2.908
   36    H    ILE   4           H        ILE   4  -6.185   5.293   8.529
   37    HA   ILE   4           HA       ILE   4  -7.110   7.779   9.946
   38    HB   ILE   4           HB       ILE   4  -6.637   4.974  11.059
   39   HG12  ILE   4          1HG1      ILE   4  -8.564   4.999   9.647
   40   HG13  ILE   4          2HG1      ILE   4  -9.019   4.843  11.359
   41   HG21  ILE   4          1HG2      ILE   4  -7.659   5.895  13.113
   42   HG22  ILE   4          2HG2      ILE   4  -6.181   6.785  12.679
   43   HG23  ILE   4          3HG2      ILE   4  -7.778   7.492  12.338
   44   HD11  ILE   4          3HD1      ILE   4  -9.178   7.385   9.702
   45   HD12  ILE   4          1HD1      ILE   4 -10.553   6.358  10.165
   46   HD13  ILE   4          2HD1      ILE   4  -9.633   7.230  11.415
   47    H    SER   5           H        SER   5  -4.474   5.421   9.725
   48    HA   SER   5           HA       SER   5  -2.562   7.525  10.706
   49    HB2  SER   5           1HB      SER   5  -3.339   6.629  12.705
   50    HB3  SER   5           2HB      SER   5  -2.985   4.978  12.148
   51    HG   SER   5           HG       SER   5  -1.311   5.859  13.437
   52    H    ILE   6           H        ILE   6  -0.868   7.446   9.369
   53    HA   ILE   6           HA       ILE   6   0.051   4.754   8.385
   54    HB   ILE   6           HB       ILE   6   0.573   7.543   7.256
   55   HG12  ILE   6          1HG1      ILE   6  -0.959   5.225   6.105
   56   HG13  ILE   6          2HG1      ILE   6  -1.668   6.682   6.840
   57   HG21  ILE   6          1HG2      ILE   6   1.771   6.345   5.457
   58   HG22  ILE   6          2HG2      ILE   6   2.531   6.051   7.037
   59   HG23  ILE   6          3HG2      ILE   6   1.500   4.802   6.302
   60   HD11  ILE   6          3HD1      ILE   6   0.086   6.614   4.360
   61   HD12  ILE   6          1HD1      ILE   6  -1.680   6.831   4.381
   62   HD13  ILE   6          2HD1      ILE   6  -0.622   8.072   5.096
   63    H    SER   7           H        SER   7   1.904   3.956   8.913
   64    HA   SER   7           HA       SER   7   3.866   5.702  10.425
   65    HB2  SER   7           1HB      SER   7   4.148   4.165  12.087
   66    HB3  SER   7           2HB      SER   7   2.436   4.639  11.998
   67    HG   SER   7           HG       SER   7   3.585   2.247  10.993
   68    H    GLU   8           H        GLU   8   5.965   4.618  10.661
   69    HA   GLU   8           HA       GLU   8   6.689   3.133   8.194
   70    HB2  GLU   8           1HB      GLU   8   8.338   4.305  10.439
   71    HB3  GLU   8           2HB      GLU   8   8.998   3.455   9.022
   72    HG2  GLU   8           1HG      GLU   8   8.021   5.276   7.535
   73    HG3  GLU   8           2HG      GLU   8   7.396   5.977   9.043
   74    H    THR   9           H        THR   9   8.385   1.409   8.449
   75    HA   THR   9           HA       THR   9   7.709  -0.363  10.768
   76    HB   THR   9           HB       THR   9   7.500  -2.274   9.359
   77    HG1  THR   9           HG1      THR   9   7.914  -0.827   6.980
   78   HG21  THR   9          3HG2      THR   9   6.069   0.034   7.984
   79   HG22  THR   9          1HG2      THR   9   5.640  -1.686   7.845
   80   HG23  THR   9          2HG2      THR   9   5.480  -0.851   9.410
   81    HA   PRO  10           HA       PRO  10  11.911  -1.305  11.365
   82    HB2  PRO  10           2HB      PRO  10  12.092  -3.552  12.152
   83    HB3  PRO  10           1HB      PRO  10  11.290  -4.220  10.722
   84    HG2  PRO  10           1HG      PRO  10   9.568  -4.385  12.342
   85    HG3  PRO  10           2HG      PRO  10  10.051  -2.892  13.158
   86    HD2  PRO  10           1HD      PRO  10   8.489  -3.224  10.569
   87    HD3  PRO  10           2HD      PRO  10   8.262  -2.035  11.858
   88    H    ASN  11           H        ASN  11  10.404  -2.744   8.510
   89    HA   ASN  11           HA       ASN  11  12.991  -2.342   7.064
   90    HB2  ASN  11           1HB      ASN  11  11.560  -4.603   6.661
   91    HB3  ASN  11           2HB      ASN  11  10.478  -3.298   6.120
   92   HD21  ASN  11          2HD2      ASN  11  11.561  -5.561   4.647
   93   HD22  ASN  11          1HD2      ASN  11  12.425  -4.894   3.301
   94    H    HIS  12           H        HIS  12  13.357  -0.437   6.253
   95    HA   HIS  12           HA       HIS  12  11.268   1.560   6.220
   96    HB2  HIS  12           1HB      HIS  12  12.988   3.085   5.485
   97    HB3  HIS  12           2HB      HIS  12  13.756   1.976   6.646
   98    HD2  HIS  12           HD2      HIS  12  14.168   3.089   2.886
   99    HE1  HIS  12           HE1      HIS  12  16.855  -0.089   3.742
  100    HE2  HIS  12           HE2      HIS  12  16.122   1.777   2.040
  101    H    ASN  13           H        ASN  13  12.176  -0.813   3.976
  102    HA   ASN  13           HA       ASN  13  11.553   0.651   1.544
  103    HB2  ASN  13           1HB      ASN  13  11.723  -2.432   1.925
  104    HB3  ASN  13           2HB      ASN  13  11.285  -1.344   0.587
  105   HD21  ASN  13          2HD2      ASN  13  13.481  -3.248   0.829
  106   HD22  ASN  13          1HD2      ASN  13  14.936  -2.336   0.589
  107    H    THR  14           H        THR  14   9.659  -0.903   3.988
  108    HA   THR  14           HA       THR  14   7.221  -0.351   2.329
  109    HB   THR  14           HB       THR  14   7.518  -2.793   2.521
  110    HG1  THR  14           HG1      THR  14   5.485  -3.113   3.822
  111   HG21  THR  14          3HG2      THR  14   7.455  -2.273   5.520
  112   HG22  THR  14          1HG2      THR  14   7.439  -3.872   4.740
  113   HG23  THR  14          2HG2      THR  14   8.868  -2.821   4.590
  114    H    MET  15           H        MET  15   5.410   0.409   3.352
  115    HA   MET  15           HA       MET  15   5.815   1.293   6.191
  116    HB2  MET  15           1HB      MET  15   4.669   2.801   3.848
  117    HB3  MET  15           2HB      MET  15   4.415   3.275   5.544
  118    HG2  MET  15           1HG      MET  15   6.851   3.521   5.828
  119    HG3  MET  15           2HG      MET  15   7.088   3.081   4.120
  120    HE1  MET  15           3HE      MET  15   5.935   5.797   6.673
  121    HE2  MET  15           1HE      MET  15   5.123   6.993   5.635
  122    HE3  MET  15           2HE      MET  15   4.385   5.394   5.894
  123    H    LYS  16           H        LYS  16   3.866   1.727   7.380
  124    HA   LYS  16           HA       LYS  16   1.800  -0.305   6.623
  125    HB2  LYS  16           1HB      LYS  16   3.042  -0.773   8.667
  126    HB3  LYS  16           2HB      LYS  16   2.592   0.823   9.312
  127    HG2  LYS  16           1HG      LYS  16   0.204   0.140   9.242
  128    HG3  LYS  16           2HG      LYS  16   0.707  -1.474   8.692
  129    HD2  LYS  16           1HD      LYS  16   1.956  -1.827  10.754
  130    HD3  LYS  16           2HD      LYS  16   1.569  -0.178  11.298
  131    HE2  LYS  16           1HE      LYS  16  -0.827  -0.745  11.301
  132    HE3  LYS  16           2HE      LYS  16  -0.431  -2.398  10.778
  133    HZ1  LYS  16           3HZ      LYS  16   0.421  -1.154  13.312
  134    HZ2  LYS  16           1HZ      LYS  16  -0.776  -2.275  13.151
  135    HZ3  LYS  16           2HZ      LYS  16   0.788  -2.686  12.827
  136    H    ILE  17           H        ILE  17  -0.146   0.283   6.116
  137    HA   ILE  17           HA       ILE  17  -1.059   3.035   6.926
  138    HB   ILE  17           HB       ILE  17  -1.839   1.402   4.466
  139   HG12  ILE  17          1HG1      ILE  17  -0.225   3.933   4.635
  140   HG13  ILE  17          2HG1      ILE  17   0.445   2.301   4.409
  141   HG21  ILE  17          1HG2      ILE  17  -3.053   3.452   3.804
  142   HG22  ILE  17          2HG2      ILE  17  -3.670   2.814   5.345
  143   HG23  ILE  17          3HG2      ILE  17  -2.585   4.224   5.337
  144   HD11  ILE  17          3HD1      ILE  17  -1.468   3.715   2.518
  145   HD12  ILE  17          1HD1      ILE  17   0.277   3.498   2.263
  146   HD13  ILE  17          2HD1      ILE  17  -0.799   2.082   2.293
  147    H    THR  18           H        THR  18  -2.376   2.998   8.516
  148    HA   THR  18           HA       THR  18  -4.204   0.650   8.801
  149    HB   THR  18           HB       THR  18  -3.484   2.854  10.779
  150    HG1  THR  18           HG1      THR  18  -2.382   1.088  11.815
  151   HG21  THR  18          3HG2      THR  18  -5.117   0.307  11.119
  152   HG22  THR  18          1HG2      THR  18  -4.674   1.440  12.417
  153   HG23  THR  18          2HG2      THR  18  -5.765   1.963  11.112
  154    H    LEU  19           H        LEU  19  -6.252   0.742   8.365
  155    HA   LEU  19           HA       LEU  19  -7.465   3.458   7.973
  156    HB2  LEU  19           1HB      LEU  19  -7.930   0.862   6.656
  157    HB3  LEU  19           2HB      LEU  19  -8.946   2.265   6.251
  158    HG   LEU  19           HG       LEU  19  -6.477   3.286   5.756
  159   HD11  LEU  19          1HD1      LEU  19  -5.185   1.555   4.481
  160   HD12  LEU  19          2HD1      LEU  19  -5.362   1.099   6.192
  161   HD13  LEU  19          3HD1      LEU  19  -6.386   0.331   4.956
  162   HD21  LEU  19          3HD2      LEU  19  -8.397   3.421   4.280
  163   HD22  LEU  19          1HD2      LEU  19  -6.960   2.906   3.363
  164   HD23  LEU  19          2HD2      LEU  19  -8.200   1.712   3.822
  165    H    SER  20           H        SER  20  -9.863   3.467   8.099
  166    HA   SER  20           HA       SER  20 -10.826   2.144  10.570
  167    HB2  SER  20           1HB      SER  20 -12.791   3.332  10.246
  168    HB3  SER  20           2HB      SER  20 -11.359   4.383  10.164
  169    HG   SER  20           HG       SER  20 -13.123   4.621   8.522
  170    H    GLU  21           H        GLU  21 -11.965   2.277   7.155
  171    HA   GLU  21           HA       GLU  21 -12.978  -0.521   7.451
  172    HB2  GLU  21           1HB      GLU  21 -13.370   1.558   5.290
  173    HB3  GLU  21           2HB      GLU  21 -14.020  -0.100   5.252
  174    HG2  GLU  21           1HG      GLU  21 -15.448   0.426   7.262
  175    HG3  GLU  21           2HG      GLU  21 -14.614   1.996   7.299
  176    H    SER  22           H        SER  22 -12.611  -2.035   5.715
  177    HA   SER  22           HA       SER  22  -9.844  -1.757   4.514
  178    HB2  SER  22           1HB      SER  22  -9.749  -2.760   6.727
  179    HB3  SER  22           2HB      SER  22 -10.681  -4.123   6.063
  180    HG   SER  22           HG       SER  22  -8.432  -4.463   5.914
  181    H    ARG  23           H        ARG  23  -9.572  -4.246   3.547
  182    HA   ARG  23           HA       ARG  23 -11.261  -4.418   1.252
  183    HB2  ARG  23           1HB      ARG  23  -9.056  -5.357   1.341
  184    HB3  ARG  23           2HB      ARG  23  -9.623  -6.575   2.508
  185    HG2  ARG  23           1HG      ARG  23 -11.180  -7.462   0.821
  186    HG3  ARG  23           2HG      ARG  23 -10.602  -6.249  -0.345
  187    HD2  ARG  23           1HD      ARG  23  -8.420  -7.238  -0.329
  188    HD3  ARG  23           2HD      ARG  23  -8.938  -8.411   0.904
  189    HE   ARG  23           HE       ARG  23  -9.516  -8.685  -1.990
  190   HH11  ARG  23          1HH1      ARG  23 -10.466  -9.660   1.220
  191   HH12  ARG  23          2HH1      ARG  23 -11.269 -11.071   0.561
  192   HH21  ARG  23          2HH2      ARG  23 -11.245 -11.439  -1.709
  193   HH22  ARG  23          1HH2      ARG  23 -10.424 -10.302  -2.760
  194    H    GLU  24           H        GLU  24 -13.028  -5.528   0.714
  195    HA   GLU  24           HA       GLU  24 -15.095  -5.981   2.485
  196    HB2  GLU  24           1HB      GLU  24 -15.199  -6.127   0.007
  197    HB3  GLU  24           2HB      GLU  24 -14.454  -7.741   0.114
  198    HG2  GLU  24           1HG      GLU  24 -16.475  -8.559   1.403
  199    HG3  GLU  24           2HG      GLU  24 -17.049  -6.878   1.322
  200    H    GLY  25           H        GLY  25 -12.818  -8.554   1.443
  201    HA2  GLY  25           1HA      GLY  25 -13.325  -9.853   4.082
  202    HA3  GLY  25           2HA      GLY  25 -12.554 -10.624   2.677
  203    H    MET  26           H        MET  26 -11.861  -9.745   5.666
  204    HA   MET  26           HA       MET  26  -9.464  -8.059   5.088
  205    HB2  MET  26           1HB      MET  26 -10.934  -8.727   7.637
  206    HB3  MET  26           2HB      MET  26  -9.450  -7.749   7.545
  207    HG2  MET  26           1HG      MET  26 -10.623  -6.085   6.180
  208    HG3  MET  26           2HG      MET  26 -12.106  -7.068   6.245
  209    HE1  MET  26           3HE      MET  26 -13.677  -5.251   7.211
  210    HE2  MET  26           1HE      MET  26 -13.236  -4.151   8.539
  211    HE3  MET  26           2HE      MET  26 -12.351  -4.082   6.996
  212    H    THR  27           H        THR  27  -9.224 -10.681   4.260
  213    HA   THR  27           HA       THR  27  -7.751 -12.109   6.407
  214    HB   THR  27           HB       THR  27  -7.590 -13.950   4.789
  215    HG1  THR  27           HG1      THR  27  -7.446 -12.622   2.890
  216   HG21  THR  27          3HG2      THR  27 -10.382 -12.737   4.867
  217   HG22  THR  27          1HG2      THR  27  -9.996 -14.440   4.522
  218   HG23  THR  27          2HG2      THR  27  -9.657 -13.758   6.131
  219    H    SER  28           H        SER  28  -5.677 -13.136   5.869
  220    HA   SER  28           HA       SER  28  -3.715 -11.110   5.040
  221    HB2  SER  28           1HB      SER  28  -3.409 -13.946   5.823
  222    HB3  SER  28           2HB      SER  28  -2.107 -12.784   5.479
  223    HG   SER  28           HG       SER  28  -2.613 -12.917   7.708
  224    H    ASP  29           H        ASP  29  -3.186 -10.699   2.992
  225    HA   ASP  29           HA       ASP  29  -2.888 -12.955   1.082
  226    HB2  ASP  29           1HB      ASP  29  -4.645 -10.504   0.456
  227    HB3  ASP  29           2HB      ASP  29  -3.969 -11.756  -0.615
  228    H    THR  30           H        THR  30  -1.141 -12.817  -0.083
  229    HA   THR  30           HA       THR  30   0.266 -10.169  -0.165
  230    HB   THR  30           HB       THR  30   1.422 -12.977  -0.423
  231    HG1  THR  30           HG1      THR  30   2.361 -12.416   1.629
  232   HG21  THR  30          3HG2      THR  30   2.762 -10.247  -0.296
  233   HG22  THR  30          1HG2      THR  30   3.600 -11.817  -0.331
  234   HG23  THR  30          2HG2      THR  30   2.649 -11.282  -1.738
  235    H    TYR  31           H        TYR  31   0.438  -9.154  -1.985
  236    HA   TYR  31           HA       TYR  31   0.388 -10.744  -4.523
  237    HB2  TYR  31           1HB      TYR  31  -1.146  -8.216  -3.896
  238    HB3  TYR  31           2HB      TYR  31  -0.923  -8.889  -5.530
  239    HD1  TYR  31           HD1      TYR  31  -2.759  -9.157  -2.387
  240    HD2  TYR  31           HD2      TYR  31  -1.979 -11.063  -6.121
  241    HE1  TYR  31           HE1      TYR  31  -4.747 -10.599  -2.057
  242    HE2  TYR  31           HE2      TYR  31  -3.958 -12.510  -5.808
  243    HH   TYR  31           HH       TYR  31  -5.892 -12.443  -2.829
  244    H    THR  32           H        THR  32   1.599 -10.002  -6.200
  245    HA   THR  32           HA       THR  32   3.179  -7.503  -5.679
  246    HB   THR  32           HB       THR  32   4.906  -8.411  -7.174
  247    HG1  THR  32           HG1      THR  32   4.683 -10.619  -7.866
  248   HG21  THR  32          3HG2      THR  32   4.117 -10.390  -5.002
  249   HG22  THR  32          1HG2      THR  32   5.728 -10.245  -5.740
  250   HG23  THR  32          2HG2      THR  32   5.075  -8.911  -4.760
  251    H    LYS  33           H        LYS  33   1.118  -9.269  -7.875
  252    HA   LYS  33           HA       LYS  33   1.123  -6.852  -9.657
  253    HB2  LYS  33           1HB      LYS  33   0.465  -9.736 -10.271
  254    HB3  LYS  33           2HB      LYS  33   0.212  -8.372 -11.383
  255    HG2  LYS  33           1HG      LYS  33   2.649  -7.925 -11.357
  256    HG3  LYS  33           2HG      LYS  33   2.879  -9.337 -10.298
  257    HD2  LYS  33           1HD      LYS  33   1.957 -10.806 -12.034
  258    HD3  LYS  33           2HD      LYS  33   1.688  -9.401 -13.091
  259    HE2  LYS  33           1HE      LYS  33   4.112  -8.947 -13.088
  260    HE3  LYS  33           2HE      LYS  33   4.370 -10.375 -12.060
  261    HZ1  LYS  33           3HZ      LYS  33   3.244 -10.407 -14.785
  262    HZ2  LYS  33           1HZ      LYS  33   4.774 -10.862 -14.375
  263    HZ3  LYS  33           2HZ      LYS  33   3.482 -11.732 -13.831
  264    H    VAL  34           H        VAL  34  -0.902  -6.322 -10.681
  265    HA   VAL  34           HA       VAL  34  -3.006  -6.115  -8.668
  266    HB   VAL  34           HB       VAL  34  -4.271  -4.954 -10.414
  267   HG11  VAL  34          1HG1      VAL  34  -2.675  -3.133 -10.919
  268   HG12  VAL  34          2HG1      VAL  34  -2.503  -3.687  -9.236
  269   HG13  VAL  34          3HG1      VAL  34  -1.320  -4.194 -10.465
  270   HG21  VAL  34          3HG2      VAL  34  -3.748  -6.400 -12.286
  271   HG22  VAL  34          1HG2      VAL  34  -3.395  -4.701 -12.681
  272   HG23  VAL  34          2HG2      VAL  34  -2.066  -5.819 -12.291
  273    H    ASP  35           H        ASP  35  -5.198  -6.697  -8.915
  274    HA   ASP  35           HA       ASP  35  -5.937  -8.895 -10.662
  275    HB2  ASP  35           1HB      ASP  35  -4.383  -9.909  -8.679
  276    HB3  ASP  35           2HB      ASP  35  -5.898  -9.543  -7.818
  277    H    ASP  36           H        ASP  36  -8.080  -9.696 -10.279
  278    HA   ASP  36           HA       ASP  36  -9.849  -7.507  -9.515
  279    HB2  ASP  36           1HB      ASP  36 -10.452 -10.392 -10.403
  280    HB3  ASP  36           2HB      ASP  36 -11.580  -9.103  -9.912
  281    H    SER  37           H        SER  37  -8.462 -10.193  -7.874
  282    HA   SER  37           HA       SER  37 -10.485 -10.501  -5.770
  283    HB2  SER  37           1HB      SER  37  -8.958 -11.819  -4.679
  284    HB3  SER  37           2HB      SER  37  -9.023 -12.248  -6.404
  285    HG   SER  37           HG       SER  37  -6.897 -11.741  -5.026
  286    H    GLN  38           H        GLN  38  -8.025  -8.172  -6.503
  287    HA   GLN  38           HA       GLN  38  -7.785  -7.339  -3.650
  288    HB2  GLN  38           1HB      GLN  38  -6.370  -6.395  -6.154
  289    HB3  GLN  38           2HB      GLN  38  -6.057  -5.813  -4.502
  290    HG2  GLN  38           1HG      GLN  38  -5.233  -8.339  -3.959
  291    HG3  GLN  38           2HG      GLN  38  -5.772  -8.449  -5.651
  292   HE21  GLN  38          2HE2      GLN  38  -4.210  -8.367  -7.119
  293   HE22  GLN  38          1HE2      GLN  38  -2.669  -7.600  -6.924
  294    HA   PRO  39           HA       PRO  39 -10.434  -3.788  -3.914
  295    HB2  PRO  39           2HB      PRO  39  -9.724  -2.379  -2.132
  296    HB3  PRO  39           1HB      PRO  39  -8.052  -2.334  -2.709
  297    HG2  PRO  39           1HG      PRO  39  -7.850  -3.782  -0.848
  298    HG3  PRO  39           2HG      PRO  39  -9.454  -4.488  -1.092
  299    HD2  PRO  39           1HD      PRO  39  -6.876  -5.060  -2.609
  300    HD3  PRO  39           2HD      PRO  39  -8.128  -6.192  -2.086
  301    H    ALA  40           H        ALA  40 -10.840  -2.332  -5.379
  302    HA   ALA  40           HA       ALA  40  -9.258  -1.819  -7.620
  303    HB1  ALA  40           3HB      ALA  40 -11.172   0.085  -6.231
  304    HB2  ALA  40           1HB      ALA  40 -10.586   0.238  -7.903
  305    HB3  ALA  40           2HB      ALA  40 -11.610  -1.142  -7.440
  306    H    PHE  41           H        PHE  41  -9.244  -0.109  -4.502
  307    HA   PHE  41           HA       PHE  41  -7.344   1.900  -5.139
  308    HB2  PHE  41           1HB      PHE  41  -7.855   0.385  -2.544
  309    HB3  PHE  41           2HB      PHE  41  -6.780   1.795  -2.676
  310    HD1  PHE  41           HD1      PHE  41  -8.854   2.924  -4.901
  311    HD2  PHE  41           HD2      PHE  41  -9.039   1.694  -0.813
  312    HE1  PHE  41           HE1      PHE  41 -10.781   4.429  -4.537
  313    HE2  PHE  41           HE2      PHE  41 -10.968   3.196  -0.447
  314    HZ   PHE  41           HZ       PHE  41 -11.838   4.566  -2.309
  315    H    ILE  42           H        ILE  42  -6.786  -1.425  -3.968
  316    HA   ILE  42           HA       ILE  42  -3.906  -1.089  -3.824
  317    HB   ILE  42           HB       ILE  42  -5.635  -3.600  -3.999
  318   HG12  ILE  42          1HG1      ILE  42  -6.135  -2.332  -2.055
  319   HG13  ILE  42          2HG1      ILE  42  -5.224  -3.796  -1.621
  320   HG21  ILE  42          1HG2      ILE  42  -3.628  -4.782  -3.174
  321   HG22  ILE  42          2HG2      ILE  42  -3.318  -4.018  -4.751
  322   HG23  ILE  42          3HG2      ILE  42  -2.698  -3.267  -3.261
  323   HD11  ILE  42          3HD1      ILE  42  -4.087  -0.984  -1.811
  324   HD12  ILE  42          1HD1      ILE  42  -4.466  -1.854  -0.308
  325   HD13  ILE  42          2HD1      ILE  42  -3.174  -2.449  -1.379
  326    H    ASN  43           H        ASN  43  -6.091  -2.120  -6.367
  327    HA   ASN  43           HA       ASN  43  -4.029  -3.092  -8.142
  328    HB2  ASN  43           1HB      ASN  43  -6.872  -2.082  -8.907
  329    HB3  ASN  43           2HB      ASN  43  -5.448  -2.653  -9.810
  330   HD21  ASN  43          2HD2      ASN  43  -8.207  -3.730  -9.421
  331   HD22  ASN  43          1HD2      ASN  43  -7.975  -5.363  -8.896
  332    H    ASP  44           H        ASP  44  -5.701   0.063  -7.958
  333    HA   ASP  44           HA       ASP  44  -4.148   1.388  -9.934
  334    HB2  ASP  44           1HB      ASP  44  -5.462   2.517  -7.388
  335    HB3  ASP  44           2HB      ASP  44  -4.582   3.375  -8.677
  336    H    ILE  45           H        ILE  45  -3.525   0.980  -6.451
  337    HA   ILE  45           HA       ILE  45  -1.192   2.661  -6.384
  338    HB   ILE  45           HB       ILE  45  -2.057   0.308  -4.646
  339   HG12  ILE  45          1HG1      ILE  45  -2.015   3.237  -3.995
  340   HG13  ILE  45          2HG1      ILE  45  -3.419   2.411  -4.712
  341   HG21  ILE  45          1HG2      ILE  45  -0.337   1.076  -3.046
  342   HG22  ILE  45          2HG2      ILE  45   0.402   0.565  -4.581
  343   HG23  ILE  45          3HG2      ILE  45   0.212   2.295  -4.220
  344   HD11  ILE  45          3HD1      ILE  45  -2.121   1.729  -2.049
  345   HD12  ILE  45          1HD1      ILE  45  -3.653   2.605  -2.267
  346   HD13  ILE  45          2HD1      ILE  45  -3.523   0.901  -2.766
  347    H    LEU  46           H        LEU  46  -1.524  -0.828  -6.929
  348    HA   LEU  46           HA       LEU  46   1.275  -1.357  -7.138
  349    HB2  LEU  46           1HB      LEU  46  -1.167  -2.506  -8.287
  350    HB3  LEU  46           2HB      LEU  46   0.372  -3.315  -8.663
  351    HG   LEU  46           HG       LEU  46  -0.770  -2.902  -5.873
  352   HD11  LEU  46          1HD1      LEU  46  -1.151  -5.380  -5.908
  353   HD12  LEU  46          2HD1      LEU  46  -2.081  -4.565  -7.188
  354   HD13  LEU  46          3HD1      LEU  46  -0.578  -5.429  -7.592
  355   HD21  LEU  46          3HD2      LEU  46   1.653  -2.939  -5.902
  356   HD22  LEU  46          1HD2      LEU  46   1.034  -4.433  -5.161
  357   HD23  LEU  46          2HD2      LEU  46   1.648  -4.456  -6.831
  358    H    LYS  47           H        LYS  47  -1.054  -0.124  -9.478
  359    HA   LYS  47           HA       LYS  47   0.771  -0.376 -11.738
  360    HB2  LYS  47           1HB      LYS  47  -1.779   1.178 -11.296
  361    HB3  LYS  47           2HB      LYS  47  -0.878   1.159 -12.830
  362    HG2  LYS  47           1HG      LYS  47  -1.210  -1.276 -12.994
  363    HG3  LYS  47           2HG      LYS  47  -2.116  -1.253 -11.463
  364    HD2  LYS  47           1HD      LYS  47  -3.791   0.243 -12.475
  365    HD3  LYS  47           2HD      LYS  47  -2.886   0.214 -14.008
  366    HE2  LYS  47           1HE      LYS  47  -3.217  -2.222 -14.151
  367    HE3  LYS  47           2HE      LYS  47  -4.139  -2.181 -12.630
  368    HZ1  LYS  47           3HZ      LYS  47  -4.891  -0.805 -15.131
  369    HZ2  LYS  47           1HZ      LYS  47  -5.585  -2.184 -14.549
  370    HZ3  LYS  47           2HZ      LYS  47  -5.747  -0.766 -13.720
  371    H    VAL  48           H        VAL  48   0.247   1.973  -9.236
  372    HA   VAL  48           HA       VAL  48   1.578   4.214 -10.509
  373    HB   VAL  48           HB       VAL  48   1.311   3.432  -7.578
  374   HG11  VAL  48          1HG1      VAL  48   1.949   5.775  -7.114
  375   HG12  VAL  48          2HG1      VAL  48   3.255   4.909  -7.956
  376   HG13  VAL  48          3HG1      VAL  48   2.219   6.045  -8.852
  377   HG21  VAL  48          3HG2      VAL  48  -0.822   3.857  -8.643
  378   HG22  VAL  48          1HG2      VAL  48  -0.408   5.167  -7.511
  379   HG23  VAL  48          2HG2      VAL  48  -0.222   5.414  -9.263
  380    H    GLU  49           H        GLU  49   3.527   4.557 -11.083
  381    HA   GLU  49           HA       GLU  49   5.567   2.578 -10.870
  382    HB2  GLU  49           1HB      GLU  49   5.484   4.374 -12.557
  383    HB3  GLU  49           2HB      GLU  49   5.852   5.558 -11.280
  384    HG2  GLU  49           1HG      GLU  49   8.098   4.415 -10.928
  385    HG3  GLU  49           2HG      GLU  49   7.558   3.275 -12.182
  386    H    GLY  50           H        GLY  50   6.951   2.002  -9.397
  387    HA2  GLY  50           1HA      GLY  50   8.659   2.808  -7.777
  388    HA3  GLY  50           2HA      GLY  50   7.407   3.881  -7.109
  389    H    VAL  51           H        VAL  51   5.307   1.819  -7.393
  390    HA   VAL  51           HA       VAL  51   5.779   0.455  -4.811
  391    HB   VAL  51           HB       VAL  51   3.420   0.368  -6.738
  392   HG11  VAL  51          1HG1      VAL  51   2.207  -0.614  -4.822
  393   HG12  VAL  51          2HG1      VAL  51   3.576  -1.640  -5.307
  394   HG13  VAL  51          3HG1      VAL  51   3.706  -0.603  -3.866
  395   HG21  VAL  51          3HG2      VAL  51   3.754   2.591  -5.832
  396   HG22  VAL  51          1HG2      VAL  51   2.310   1.830  -5.126
  397   HG23  VAL  51          2HG2      VAL  51   3.814   1.928  -4.179
  398    H    LYS  52           H        LYS  52   6.499  -1.448  -4.452
  399    HA   LYS  52           HA       LYS  52   7.101  -3.143  -6.828
  400    HB2  LYS  52           1HB      LYS  52   8.919  -2.514  -5.292
  401    HB3  LYS  52           2HB      LYS  52   8.051  -3.321  -3.964
  402    HG2  LYS  52           1HG      LYS  52   8.263  -5.476  -5.116
  403    HG3  LYS  52           2HG      LYS  52   9.097  -4.680  -6.471
  404    HD2  LYS  52           1HD      LYS  52  10.902  -3.980  -4.940
  405    HD3  LYS  52           2HD      LYS  52  10.074  -4.802  -3.598
  406    HE2  LYS  52           1HE      LYS  52  10.297  -6.947  -4.748
  407    HE3  LYS  52           2HE      LYS  52  11.071  -6.141  -6.131
  408    HZ1  LYS  52           3HZ      LYS  52  12.151  -6.252  -3.388
  409    HZ2  LYS  52           1HZ      LYS  52  12.688  -7.144  -4.666
  410    HZ3  LYS  52           2HZ      LYS  52  12.870  -5.505  -4.672
  411    H    SER  53           H        SER  53   5.916  -3.614  -3.483
  412    HA   SER  53           HA       SER  53   4.028  -5.741  -4.482
  413    HB2  SER  53           1HB      SER  53   4.737  -7.356  -3.029
  414    HB3  SER  53           2HB      SER  53   6.082  -6.863  -4.084
  415    HG   SER  53           HG       SER  53   6.710  -7.102  -1.895
  416    H    ILE  54           H        ILE  54   2.376  -6.215  -3.001
  417    HA   ILE  54           HA       ILE  54   2.177  -4.460  -0.579
  418    HB   ILE  54           HB       ILE  54   0.037  -4.855  -2.720
  419   HG12  ILE  54          1HG1      ILE  54   1.441  -2.386  -1.733
  420   HG13  ILE  54          2HG1      ILE  54   1.700  -3.205  -3.292
  421   HG21  ILE  54          1HG2      ILE  54  -1.389  -3.465  -1.256
  422   HG22  ILE  54          2HG2      ILE  54  -0.913  -4.971  -0.440
  423   HG23  ILE  54          3HG2      ILE  54  -0.105  -3.443  -0.025
  424   HD11  ILE  54          3HD1      ILE  54  -0.884  -1.888  -2.381
  425   HD12  ILE  54          1HD1      ILE  54   0.268  -1.217  -3.558
  426   HD13  ILE  54          2HD1      ILE  54  -0.626  -2.708  -3.940
  427    H    PHE  55           H        PHE  55   1.677  -5.433   1.179
  428    HA   PHE  55           HA       PHE  55   0.183  -8.029   0.961
  429    HB2  PHE  55           1HB      PHE  55   2.349  -8.430   1.973
  430    HB3  PHE  55           2HB      PHE  55   2.150  -7.044   3.069
  431    HD1  PHE  55           HD1      PHE  55   0.338 -10.186   2.156
  432    HD2  PHE  55           HD2      PHE  55   1.615  -7.497   5.219
  433    HE1  PHE  55           HE1      PHE  55  -0.632 -11.681   3.869
  434    HE2  PHE  55           HE2      PHE  55   0.649  -8.991   6.937
  435    HZ   PHE  55           HZ       PHE  55  -0.476 -11.083   6.260
  436    H    HIS  56           H        HIS  56  -1.781  -8.134   1.688
  437    HA   HIS  56           HA       HIS  56  -2.735  -5.923   3.473
  438    HB2  HIS  56           1HB      HIS  56  -3.914  -6.017   1.299
  439    HB3  HIS  56           2HB      HIS  56  -4.319  -7.726   1.587
  440    HD2  HIS  56           HD2      HIS  56  -5.787  -4.178   2.376
  441    HE1  HIS  56           HE1      HIS  56  -7.932  -7.104   4.587
  442    HE2  HIS  56           HE2      HIS  56  -7.810  -4.604   3.785
  443    H    VAL  57           H        VAL  57  -3.612  -6.305   5.385
  444    HA   VAL  57           HA       VAL  57  -4.761  -8.925   6.061
  445    HB   VAL  57           HB       VAL  57  -2.380  -9.402   6.526
  446   HG11  VAL  57          1HG1      VAL  57  -1.186  -8.101   8.257
  447   HG12  VAL  57          2HG1      VAL  57  -1.614  -7.077   6.865
  448   HG13  VAL  57          3HG1      VAL  57  -2.565  -6.982   8.366
  449   HG21  VAL  57          3HG2      VAL  57  -4.077 -10.390   7.945
  450   HG22  VAL  57          1HG2      VAL  57  -2.610 -10.016   8.880
  451   HG23  VAL  57          2HG2      VAL  57  -4.041  -8.965   9.012
  452    H    MET  58           H        MET  58  -6.270  -8.840   7.528
  453    HA   MET  58           HA       MET  58  -7.848  -7.838   8.919
  454    HB2  MET  58           1HB      MET  58  -5.293  -6.567   9.887
  455    HB3  MET  58           2HB      MET  58  -6.874  -6.311  10.666
  456    HG2  MET  58           1HG      MET  58  -7.046  -8.635  11.243
  457    HG3  MET  58           2HG      MET  58  -5.608  -9.036  10.273
  458    HE1  MET  58           3HE      MET  58  -7.006  -7.538  13.592
  459    HE2  MET  58           1HE      MET  58  -5.575  -6.755  14.304
  460    HE3  MET  58           2HE      MET  58  -6.318  -6.081  12.833
  461    H    ASP  59           H        ASP  59  -6.434  -4.902   9.640
  462    HA   ASP  59           HA       ASP  59  -8.239  -3.561   7.653
  463    HB2  ASP  59           1HB      ASP  59  -9.028  -2.053   9.452
  464    HB3  ASP  59           2HB      ASP  59  -9.201  -3.793   9.794
  465    H    PHE  60           H        PHE  60  -5.317  -4.024   7.634
  466    HA   PHE  60           HA       PHE  60  -4.640  -1.220   6.979
  467    HB2  PHE  60           1HB      PHE  60  -2.556  -1.226   8.252
  468    HB3  PHE  60           2HB      PHE  60  -3.909  -1.520   9.369
  469    HD1  PHE  60           HD1      PHE  60  -0.939  -2.921   7.779
  470    HD2  PHE  60           HD2      PHE  60  -4.225  -3.672  10.405
  471    HE1  PHE  60           HE1      PHE  60   0.193  -4.956   8.610
  472    HE2  PHE  60           HE2      PHE  60  -3.096  -5.706  11.240
  473    HZ   PHE  60           HZ       PHE  60  -0.887  -6.349  10.341
  474    H    ILE  61           H        ILE  61  -2.700  -1.004   5.729
  475    HA   ILE  61           HA       ILE  61  -2.070  -3.522   4.208
  476    HB   ILE  61           HB       ILE  61  -2.528  -0.692   3.165
  477   HG12  ILE  61          1HG1      ILE  61  -3.992  -2.282   1.599
  478   HG13  ILE  61          2HG1      ILE  61  -4.040  -3.220   3.110
  479   HG21  ILE  61          1HG2      ILE  61  -1.909  -1.604   0.952
  480   HG22  ILE  61          2HG2      ILE  61  -0.549  -1.714   2.093
  481   HG23  ILE  61          3HG2      ILE  61  -1.504  -3.164   1.706
  482   HD11  ILE  61          3HD1      ILE  61  -4.858  -0.310   2.796
  483   HD12  ILE  61          1HD1      ILE  61  -5.966  -1.692   2.948
  484   HD13  ILE  61          2HD1      ILE  61  -4.906  -1.246   4.306
  485    H    SER  62           H        SER  62  -0.077  -4.056   3.876
  486    HA   SER  62           HA       SER  62   2.113  -2.159   4.700
  487    HB2  SER  62           1HB      SER  62   2.166  -4.239   5.729
  488    HB3  SER  62           2HB      SER  62   2.148  -5.065   4.154
  489    HG   SER  62           HG       SER  62   4.259  -4.758   5.118
  490    H    VAL  63           H        VAL  63   2.717  -0.840   3.067
  491    HA   VAL  63           HA       VAL  63   2.767  -1.936   0.263
  492    HB   VAL  63           HB       VAL  63   2.760   0.945   1.253
  493   HG11  VAL  63          1HG1      VAL  63   2.461   1.495  -1.138
  494   HG12  VAL  63          2HG1      VAL  63   3.991   0.630  -0.867
  495   HG13  VAL  63          3HG1      VAL  63   2.590  -0.231  -1.552
  496   HG21  VAL  63          3HG2      VAL  63   0.618  -0.116   1.636
  497   HG22  VAL  63          1HG2      VAL  63   0.510   1.063   0.308
  498   HG23  VAL  63          2HG2      VAL  63   0.572  -0.677  -0.053
  499    H    ASP  64           H        ASP  64   4.558  -2.521  -0.567
  500    HA   ASP  64           HA       ASP  64   7.078  -1.353   0.568
  501    HB2  ASP  64           1HB      ASP  64   6.735  -3.889   0.931
  502    HB3  ASP  64           2HB      ASP  64   6.609  -3.902  -0.844
  503    H    LYS  65           H        LYS  65   8.149  -0.039  -0.651
  504    HA   LYS  65           HA       LYS  65   7.639  -0.081  -3.593
  505    HB2  LYS  65           1HB      LYS  65   8.762   2.120  -3.550
  506    HB3  LYS  65           2HB      LYS  65   7.259   2.042  -2.600
  507    HG2  LYS  65           1HG      LYS  65   8.792   3.306  -1.296
  508    HG3  LYS  65           2HG      LYS  65   8.717   1.691  -0.551
  509    HD2  LYS  65           1HD      LYS  65  10.789   1.048  -1.677
  510    HD3  LYS  65           2HD      LYS  65  10.851   2.624  -2.501
  511    HE2  LYS  65           1HE      LYS  65  10.778   2.404   0.509
  512    HE3  LYS  65           2HE      LYS  65  12.306   2.291  -0.394
  513    HZ1  LYS  65           3HZ      LYS  65  10.430   4.566  -0.478
  514    HZ2  LYS  65           1HZ      LYS  65  11.867   4.537   0.331
  515    HZ3  LYS  65           2HZ      LYS  65  11.846   4.460  -1.318
  516    H    GLU  66           H        GLU  66   9.478   0.474  -5.006
  517    HA   GLU  66           HA       GLU  66  11.534  -1.542  -4.627
  518    HB2  GLU  66           1HB      GLU  66  11.185   0.678  -6.644
  519    HB3  GLU  66           2HB      GLU  66  12.486  -0.536  -6.700
  520    HG2  GLU  66           1HG      GLU  66  10.658  -2.343  -6.885
  521    HG3  GLU  66           2HG      GLU  66   9.536  -0.964  -6.895
  522    H    ASN  67           H        ASN  67  13.803  -1.231  -4.647
  523    HA   ASN  67           HA       ASN  67  14.625   0.389  -2.459
  524    HB2  ASN  67           1HB      ASN  67  16.486  -0.911  -4.589
  525    HB3  ASN  67           2HB      ASN  67  16.724   0.092  -3.139
  526   HD21  ASN  67          2HD2      ASN  67  17.522  -2.675  -3.769
  527   HD22  ASN  67          1HD2      ASN  67  16.875  -3.646  -2.487
  528    H    ASP  68           H        ASP  68  14.769   0.996  -5.947
  529    HA   ASP  68           HA       ASP  68  16.221   3.496  -5.679
  530    HB2  ASP  68           1HB      ASP  68  14.507   2.387  -7.981
  531    HB3  ASP  68           2HB      ASP  68  15.371   3.939  -7.868
  532    H    ALA  69           H        ALA  69  12.790   2.630  -5.815
  533    HA   ALA  69           HA       ALA  69  11.793   5.270  -6.166
  534    HB1  ALA  69           3HB      ALA  69  10.518   2.908  -4.745
  535    HB2  ALA  69           1HB      ALA  69   9.670   4.370  -5.298
  536    HB3  ALA  69           2HB      ALA  69  10.410   3.268  -6.483
  537    H    ASN  70           H        ASN  70  11.033   6.830  -4.794
  538    HA   ASN  70           HA       ASN  70  11.909   6.557  -1.933
  539    HB2  ASN  70           1HB      ASN  70  11.788   9.270  -3.448
  540    HB3  ASN  70           2HB      ASN  70  12.067   8.696  -1.785
  541   HD21  ASN  70          2HD2      ASN  70  13.399   9.225  -4.891
  542   HD22  ASN  70          1HD2      ASN  70  15.010   8.687  -4.551
  543    H    TRP  71           H        TRP  71  10.628   7.353  -0.310
  544    HA   TRP  71           HA       TRP  71   7.788   6.996  -0.789
  545    HB2  TRP  71           1HB      TRP  71   9.450   7.803   1.619
  546    HB3  TRP  71           2HB      TRP  71   7.671   7.801   1.662
  547    HD1  TRP  71           HD1      TRP  71  10.358   5.831   2.576
  548    HE1  TRP  71           HE1      TRP  71   9.730   3.210   2.783
  549    HE3  TRP  71           HE3      TRP  71   5.978   5.924   0.001
  550    HZ2  TRP  71           HZ2      TRP  71   7.644   1.614   1.920
  551    HZ3  TRP  71           HZ3      TRP  71   4.702   3.893  -0.299
  552    HH2  TRP  71           HH2      TRP  71   5.464   1.746   0.621
  553    H    GLU  72           H        GLU  72   9.918   9.730  -0.790
  554    HA   GLU  72           HA       GLU  72   8.062  11.827  -0.298
  555    HB2  GLU  72           1HB      GLU  72  10.453  11.647  -2.132
  556    HB3  GLU  72           2HB      GLU  72   9.541  13.146  -1.837
  557    HG2  GLU  72           1HG      GLU  72  10.178  13.030   0.606
  558    HG3  GLU  72           2HG      GLU  72  10.947  11.476   0.204
  559    H    THR  73           H        THR  73   8.699   9.976  -3.253
  560    HA   THR  73           HA       THR  73   6.547  11.433  -4.672
  561    HB   THR  73           HB       THR  73   8.230   9.034  -5.509
  562    HG1  THR  73           HG1      THR  73   9.253  10.653  -6.829
  563   HG21  THR  73          3HG2      THR  73   6.341  10.812  -7.103
  564   HG22  THR  73          1HG2      THR  73   7.363   9.518  -7.771
  565   HG23  THR  73          2HG2      THR  73   6.039   9.118  -6.648
  566    H    VAL  74           H        VAL  74   7.133   8.176  -3.341
  567    HA   VAL  74           HA       VAL  74   4.752   7.076  -4.621
  568    HB   VAL  74           HB       VAL  74   6.533   6.022  -2.385
  569   HG11  VAL  74          1HG1      VAL  74   5.441   3.848  -2.821
  570   HG12  VAL  74          2HG1      VAL  74   4.261   5.058  -2.263
  571   HG13  VAL  74          3HG1      VAL  74   4.349   4.630  -3.988
  572   HG21  VAL  74          3HG2      VAL  74   7.691   6.258  -4.502
  573   HG22  VAL  74          1HG2      VAL  74   7.423   4.541  -4.114
  574   HG23  VAL  74          2HG2      VAL  74   6.402   5.349  -5.328
  575    H    LEU  75           H        LEU  75   5.450   8.165  -1.297
  576    HA   LEU  75           HA       LEU  75   3.192   6.762  -0.218
  577    HB2  LEU  75           1HB      LEU  75   5.031   7.302   1.028
  578    HB3  LEU  75           2HB      LEU  75   4.879   9.068   0.889
  579    HG   LEU  75           HG       LEU  75   2.666   8.883   2.084
  580   HD11  LEU  75          1HD1      LEU  75   2.269   6.787   3.407
  581   HD12  LEU  75          2HD1      LEU  75   2.276   6.456   1.659
  582   HD13  LEU  75          3HD1      LEU  75   3.701   6.054   2.646
  583   HD21  LEU  75          3HD2      LEU  75   4.664   9.627   3.237
  584   HD22  LEU  75          1HD2      LEU  75   3.667   8.636   4.329
  585   HD23  LEU  75          2HD2      LEU  75   5.128   7.944   3.581
  586    HA   PRO  76           HA       PRO  76   1.064  11.203  -0.342
  587    HB2  PRO  76           2HB      PRO  76   1.852  13.010  -1.702
  588    HB3  PRO  76           1HB      PRO  76   2.399  11.931  -2.993
  589    HG2  PRO  76           1HG      PRO  76   4.449  12.532  -1.943
  590    HG3  PRO  76           2HG      PRO  76   3.732  12.538  -0.326
  591    HD2  PRO  76           1HD      PRO  76   4.550  10.155  -2.035
  592    HD3  PRO  76           2HD      PRO  76   4.722  10.380  -0.290
  593    H    LYS  77           H        LYS  77   2.020   9.431  -3.282
  594    HA   LYS  77           HA       LYS  77  -0.605   9.723  -4.490
  595    HB2  LYS  77           1HB      LYS  77   1.711   7.860  -5.027
  596    HB3  LYS  77           2HB      LYS  77   0.224   7.916  -6.004
  597    HG2  LYS  77           1HG      LYS  77   0.692  10.263  -6.583
  598    HG3  LYS  77           2HG      LYS  77   2.177  10.209  -5.607
  599    HD2  LYS  77           1HD      LYS  77   3.046   8.405  -7.062
  600    HD3  LYS  77           2HD      LYS  77   1.576   8.516  -8.057
  601    HE2  LYS  77           1HE      LYS  77   2.111  10.864  -8.576
  602    HE3  LYS  77           2HE      LYS  77   3.589  10.738  -7.598
  603    HZ1  LYS  77           3HZ      LYS  77   3.000   9.168 -10.024
  604    HZ2  LYS  77           1HZ      LYS  77   4.043  10.443  -9.938
  605    HZ3  LYS  77           2HZ      LYS  77   4.374   9.049  -9.116
  606    H    VAL  78           H        VAL  78   1.023   7.072  -2.751
  607    HA   VAL  78           HA       VAL  78  -1.110   5.162  -2.963
  608    HB   VAL  78           HB       VAL  78   0.957   5.580  -0.765
  609   HG11  VAL  78          1HG1      VAL  78   0.424   3.254  -0.118
  610   HG12  VAL  78          2HG1      VAL  78  -1.000   4.307   0.047
  611   HG13  VAL  78          3HG1      VAL  78  -0.862   3.206  -1.345
  612   HG21  VAL  78          3HG2      VAL  78   1.954   5.118  -2.923
  613   HG22  VAL  78          1HG2      VAL  78   2.132   3.724  -1.834
  614   HG23  VAL  78          2HG2      VAL  78   0.906   3.694  -3.125
  615    H    GLU  79           H        GLU  79  -0.439   7.482  -0.336
  616    HA   GLU  79           HA       GLU  79  -2.748   6.918   1.202
  617    HB2  GLU  79           1HB      GLU  79  -0.916   8.341   1.950
  618    HB3  GLU  79           2HB      GLU  79  -1.357   9.559   0.728
  619    HG2  GLU  79           1HG      GLU  79  -3.598   9.849   1.937
  620    HG3  GLU  79           2HG      GLU  79  -2.967   8.632   3.069
  621    H    ALA  80           H        ALA  80  -2.367   9.111  -1.569
  622    HA   ALA  80           HA       ALA  80  -4.929  10.300  -1.434
  623    HB1  ALA  80           3HB      ALA  80  -3.258   9.653  -3.886
  624    HB2  ALA  80           1HB      ALA  80  -4.619  10.795  -3.829
  625    HB3  ALA  80           2HB      ALA  80  -3.141  11.126  -2.897
  626    H    VAL  81           H        VAL  81  -3.901   7.233  -2.876
  627    HA   VAL  81           HA       VAL  81  -6.259   6.760  -4.452
  628    HB   VAL  81           HB       VAL  81  -4.279   4.834  -3.169
  629   HG11  VAL  81          1HG1      VAL  81  -5.222   3.142  -4.706
  630   HG12  VAL  81          2HG1      VAL  81  -6.454   3.727  -3.564
  631   HG13  VAL  81          3HG1      VAL  81  -6.448   4.315  -5.244
  632   HG21  VAL  81          3HG2      VAL  81  -3.290   6.296  -4.826
  633   HG22  VAL  81          1HG2      VAL  81  -3.392   4.628  -5.435
  634   HG23  VAL  81          2HG2      VAL  81  -4.553   5.853  -6.000
  635    H    PHE  82           H        PHE  82  -5.477   5.716  -1.138
  636    HA   PHE  82           HA       PHE  82  -7.944   4.287  -0.771
  637    HB2  PHE  82           1HB      PHE  82  -6.001   5.537   1.212
  638    HB3  PHE  82           2HB      PHE  82  -7.388   4.531   1.680
  639    HD1  PHE  82           HD1      PHE  82  -3.968   4.573   0.798
  640    HD2  PHE  82           HD2      PHE  82  -7.501   2.176   0.643
  641    HE1  PHE  82           HE1      PHE  82  -2.578   2.544   0.546
  642    HE2  PHE  82           HE2      PHE  82  -6.115   0.144   0.393
  643    HZ   PHE  82           HZ       PHE  82  -3.652   0.329   0.343
  644    H    GLU  83           H        GLU  83  -7.151   7.668  -0.635
  645    HA   GLU  83           HA       GLU  83  -9.573   8.318   0.938
  646    HB2  GLU  83           1HB      GLU  83  -7.449  10.038  -0.354
  647    HB3  GLU  83           2HB      GLU  83  -8.806  10.645   0.627
  648    HG2  GLU  83           1HG      GLU  83  -6.494   8.885   1.647
  649    HG3  GLU  83           2HG      GLU  83  -6.820  10.616   1.895
  650    H    LEU  84           H        LEU  84  -8.999   7.528  -2.210
  651    HA   LEU  84           HA       LEU  84 -10.644   9.432  -3.600
  652    HB2  LEU  84           1HB      LEU  84  -9.985   6.589  -3.969
  653    HB3  LEU  84           2HB      LEU  84 -10.923   7.413  -5.238
  654    HG   LEU  84           HG       LEU  84  -8.099   8.110  -4.338
  655   HD11  LEU  84          1HD1      LEU  84  -7.455   7.347  -6.640
  656   HD12  LEU  84          2HD1      LEU  84  -8.220   6.034  -5.713
  657   HD13  LEU  84          3HD1      LEU  84  -9.152   6.909  -6.952
  658   HD21  LEU  84          3HD2      LEU  84  -9.342  10.090  -4.980
  659   HD22  LEU  84          1HD2      LEU  84  -8.116   9.716  -6.214
  660   HD23  LEU  84          2HD2      LEU  84  -9.828   9.324  -6.512
  661    H    GLU  85           H        GLU  85 -11.396   6.528  -1.746
  662    HA   GLU  85           HA       GLU  85 -13.441   5.616  -1.112
  663    HB2  GLU  85           1HB      GLU  85 -14.298   8.499  -1.417
  664    HB3  GLU  85           2HB      GLU  85 -15.221   7.218  -0.592
  665    HG2  GLU  85           1HG      GLU  85 -13.303   7.022   1.095
  666    HG3  GLU  85           2HG      GLU  85 -12.546   8.326   0.151
  667    H    HIS  86           H        HIS  86 -12.792   5.495  -3.883
  668    HA   HIS  86           HA       HIS  86 -15.558   5.534  -5.041
  669    HB2  HIS  86           1HB      HIS  86 -12.836   5.541  -6.423
  670    HB3  HIS  86           2HB      HIS  86 -14.403   5.403  -7.258
  671    HD1  HIS  86           HD1      HIS  86 -16.068   7.565  -6.104
  672    HD2  HIS  86           HD2      HIS  86 -11.954   8.169  -6.786
  673    HE1  HIS  86           HE1      HIS  86 -15.775   9.977  -6.361
  674    H    HIS  87           H        HIS  87 -13.408   3.532  -3.552
  675    HA   HIS  87           HA       HIS  87 -13.656   1.183  -5.253
  676    HB2  HIS  87           1HB      HIS  87 -11.768   1.285  -3.736
  677    HB3  HIS  87           2HB      HIS  87 -12.841   1.538  -2.338
  678    HD2  HIS  87           HD2      HIS  87 -13.225  -0.842  -0.918
  679    HE1  HIS  87           HE1      HIS  87 -12.511  -3.430  -4.211
  680    HE2  HIS  87           HE2      HIS  87 -13.048  -3.230  -1.645
  681    H    HIS  88           H        HIS  88 -15.397   0.084  -5.631
  682    HA   HIS  88           HA       HIS  88 -17.734   0.161  -3.912
  683    HB2  HIS  88           1HB      HIS  88 -17.974  -0.261  -6.327
  684    HB3  HIS  88           2HB      HIS  88 -16.987  -1.734  -6.183
  685    HD2  HIS  88           HD2      HIS  88 -18.514  -4.059  -5.722
  686    HE1  HIS  88           HE1      HIS  88 -22.043  -1.993  -4.571
  687    HE2  HIS  88           HE2      HIS  88 -20.922  -4.313  -5.095
  688    H    HIS  89           H        HIS  89 -18.277  -0.971  -2.225
  689    HA   HIS  89           HA       HIS  89 -17.285  -3.691  -1.815
  690    HB2  HIS  89           1HB      HIS  89 -16.170  -3.248   0.338
  691    HB3  HIS  89           2HB      HIS  89 -15.352  -2.352  -0.962
  692    HD1  HIS  89           HD1      HIS  89 -15.930   0.257  -1.103
  693    HD2  HIS  89           HD2      HIS  89 -17.105  -1.625   2.479
  694    HE1  HIS  89           HE1      HIS  89 -16.229   2.048   0.532
  695    H    HIS  90           H        HIS  90 -18.094  -4.636   0.223
  696    HA   HIS  90           HA       HIS  90 -20.752  -3.419   0.898
  697    HB2  HIS  90           1HB      HIS  90 -20.091  -6.358   0.402
  698    HB3  HIS  90           2HB      HIS  90 -21.645  -5.747   1.016
  699    HD1  HIS  90           HD1      HIS  90 -22.887  -4.003  -0.688
  700    HD2  HIS  90           HD2      HIS  90 -19.969  -6.509  -2.411
  701    HE1  HIS  90           HE1      HIS  90 -23.382  -4.070  -3.080
  702    H    HIS  91           H        HIS  91 -17.805  -4.772   1.998
  703    HA   HIS  91           HA       HIS  91 -18.890  -4.757   4.794
  704    HB2  HIS  91           1HB      HIS  91 -16.838  -6.652   3.566
  705    HB3  HIS  91           2HB      HIS  91 -17.185  -6.531   5.306
  706    HD2  HIS  91           HD2      HIS  91 -19.335  -8.162   6.168
  707    HE1  HIS  91           HE1      HIS  91 -20.679  -9.101   2.248
  708    HE2  HIS  91           HE2      HIS  91 -20.934  -9.541   4.828
  Start of MODEL   15
    1    H1   MET   1           1H       MET   1 -14.441   1.096   2.596
    2    H2   MET   1           2H       MET   1 -14.384   0.858   4.076
    3    H3   MET   1           3H       MET   1 -14.619   2.241   3.548
    4    HA   MET   1           HA       MET   1 -12.073   1.169   4.196
    5    HB2  MET   1           1HB      MET   1 -12.197   0.186   1.962
    6    HB3  MET   1           2HB      MET   1 -12.449   1.807   1.268
    7    HG2  MET   1           1HG      MET   1 -10.135   1.075   0.963
    8    HG3  MET   1           2HG      MET   1 -10.228   2.493   2.037
    9    HE1  MET   1           3HE      MET   1  -9.479  -1.330   1.719
   10    HE2  MET   1           1HE      MET   1  -9.362  -1.845   3.419
   11    HE3  MET   1           2HE      MET   1 -10.935  -1.350   2.745
   12    H    LYS   2           H        LYS   2 -11.232   2.728   5.308
   13    HA   LYS   2           HA       LYS   2 -10.803   5.339   4.012
   14    HB2  LYS   2           1HB      LYS   2 -13.018   5.561   5.080
   15    HB3  LYS   2           2HB      LYS   2 -12.281   5.119   6.639
   16    HG2  LYS   2           1HG      LYS   2 -10.903   7.122   6.605
   17    HG3  LYS   2           2HG      LYS   2 -11.504   7.542   4.984
   18    HD2  LYS   2           1HD      LYS   2 -13.743   7.875   5.836
   19    HD3  LYS   2           2HD      LYS   2 -13.264   7.279   7.442
   20    HE2  LYS   2           1HE      LYS   2 -11.711   9.170   7.682
   21    HE3  LYS   2           2HE      LYS   2 -12.191   9.768   6.077
   22    HZ1  LYS   2           3HZ      LYS   2 -13.978   9.496   8.408
   23    HZ2  LYS   2           1HZ      LYS   2 -13.357  10.913   7.837
   24    HZ3  LYS   2           2HZ      LYS   2 -14.423  10.050   6.920
   25    H    ILE   3           H        ILE   3  -8.761   5.723   4.240
   26    HA   ILE   3           HA       ILE   3  -7.094   4.499   6.262
   27    HB   ILE   3           HB       ILE   3  -6.328   5.471   3.999
   28   HG12  ILE   3          1HG1      ILE   3  -4.816   6.429   6.411
   29   HG13  ILE   3          2HG1      ILE   3  -4.889   4.731   5.886
   30   HG21  ILE   3          1HG2      ILE   3  -5.724   7.868   4.023
   31   HG22  ILE   3          2HG2      ILE   3  -7.480   7.649   4.207
   32   HG23  ILE   3          3HG2      ILE   3  -6.479   8.043   5.624
   33   HD11  ILE   3          3HD1      ILE   3  -3.797   7.050   4.255
   34   HD12  ILE   3          1HD1      ILE   3  -2.826   5.819   5.093
   35   HD13  ILE   3          2HD1      ILE   3  -3.871   5.352   3.730
   36    H    ILE   4           H        ILE   4  -6.212   5.175   8.105
   37    HA   ILE   4           HA       ILE   4  -7.314   7.725   9.249
   38    HB   ILE   4           HB       ILE   4  -6.010   5.315  10.595
   39   HG12  ILE   4          1HG1      ILE   4  -8.814   6.388  10.774
   40   HG13  ILE   4          2HG1      ILE   4  -8.299   4.970   9.832
   41   HG21  ILE   4          1HG2      ILE   4  -6.499   6.495  12.711
   42   HG22  ILE   4          2HG2      ILE   4  -5.381   7.436  11.697
   43   HG23  ILE   4          3HG2      ILE   4  -7.097   7.896  11.790
   44   HD11  ILE   4          3HD1      ILE   4  -8.106   5.263  12.850
   45   HD12  ILE   4          1HD1      ILE   4  -9.312   4.293  11.972
   46   HD13  ILE   4          2HD1      ILE   4  -7.590   3.846  11.907
   47    H    SER   5           H        SER   5  -4.267   5.873   9.123
   48    HA   SER   5           HA       SER   5  -2.735   8.359   8.567
   49    HB2  SER   5           1HB      SER   5  -1.467   8.450  10.456
   50    HB3  SER   5           2HB      SER   5  -3.185   8.596  10.893
   51    HG   SER   5           HG       SER   5  -2.030   7.203  12.295
   52    H    ILE   6           H        ILE   6  -0.397   7.875   8.472
   53    HA   ILE   6           HA       ILE   6   0.196   4.967   7.988
   54    HB   ILE   6           HB       ILE   6   1.230   7.353   6.387
   55   HG12  ILE   6          1HG1      ILE   6  -0.649   5.150   5.573
   56   HG13  ILE   6          2HG1      ILE   6  -1.096   6.838   5.916
   57   HG21  ILE   6          1HG2      ILE   6   2.289   5.621   4.975
   58   HG22  ILE   6          2HG2      ILE   6   2.882   5.534   6.649
   59   HG23  ILE   6          3HG2      ILE   6   1.682   4.357   6.069
   60   HD11  ILE   6          3HD1      ILE   6   0.754   5.906   3.693
   61   HD12  ILE   6          1HD1      ILE   6  -0.930   6.438   3.490
   62   HD13  ILE   6          2HD1      ILE   6   0.308   7.594   4.038
   63    H    SER   7           H        SER   7   1.815   4.124   8.973
   64    HA   SER   7           HA       SER   7   3.749   5.966  10.410
   65    HB2  SER   7           1HB      SER   7   2.418   4.900  11.943
   66    HB3  SER   7           2HB      SER   7   2.696   3.316  11.187
   67    HG   SER   7           HG       SER   7   4.978   3.728  11.641
   68    H    GLU   8           H        GLU   8   5.820   5.829   9.819
   69    HA   GLU   8           HA       GLU   8   6.806   3.862   7.924
   70    HB2  GLU   8           1HB      GLU   8   8.957   4.817   8.327
   71    HB3  GLU   8           2HB      GLU   8   7.749   6.116   8.165
   72    HG2  GLU   8           1HG      GLU   8   7.748   6.343  10.714
   73    HG3  GLU   8           2HG      GLU   8   8.951   5.033  10.679
   74    H    THR   9           H        THR   9   8.857   2.619   8.463
   75    HA   THR   9           HA       THR   9   8.551   1.237  11.095
   76    HB   THR   9           HB       THR   9   8.557  -0.934  10.106
   77    HG1  THR   9           HG1      THR   9   8.563  -0.014   7.459
   78   HG21  THR   9          3HG2      THR   9   6.701   0.820   8.451
   79   HG22  THR   9          1HG2      THR   9   6.538  -0.935   8.687
   80   HG23  THR   9          2HG2      THR   9   6.348   0.169  10.069
   81    HA   PRO  10           HA       PRO  10  12.903   1.038  11.421
   82    HB2  PRO  10           2HB      PRO  10  13.451  -0.890  12.707
   83    HB3  PRO  10           1HB      PRO  10  12.674  -1.992  11.561
   84    HG2  PRO  10           1HG      PRO  10  11.097  -1.979  13.330
   85    HG3  PRO  10           2HG      PRO  10  11.402  -0.284  13.727
   86    HD2  PRO  10           1HD      PRO  10   9.756  -1.434  11.439
   87    HD3  PRO  10           2HD      PRO  10   9.419  -0.022  12.445
   88    H    ASN  11           H        ASN  11  11.340  -1.155   9.153
   89    HA   ASN  11           HA       ASN  11  13.772  -1.025   7.428
   90    HB2  ASN  11           1HB      ASN  11  12.391  -3.336   7.678
   91    HB3  ASN  11           2HB      ASN  11  11.221  -2.205   6.952
   92   HD21  ASN  11          2HD2      ASN  11  12.308  -4.742   5.968
   93   HD22  ASN  11          1HD2      ASN  11  13.010  -4.390   4.424
   94    H    HIS  12           H        HIS  12  14.009   0.688   6.242
   95    HA   HIS  12           HA       HIS  12  12.060   2.656   5.768
   96    HB2  HIS  12           1HB      HIS  12  14.400   3.164   5.380
   97    HB3  HIS  12           2HB      HIS  12  14.516   1.909   4.124
   98    HD1  HIS  12           HD1      HIS  12  13.044   5.327   4.775
   99    HD2  HIS  12           HD2      HIS  12  13.820   2.789   1.502
  100    HE1  HIS  12           HE1      HIS  12  12.543   6.637   2.774
  101    H    ASN  13           H        ASN  13  12.674  -0.307   3.952
  102    HA   ASN  13           HA       ASN  13  11.596   0.693   1.472
  103    HB2  ASN  13           1HB      ASN  13  12.119  -2.269   2.270
  104    HB3  ASN  13           2HB      ASN  13  11.394  -1.456   0.861
  105   HD21  ASN  13          2HD2      ASN  13  13.784  -3.098   1.036
  106   HD22  ASN  13          1HD2      ASN  13  15.091  -2.118   0.461
  107    H    THR  14           H        THR  14  10.108  -0.521   4.329
  108    HA   THR  14           HA       THR  14   7.505  -0.731   2.852
  109    HB   THR  14           HB       THR  14   8.345  -2.986   3.550
  110    HG1  THR  14           HG1      THR  14   6.375  -3.511   4.671
  111   HG21  THR  14          3HG2      THR  14   8.074  -1.816   6.348
  112   HG22  THR  14          1HG2      THR  14   8.395  -3.523   5.962
  113   HG23  THR  14          2HG2      THR  14   9.600  -2.277   5.558
  114    H    MET  15           H        MET  15   5.689   0.026   3.805
  115    HA   MET  15           HA       MET  15   6.006   1.354   6.468
  116    HB2  MET  15           1HB      MET  15   4.775   2.534   3.978
  117    HB3  MET  15           2HB      MET  15   4.649   3.226   5.612
  118    HG2  MET  15           1HG      MET  15   7.117   3.462   5.665
  119    HG3  MET  15           2HG      MET  15   7.190   2.852   3.995
  120    HE1  MET  15           3HE      MET  15   6.334   5.826   6.360
  121    HE2  MET  15           1HE      MET  15   5.411   6.922   5.305
  122    HE3  MET  15           2HE      MET  15   4.702   5.368   5.811
  123    H    LYS  16           H        LYS  16   4.051   1.772   7.593
  124    HA   LYS  16           HA       LYS  16   2.047  -0.365   6.953
  125    HB2  LYS  16           1HB      LYS  16   3.340  -0.753   8.981
  126    HB3  LYS  16           2HB      LYS  16   2.869   0.849   9.595
  127    HG2  LYS  16           1HG      LYS  16   0.485   0.102   9.563
  128    HG3  LYS  16           2HG      LYS  16   1.041  -1.523   9.097
  129    HD2  LYS  16           1HD      LYS  16   2.313  -1.720  11.164
  130    HD3  LYS  16           2HD      LYS  16   1.876  -0.057  11.622
  131    HE2  LYS  16           1HE      LYS  16  -0.502  -0.709  11.669
  132    HE3  LYS  16           2HE      LYS  16  -0.045  -2.375  11.247
  133    HZ1  LYS  16           3HZ      LYS  16   0.769  -0.941  13.694
  134    HZ2  LYS  16           1HZ      LYS  16  -0.386  -2.118  13.610
  135    HZ3  LYS  16           2HZ      LYS  16   1.193  -2.487  13.302
  136    H    ILE  17           H        ILE  17   0.014   0.098   6.637
  137    HA   ILE  17           HA       ILE  17  -0.864   2.929   7.163
  138    HB   ILE  17           HB       ILE  17  -1.696   0.965   4.980
  139   HG12  ILE  17          1HG1      ILE  17  -1.044   3.211   3.701
  140   HG13  ILE  17          2HG1      ILE  17   0.042   3.343   5.104
  141   HG21  ILE  17          1HG2      ILE  17  -3.222   2.755   4.219
  142   HG22  ILE  17          2HG2      ILE  17  -3.647   2.205   5.857
  143   HG23  ILE  17          3HG2      ILE  17  -2.773   3.738   5.633
  144   HD11  ILE  17          3HD1      ILE  17  -0.113   0.987   3.190
  145   HD12  ILE  17          1HD1      ILE  17   1.162   2.227   3.212
  146   HD13  ILE  17          2HD1      ILE  17   0.973   1.119   4.592
  147    H    THR  18           H        THR  18  -2.373   3.305   8.517
  148    HA   THR  18           HA       THR  18  -3.842   0.975   9.648
  149    HB   THR  18           HB       THR  18  -3.649   3.869  10.585
  150    HG1  THR  18           HG1      THR  18  -2.370   2.873  12.254
  151   HG21  THR  18          3HG2      THR  18  -4.888   1.420  11.901
  152   HG22  THR  18          1HG2      THR  18  -4.731   3.031  12.642
  153   HG23  THR  18          2HG2      THR  18  -5.783   2.800  11.225
  154    H    LEU  19           H        LEU  19  -5.877   0.544   9.328
  155    HA   LEU  19           HA       LEU  19  -7.468   2.526   7.744
  156    HB2  LEU  19           1HB      LEU  19  -7.817  -0.365   8.186
  157    HB3  LEU  19           2HB      LEU  19  -8.820   0.534   7.026
  158    HG   LEU  19           HG       LEU  19  -5.839  -0.037   6.804
  159   HD11  LEU  19          1HD1      LEU  19  -6.524  -1.361   4.786
  160   HD12  LEU  19          2HD1      LEU  19  -7.299  -1.984   6.261
  161   HD13  LEU  19          3HD1      LEU  19  -8.227  -0.972   5.128
  162   HD21  LEU  19          3HD2      LEU  19  -6.356   2.169   5.944
  163   HD22  LEU  19          1HD2      LEU  19  -5.978   1.066   4.599
  164   HD23  LEU  19          2HD2      LEU  19  -7.669   1.503   4.945
  165    H    SER  20           H        SER  20  -9.621   2.917   8.214
  166    HA   SER  20           HA       SER  20 -10.352   2.898  11.070
  167    HB2  SER  20           1HB      SER  20 -12.198   4.071  10.494
  168    HB3  SER  20           2HB      SER  20 -10.816   4.722   9.583
  169    HG   SER  20           HG       SER  20 -12.795   2.950   8.584
  170    H    GLU  21           H        GLU  21 -10.748   0.781   8.339
  171    HA   GLU  21           HA       GLU  21 -13.225  -0.475   9.196
  172    HB2  GLU  21           1HB      GLU  21 -10.988  -1.420   7.395
  173    HB3  GLU  21           2HB      GLU  21 -12.536  -2.267   7.634
  174    HG2  GLU  21           1HG      GLU  21 -12.217   0.519   6.364
  175    HG3  GLU  21           2HG      GLU  21 -12.511  -1.054   5.592
  176    H    SER  22           H        SER  22 -13.581  -2.440  10.157
  177    HA   SER  22           HA       SER  22 -11.730  -3.087  12.364
  178    HB2  SER  22           1HB      SER  22 -13.335  -4.508  13.132
  179    HB3  SER  22           2HB      SER  22 -14.091  -2.973  12.651
  180    HG   SER  22           HG       SER  22 -14.091  -5.396  11.174
  181    H    ARG  23           H        ARG  23 -10.915  -5.199  12.770
  182    HA   ARG  23           HA       ARG  23  -9.871  -6.556  10.391
  183    HB2  ARG  23           1HB      ARG  23  -8.629  -7.892  11.787
  184    HB3  ARG  23           2HB      ARG  23  -8.552  -6.227  12.410
  185    HG2  ARG  23           1HG      ARG  23 -10.199  -6.813  14.149
  186    HG3  ARG  23           2HG      ARG  23 -10.242  -8.483  13.535
  187    HD2  ARG  23           1HD      ARG  23  -7.932  -8.778  14.123
  188    HD3  ARG  23           2HD      ARG  23  -7.842  -7.093  14.682
  189    HE   ARG  23           HE       ARG  23  -9.828  -8.468  16.291
  190   HH11  ARG  23          1HH1      ARG  23  -6.381  -8.515  15.769
  191   HH12  ARG  23          2HH1      ARG  23  -6.131  -9.039  17.423
  192   HH21  ARG  23          2HH2      ARG  23  -7.943  -9.359  18.802
  193   HH22  ARG  23          1HH2      ARG  23  -9.559  -9.075  18.184
  194    H    GLU  24           H        GLU  24 -12.650  -6.859  12.390
  195    HA   GLU  24           HA       GLU  24 -13.113  -9.692  11.952
  196    HB2  GLU  24           1HB      GLU  24 -14.106  -8.352  13.785
  197    HB3  GLU  24           2HB      GLU  24 -15.078  -7.483  12.574
  198    HG2  GLU  24           1HG      GLU  24 -16.209  -9.685  11.974
  199    HG3  GLU  24           2HG      GLU  24 -15.133 -10.407  13.193
  200    H    GLY  25           H        GLY  25 -13.589 -10.679  10.175
  201    HA2  GLY  25           1HA      GLY  25 -15.125 -11.075   8.363
  202    HA3  GLY  25           2HA      GLY  25 -15.401  -9.321   8.238
  203    H    MET  26           H        MET  26 -12.641  -8.542   8.359
  204    HA   MET  26           HA       MET  26 -11.965  -9.006   5.532
  205    HB2  MET  26           1HB      MET  26 -10.592  -7.401   7.688
  206    HB3  MET  26           2HB      MET  26 -10.183  -7.395   5.956
  207    HG2  MET  26           1HG      MET  26 -12.415  -6.484   5.444
  208    HG3  MET  26           2HG      MET  26 -12.797  -6.464   7.182
  209    HE1  MET  26           3HE      MET  26 -11.496  -4.521   4.219
  210    HE2  MET  26           1HE      MET  26 -10.177  -3.502   4.847
  211    HE3  MET  26           2HE      MET  26  -9.940  -5.259   4.675
  212    H    THR  27           H        THR  27 -10.301 -10.072   4.683
  213    HA   THR  27           HA       THR  27  -8.714 -11.749   6.607
  214    HB   THR  27           HB       THR  27  -8.647 -13.491   4.892
  215    HG1  THR  27           HG1      THR  27 -10.262 -11.685   3.371
  216   HG21  THR  27          3HG2      THR  27 -11.485 -12.486   5.341
  217   HG22  THR  27          1HG2      THR  27 -11.030 -14.139   4.865
  218   HG23  THR  27          2HG2      THR  27 -10.555 -13.510   6.462
  219    H    SER  28           H        SER  28  -6.657 -12.553   5.750
  220    HA   SER  28           HA       SER  28  -5.016 -10.299   4.786
  221    HB2  SER  28           1HB      SER  28  -3.202 -11.625   5.138
  222    HB3  SER  28           2HB      SER  28  -4.313 -11.779   6.519
  223    HG   SER  28           HG       SER  28  -3.458 -13.791   5.838
  224    H    ASP  29           H        ASP  29  -3.668 -10.372   2.938
  225    HA   ASP  29           HA       ASP  29  -3.882 -12.445   0.926
  226    HB2  ASP  29           1HB      ASP  29  -6.124 -10.904   0.755
  227    HB3  ASP  29           2HB      ASP  29  -4.870  -9.845   0.062
  228    H    THR  30           H        THR  30  -2.622 -12.035  -0.959
  229    HA   THR  30           HA       THR  30  -0.571  -9.893  -0.491
  230    HB   THR  30           HB       THR  30  -0.167 -12.657  -1.709
  231    HG1  THR  30           HG1      THR  30   1.137 -12.933   0.198
  232   HG21  THR  30          3HG2      THR  30   1.800 -10.407  -1.127
  233   HG22  THR  30          1HG2      THR  30   2.220 -12.025  -1.737
  234   HG23  THR  30          2HG2      THR  30   1.253 -10.918  -2.741
  235    H    TYR  31           H        TYR  31  -0.160  -8.508  -2.032
  236    HA   TYR  31           HA       TYR  31  -1.363  -9.042  -4.729
  237    HB2  TYR  31           1HB      TYR  31  -1.310  -6.411  -3.240
  238    HB3  TYR  31           2HB      TYR  31  -1.988  -6.713  -4.859
  239    HD1  TYR  31           HD1      TYR  31  -2.655  -6.686  -1.324
  240    HD2  TYR  31           HD2      TYR  31  -3.966  -8.330  -5.032
  241    HE1  TYR  31           HE1      TYR  31  -4.843  -7.234  -0.298
  242    HE2  TYR  31           HE2      TYR  31  -6.155  -8.884  -4.024
  243    HH   TYR  31           HH       TYR  31  -6.902  -8.138  -0.613
  244    H    THR  32           H        THR  32   0.249  -9.363  -6.055
  245    HA   THR  32           HA       THR  32   2.626  -7.542  -5.831
  246    HB   THR  32           HB       THR  32   3.933  -9.353  -6.897
  247    HG1  THR  32           HG1      THR  32   2.951 -11.394  -7.168
  248   HG21  THR  32          3HG2      THR  32   2.413 -10.268  -4.423
  249   HG22  THR  32          1HG2      THR  32   3.975 -10.910  -4.981
  250   HG23  THR  32          2HG2      THR  32   3.853  -9.222  -4.432
  251    H    LYS  33           H        LYS  33   0.600  -9.373  -8.124
  252    HA   LYS  33           HA       LYS  33   1.353  -7.336 -10.198
  253    HB2  LYS  33           1HB      LYS  33   0.466 -10.211 -10.477
  254    HB3  LYS  33           2HB      LYS  33   0.639  -9.067 -11.829
  255    HG2  LYS  33           1HG      LYS  33   3.048  -8.830 -11.281
  256    HG3  LYS  33           2HG      LYS  33   2.853 -10.045  -9.995
  257    HD2  LYS  33           1HD      LYS  33   2.137 -11.702 -11.673
  258    HD3  LYS  33           2HD      LYS  33   2.341 -10.487 -12.957
  259    HE2  LYS  33           1HE      LYS  33   4.729 -10.310 -12.419
  260    HE3  LYS  33           2HE      LYS  33   4.531 -11.518 -11.128
  261    HZ1  LYS  33           3HZ      LYS  33   4.075 -11.992 -14.004
  262    HZ2  LYS  33           1HZ      LYS  33   5.387 -12.504 -13.144
  263    HZ3  LYS  33           2HZ      LYS  33   3.891 -13.112 -12.807
  264    H    VAL  34           H        VAL  34  -0.177  -6.377 -11.430
  265    HA   VAL  34           HA       VAL  34  -2.707  -5.878 -10.114
  266    HB   VAL  34           HB       VAL  34  -1.782  -5.266 -12.952
  267   HG11  VAL  34          1HG1      VAL  34  -3.644  -3.640 -12.969
  268   HG12  VAL  34          2HG1      VAL  34  -4.246  -5.301 -12.761
  269   HG13  VAL  34          3HG1      VAL  34  -4.154  -4.205 -11.363
  270   HG21  VAL  34          3HG2      VAL  34  -0.403  -4.195 -11.271
  271   HG22  VAL  34          1HG2      VAL  34  -1.422  -3.001 -12.109
  272   HG23  VAL  34          2HG2      VAL  34  -1.853  -3.544 -10.468
  273    H    ASP  35           H        ASP  35  -4.551  -6.814 -10.120
  274    HA   ASP  35           HA       ASP  35  -5.387  -8.419 -12.463
  275    HB2  ASP  35           1HB      ASP  35  -4.131  -9.965 -10.681
  276    HB3  ASP  35           2HB      ASP  35  -5.575  -9.506  -9.744
  277    H    ASP  36           H        ASP  36  -7.566  -8.718 -12.670
  278    HA   ASP  36           HA       ASP  36  -9.125  -6.537 -11.621
  279    HB2  ASP  36           1HB      ASP  36  -9.979  -9.059 -13.163
  280    HB3  ASP  36           2HB      ASP  36 -10.985  -7.723 -12.552
  281    H    SER  37           H        SER  37  -8.594  -9.806 -10.540
  282    HA   SER  37           HA       SER  37 -10.888 -10.077  -8.773
  283    HB2  SER  37           1HB      SER  37  -9.774 -11.835  -7.801
  284    HB3  SER  37           2HB      SER  37  -9.643 -11.915  -9.572
  285    HG   SER  37           HG       SER  37  -7.534 -11.314  -9.437
  286    H    GLN  38           H        GLN  38  -8.016  -8.145  -8.666
  287    HA   GLN  38           HA       GLN  38  -7.995  -8.001  -5.705
  288    HB2  GLN  38           1HB      GLN  38  -6.337  -6.485  -7.729
  289    HB3  GLN  38           2HB      GLN  38  -6.046  -6.623  -5.980
  290    HG2  GLN  38           1HG      GLN  38  -5.437  -9.183  -6.379
  291    HG3  GLN  38           2HG      GLN  38  -6.114  -8.728  -7.959
  292   HE21  GLN  38          2HE2      GLN  38  -3.446  -9.847  -7.064
  293   HE22  GLN  38          1HE2      GLN  38  -2.272  -8.782  -7.767
  294    HA   PRO  39           HA       PRO  39 -10.357  -4.344  -5.179
  295    HB2  PRO  39           2HB      PRO  39  -9.712  -3.477  -3.062
  296    HB3  PRO  39           1HB      PRO  39  -8.016  -3.318  -3.537
  297    HG2  PRO  39           1HG      PRO  39  -7.904  -5.212  -2.125
  298    HG3  PRO  39           2HG      PRO  39  -9.510  -5.785  -2.594
  299    HD2  PRO  39           1HD      PRO  39  -6.886  -6.013  -4.124
  300    HD3  PRO  39           2HD      PRO  39  -8.183  -7.205  -3.962
  301    H    ALA  40           H        ALA  40 -10.642  -2.461  -6.121
  302    HA   ALA  40           HA       ALA  40  -8.902  -1.484  -8.118
  303    HB1  ALA  40           3HB      ALA  40 -10.933   0.046  -6.457
  304    HB2  ALA  40           1HB      ALA  40 -10.216   0.596  -7.989
  305    HB3  ALA  40           2HB      ALA  40 -11.265  -0.842  -7.963
  306    H    PHE  41           H        PHE  41  -9.152  -0.581  -4.685
  307    HA   PHE  41           HA       PHE  41  -7.200   1.568  -4.936
  308    HB2  PHE  41           1HB      PHE  41  -7.312   1.567  -2.429
  309    HB3  PHE  41           2HB      PHE  41  -8.916   1.675  -3.191
  310    HD1  PHE  41           HD1      PHE  41  -6.553  -0.626  -1.513
  311    HD2  PHE  41           HD2      PHE  41 -10.571   0.099  -2.767
  312    HE1  PHE  41           HE1      PHE  41  -7.316  -2.562  -0.179
  313    HE2  PHE  41           HE2      PHE  41 -11.340  -1.832  -1.433
  314    HZ   PHE  41           HZ       PHE  41  -9.710  -3.166  -0.138
  315    H    ILE  42           H        ILE  42  -6.934  -1.817  -4.778
  316    HA   ILE  42           HA       ILE  42  -4.065  -1.651  -3.995
  317    HB   ILE  42           HB       ILE  42  -5.833  -3.950  -4.944
  318   HG12  ILE  42          1HG1      ILE  42  -6.297  -3.248  -2.709
  319   HG13  ILE  42          2HG1      ILE  42  -5.502  -4.838  -2.733
  320   HG21  ILE  42          1HG2      ILE  42  -3.882  -5.398  -4.492
  321   HG22  ILE  42          2HG2      ILE  42  -3.520  -4.222  -5.776
  322   HG23  ILE  42          3HG2      ILE  42  -2.898  -3.961  -4.131
  323   HD11  ILE  42          3HD1      ILE  42  -4.162  -2.191  -2.078
  324   HD12  ILE  42          1HD1      ILE  42  -4.635  -3.439  -0.901
  325   HD13  ILE  42          2HD1      ILE  42  -3.367  -3.782  -2.103
  326    H    ASN  43           H        ASN  43  -6.044  -2.081  -6.892
  327    HA   ASN  43           HA       ASN  43  -3.827  -2.740  -8.608
  328    HB2  ASN  43           1HB      ASN  43  -6.616  -1.647  -9.454
  329    HB3  ASN  43           2HB      ASN  43  -5.111  -2.070 -10.308
  330   HD21  ASN  43          2HD2      ASN  43  -7.851  -3.215 -10.364
  331   HD22  ASN  43          1HD2      ASN  43  -7.641  -4.905 -10.047
  332    H    ASP  44           H        ASP  44  -5.467   0.341  -7.907
  333    HA   ASP  44           HA       ASP  44  -4.037   1.957  -9.742
  334    HB2  ASP  44           1HB      ASP  44  -5.174   2.680  -6.975
  335    HB3  ASP  44           2HB      ASP  44  -4.376   3.729  -8.172
  336    H    ILE  45           H        ILE  45  -3.207   1.127  -6.374
  337    HA   ILE  45           HA       ILE  45  -0.768   2.705  -6.382
  338    HB   ILE  45           HB       ILE  45  -1.704   0.392  -4.626
  339   HG12  ILE  45          1HG1      ILE  45  -1.518   3.329  -4.020
  340   HG13  ILE  45          2HG1      ILE  45  -2.994   2.505  -4.575
  341   HG21  ILE  45          1HG2      ILE  45   0.121   1.056  -3.098
  342   HG22  ILE  45          2HG2      ILE  45   0.764   0.523  -4.667
  343   HG23  ILE  45          3HG2      ILE  45   0.679   2.258  -4.284
  344   HD11  ILE  45          3HD1      ILE  45  -1.465   1.888  -2.022
  345   HD12  ILE  45          1HD1      ILE  45  -2.998   2.783  -2.128
  346   HD13  ILE  45          2HD1      ILE  45  -2.940   1.062  -2.578
  347    H    LEU  46           H        LEU  46  -1.404  -0.742  -6.934
  348    HA   LEU  46           HA       LEU  46   1.272  -1.561  -7.347
  349    HB2  LEU  46           1HB      LEU  46  -1.314  -2.269  -8.539
  350    HB3  LEU  46           2HB      LEU  46   0.103  -3.218  -9.043
  351    HG   LEU  46           HG       LEU  46  -1.011  -2.986  -6.220
  352   HD11  LEU  46          1HD1      LEU  46  -1.520  -5.427  -6.506
  353   HD12  LEU  46          2HD1      LEU  46  -2.371  -4.443  -7.720
  354   HD13  LEU  46          3HD1      LEU  46  -0.904  -5.344  -8.173
  355   HD21  LEU  46          3HD2      LEU  46   1.407  -3.153  -6.200
  356   HD22  LEU  46          1HD2      LEU  46   0.690  -4.676  -5.622
  357   HD23  LEU  46          2HD2      LEU  46   1.348  -4.571  -7.273
  358    H    LYS  47           H        LYS  47  -0.920   0.163  -9.511
  359    HA   LYS  47           HA       LYS  47   0.851  -0.110 -11.818
  360    HB2  LYS  47           1HB      LYS  47  -1.539   1.640 -11.233
  361    HB3  LYS  47           2HB      LYS  47  -0.654   1.645 -12.777
  362    HG2  LYS  47           1HG      LYS  47  -1.243  -0.686 -13.162
  363    HG3  LYS  47           2HG      LYS  47  -2.040  -0.773 -11.573
  364    HD2  LYS  47           1HD      LYS  47  -3.661   0.935 -12.293
  365    HD3  LYS  47           2HD      LYS  47  -2.867   1.017 -13.883
  366    HE2  LYS  47           1HE      LYS  47  -3.388  -1.362 -14.256
  367    HE3  LYS  47           2HE      LYS  47  -4.205  -1.424 -12.677
  368    HZ1  LYS  47           3HZ      LYS  47  -5.008   0.264 -14.959
  369    HZ2  LYS  47           1HZ      LYS  47  -5.767  -1.118 -14.476
  370    HZ3  LYS  47           2HZ      LYS  47  -5.767   0.207 -13.496
  371    H    VAL  48           H        VAL  48   0.647   2.020  -9.108
  372    HA   VAL  48           HA       VAL  48   2.095   4.269 -10.234
  373    HB   VAL  48           HB       VAL  48   1.912   3.222  -7.379
  374   HG11  VAL  48          1HG1      VAL  48   2.746   5.458  -6.735
  375   HG12  VAL  48          2HG1      VAL  48   3.939   4.590  -7.729
  376   HG13  VAL  48          3HG1      VAL  48   2.947   5.877  -8.452
  377   HG21  VAL  48          3HG2      VAL  48  -0.236   3.900  -8.272
  378   HG22  VAL  48          1HG2      VAL  48   0.334   5.059  -7.050
  379   HG23  VAL  48          2HG2      VAL  48   0.447   5.464  -8.778
  380    H    GLU  49           H        GLU  49   4.031   4.498 -10.897
  381    HA   GLU  49           HA       GLU  49   5.944   2.373 -10.893
  382    HB2  GLU  49           1HB      GLU  49   5.898   4.264 -12.480
  383    HB3  GLU  49           2HB      GLU  49   6.407   5.348 -11.162
  384    HG2  GLU  49           1HG      GLU  49   8.582   4.038 -10.986
  385    HG3  GLU  49           2HG      GLU  49   7.906   3.010 -12.270
  386    H    GLY  50           H        GLY  50   7.264   1.601  -9.461
  387    HA2  GLY  50           1HA      GLY  50   9.128   2.140  -7.929
  388    HA3  GLY  50           2HA      GLY  50   8.087   3.389  -7.206
  389    H    VAL  51           H        VAL  51   5.705   1.614  -7.384
  390    HA   VAL  51           HA       VAL  51   5.963   0.365  -4.755
  391    HB   VAL  51           HB       VAL  51   3.782   0.162  -6.873
  392   HG11  VAL  51          1HG1      VAL  51   2.385  -0.694  -5.023
  393   HG12  VAL  51          2HG1      VAL  51   3.774  -1.763  -5.324
  394   HG13  VAL  51          3HG1      VAL  51   3.794  -0.648  -3.938
  395   HG21  VAL  51          3HG2      VAL  51   4.072   2.428  -6.068
  396   HG22  VAL  51          1HG2      VAL  51   2.557   1.727  -5.453
  397   HG23  VAL  51          2HG2      VAL  51   3.973   1.861  -4.382
  398    H    LYS  52           H        LYS  52   6.483  -1.550  -4.137
  399    HA   LYS  52           HA       LYS  52   7.407  -3.410  -6.273
  400    HB2  LYS  52           1HB      LYS  52   8.988  -2.731  -4.533
  401    HB3  LYS  52           2HB      LYS  52   7.891  -3.375  -3.289
  402    HG2  LYS  52           1HG      LYS  52   8.175  -5.637  -4.187
  403    HG3  LYS  52           2HG      LYS  52   9.236  -5.008  -5.469
  404    HD2  LYS  52           1HD      LYS  52  10.821  -4.211  -3.746
  405    HD3  LYS  52           2HD      LYS  52   9.766  -4.886  -2.480
  406    HE2  LYS  52           1HE      LYS  52  10.075  -7.131  -3.379
  407    HE3  LYS  52           2HE      LYS  52  11.063  -6.485  -4.708
  408    HZ1  LYS  52           3HZ      LYS  52  11.751  -6.353  -1.843
  409    HZ2  LYS  52           1HZ      LYS  52  12.424  -7.381  -2.944
  410    HZ3  LYS  52           2HZ      LYS  52  12.668  -5.754  -3.077
  411    H    SER  53           H        SER  53   5.682  -3.630  -3.144
  412    HA   SER  53           HA       SER  53   3.741  -5.577  -4.311
  413    HB2  SER  53           1HB      SER  53   4.196  -7.356  -2.983
  414    HB3  SER  53           2HB      SER  53   5.670  -6.926  -3.879
  415    HG   SER  53           HG       SER  53   6.350  -5.836  -1.937
  416    H    ILE  54           H        ILE  54   1.964  -5.927  -2.953
  417    HA   ILE  54           HA       ILE  54   1.867  -4.286  -0.435
  418    HB   ILE  54           HB       ILE  54  -0.372  -4.699  -2.471
  419   HG12  ILE  54          1HG1      ILE  54   1.015  -2.145  -1.713
  420   HG13  ILE  54          2HG1      ILE  54   1.439  -3.131  -3.133
  421   HG21  ILE  54          1HG2      ILE  54  -1.645  -3.163  -1.012
  422   HG22  ILE  54          2HG2      ILE  54  -1.167  -4.631  -0.131
  423   HG23  ILE  54          3HG2      ILE  54  -0.280  -3.110   0.127
  424   HD11  ILE  54          3HD1      ILE  54  -1.261  -1.841  -2.606
  425   HD12  ILE  54          1HD1      ILE  54  -0.037  -1.261  -3.758
  426   HD13  ILE  54          2HD1      ILE  54  -0.837  -2.828  -4.024
  427    H    PHE  55           H        PHE  55   1.059  -5.127   1.322
  428    HA   PHE  55           HA       PHE  55  -0.259  -7.811   1.077
  429    HB2  PHE  55           1HB      PHE  55   2.036  -8.122   1.941
  430    HB3  PHE  55           2HB      PHE  55   1.725  -6.924   3.218
  431    HD1  PHE  55           HD1      PHE  55   0.431 -10.155   1.877
  432    HD2  PHE  55           HD2      PHE  55   0.997  -7.616   5.268
  433    HE1  PHE  55           HE1      PHE  55  -0.396 -11.952   3.360
  434    HE2  PHE  55           HE2      PHE  55   0.175  -9.413   6.753
  435    HZ   PHE  55           HZ       PHE  55  -0.525 -11.580   5.798
  436    H    HIS  56           H        HIS  56  -2.158  -8.003   1.963
  437    HA   HIS  56           HA       HIS  56  -2.990  -5.932   3.964
  438    HB2  HIS  56           1HB      HIS  56  -4.402  -5.949   1.934
  439    HB3  HIS  56           2HB      HIS  56  -4.703  -7.689   2.150
  440    HD1  HIS  56           HD1      HIS  56  -6.349  -8.410   3.978
  441    HD2  HIS  56           HD2      HIS  56  -5.910  -4.225   3.749
  442    HE1  HIS  56           HE1      HIS  56  -8.226  -7.466   5.226
  443    H    VAL  57           H        VAL  57  -3.658  -6.458   5.931
  444    HA   VAL  57           HA       VAL  57  -4.655  -9.165   6.527
  445    HB   VAL  57           HB       VAL  57  -2.216  -9.522   6.805
  446   HG11  VAL  57          1HG1      VAL  57  -1.001  -8.272   8.559
  447   HG12  VAL  57          2HG1      VAL  57  -1.569  -7.183   7.272
  448   HG13  VAL  57          3HG1      VAL  57  -2.436  -7.253   8.825
  449   HG21  VAL  57          3HG2      VAL  57  -3.766 -10.712   8.239
  450   HG22  VAL  57          1HG2      VAL  57  -2.272 -10.311   9.118
  451   HG23  VAL  57          2HG2      VAL  57  -3.751  -9.365   9.403
  452    H    MET  58           H        MET  58  -6.133  -9.186   8.003
  453    HA   MET  58           HA       MET  58  -7.645  -8.346   9.563
  454    HB2  MET  58           1HB      MET  58  -5.013  -7.257  10.531
  455    HB3  MET  58           2HB      MET  58  -6.541  -6.964  11.395
  456    HG2  MET  58           1HG      MET  58  -6.857  -9.368  11.692
  457    HG3  MET  58           2HG      MET  58  -5.365  -9.691  10.777
  458    HE1  MET  58           3HE      MET  58  -4.439 -11.213  12.756
  459    HE2  MET  58           1HE      MET  58  -4.352 -10.682  14.452
  460    HE3  MET  58           2HE      MET  58  -5.936 -10.919  13.674
  461    H    ASP  59           H        ASP  59  -5.849  -5.467  10.198
  462    HA   ASP  59           HA       ASP  59  -7.976  -3.906   8.784
  463    HB2  ASP  59           1HB      ASP  59  -8.488  -2.654  10.857
  464    HB3  ASP  59           2HB      ASP  59  -8.642  -4.425  10.988
  465    H    PHE  60           H        PHE  60  -5.021  -4.389   8.437
  466    HA   PHE  60           HA       PHE  60  -4.464  -1.540   7.880
  467    HB2  PHE  60           1HB      PHE  60  -2.275  -1.543   8.952
  468    HB3  PHE  60           2HB      PHE  60  -3.500  -1.952  10.175
  469    HD1  PHE  60           HD1      PHE  60  -0.640  -3.126   8.249
  470    HD2  PHE  60           HD2      PHE  60  -3.662  -4.189  11.077
  471    HE1  PHE  60           HE1      PHE  60   0.632  -5.162   8.841
  472    HE2  PHE  60           HE2      PHE  60  -2.393  -6.225  11.673
  473    HZ   PHE  60           HZ       PHE  60  -0.245  -6.712  10.553
  474    H    ILE  61           H        ILE  61  -2.600  -1.226   6.502
  475    HA   ILE  61           HA       ILE  61  -2.089  -3.642   4.783
  476    HB   ILE  61           HB       ILE  61  -2.586  -0.762   3.897
  477   HG12  ILE  61          1HG1      ILE  61  -4.178  -3.242   3.308
  478   HG13  ILE  61          2HG1      ILE  61  -4.578  -2.053   4.569
  479   HG21  ILE  61          1HG2      ILE  61  -2.331  -1.663   1.610
  480   HG22  ILE  61          2HG2      ILE  61  -0.840  -1.886   2.554
  481   HG23  ILE  61          3HG2      ILE  61  -1.934  -3.261   2.284
  482   HD11  ILE  61          3HD1      ILE  61  -4.399  -1.492   1.588
  483   HD12  ILE  61          1HD1      ILE  61  -5.899  -1.664   2.526
  484   HD13  ILE  61          2HD1      ILE  61  -4.799  -0.302   2.849
  485    H    SER  62           H        SER  62  -0.128  -4.136   4.294
  486    HA   SER  62           HA       SER  62   2.092  -2.240   5.066
  487    HB2  SER  62           1HB      SER  62   2.191  -4.300   6.119
  488    HB3  SER  62           2HB      SER  62   2.101  -5.154   4.562
  489    HG   SER  62           HG       SER  62   4.248  -4.910   5.318
  490    H    VAL  63           H        VAL  63   2.737  -0.976   3.423
  491    HA   VAL  63           HA       VAL  63   2.901  -2.178   0.662
  492    HB   VAL  63           HB       VAL  63   2.562   0.741   1.462
  493   HG11  VAL  63          1HG1      VAL  63   2.312   1.106  -0.970
  494   HG12  VAL  63          2HG1      VAL  63   3.906   0.418  -0.587
  495   HG13  VAL  63          3HG1      VAL  63   2.627  -0.620  -1.262
  496   HG21  VAL  63          3HG2      VAL  63   0.518  -0.502   1.838
  497   HG22  VAL  63          1HG2      VAL  63   0.353   0.575   0.432
  498   HG23  VAL  63          2HG2      VAL  63   0.599  -1.170   0.192
  499    H    ASP  64           H        ASP  64   4.737  -2.384  -0.278
  500    HA   ASP  64           HA       ASP  64   7.068  -0.868   0.842
  501    HB2  ASP  64           1HB      ASP  64   8.460  -2.927   0.669
  502    HB3  ASP  64           2HB      ASP  64   7.002  -3.052   1.684
  503    H    LYS  65           H        LYS  65   8.697  -0.312  -0.541
  504    HA   LYS  65           HA       LYS  65   7.950  -0.520  -3.443
  505    HB2  LYS  65           1HB      LYS  65   8.950   1.720  -3.694
  506    HB3  LYS  65           2HB      LYS  65   7.460   1.689  -2.721
  507    HG2  LYS  65           1HG      LYS  65   8.896   3.176  -1.581
  508    HG3  LYS  65           2HG      LYS  65   8.990   1.651  -0.669
  509    HD2  LYS  65           1HD      LYS  65  11.059   1.078  -1.957
  510    HD3  LYS  65           2HD      LYS  65  10.992   2.694  -2.700
  511    HE2  LYS  65           1HE      LYS  65  10.880   2.511   0.279
  512    HE3  LYS  65           2HE      LYS  65  12.438   2.190  -0.516
  513    HZ1  LYS  65           3HZ      LYS  65  10.818   4.633  -0.845
  514    HZ2  LYS  65           1HZ      LYS  65  12.194   4.509   0.057
  515    HZ3  LYS  65           2HZ      LYS  65  12.264   4.336  -1.582
  516    H    GLU  66           H        GLU  66   9.822   0.109  -4.883
  517    HA   GLU  66           HA       GLU  66  11.921  -1.841  -4.312
  518    HB2  GLU  66           1HB      GLU  66  11.531   0.136  -6.563
  519    HB3  GLU  66           2HB      GLU  66  12.821  -1.089  -6.491
  520    HG2  GLU  66           1HG      GLU  66  10.988  -2.892  -6.474
  521    HG3  GLU  66           2HG      GLU  66   9.866  -1.519  -6.600
  522    H    ASN  67           H        ASN  67  14.182  -1.454  -4.395
  523    HA   ASN  67           HA       ASN  67  14.935   0.400  -2.375
  524    HB2  ASN  67           1HB      ASN  67  16.844  -1.054  -4.357
  525    HB3  ASN  67           2HB      ASN  67  17.050   0.111  -3.028
  526   HD21  ASN  67          2HD2      ASN  67  17.927  -2.691  -3.361
  527   HD22  ASN  67          1HD2      ASN  67  17.318  -3.531  -1.974
  528    H    ASP  68           H        ASP  68  15.102   0.657  -5.908
  529    HA   ASP  68           HA       ASP  68  16.487   3.201  -5.895
  530    HB2  ASP  68           1HB      ASP  68  14.784   1.838  -8.066
  531    HB3  ASP  68           2HB      ASP  68  15.620   3.409  -8.113
  532    H    ALA  69           H        ALA  69  13.073   2.262  -5.914
  533    HA   ALA  69           HA       ALA  69  12.068   4.881  -6.492
  534    HB1  ALA  69           3HB      ALA  69  10.751   2.570  -5.023
  535    HB2  ALA  69           1HB      ALA  69   9.917   3.999  -5.675
  536    HB3  ALA  69           2HB      ALA  69  10.715   2.855  -6.780
  537    H    ASN  70           H        ASN  70  11.009   6.382  -5.150
  538    HA   ASN  70           HA       ASN  70  11.872   6.272  -2.275
  539    HB2  ASN  70           1HB      ASN  70  11.626   8.935  -3.856
  540    HB3  ASN  70           2HB      ASN  70  11.909   8.412  -2.178
  541   HD21  ASN  70          2HD2      ASN  70  13.256   8.917  -5.292
  542   HD22  ASN  70          1HD2      ASN  70  14.893   8.499  -4.906
  543    H    TRP  71           H        TRP  71  10.493   7.012  -0.710
  544    HA   TRP  71           HA       TRP  71   7.665   6.655  -1.263
  545    HB2  TRP  71           1HB      TRP  71   9.245   7.572   1.167
  546    HB3  TRP  71           2HB      TRP  71   7.466   7.529   1.148
  547    HD1  TRP  71           HD1      TRP  71  10.221   5.633   2.133
  548    HE1  TRP  71           HE1      TRP  71   9.620   3.016   2.453
  549    HE3  TRP  71           HE3      TRP  71   5.791   5.586  -0.359
  550    HZ2  TRP  71           HZ2      TRP  71   7.535   1.371   1.694
  551    HZ3  TRP  71           HZ3      TRP  71   4.530   3.532  -0.556
  552    HH2  TRP  71           HH2      TRP  71   5.331   1.430   0.433
  553    H    GLU  72           H        GLU  72   9.812   9.341  -1.430
  554    HA   GLU  72           HA       GLU  72   8.031  11.501  -0.947
  555    HB2  GLU  72           1HB      GLU  72  10.328  11.188  -2.879
  556    HB3  GLU  72           2HB      GLU  72   9.468  12.722  -2.603
  557    HG2  GLU  72           1HG      GLU  72  10.216  12.680  -0.186
  558    HG3  GLU  72           2HG      GLU  72  10.930  11.094  -0.564
  559    H    THR  73           H        THR  73   8.520   9.561  -3.879
  560    HA   THR  73           HA       THR  73   6.323  11.001  -5.241
  561    HB   THR  73           HB       THR  73   7.936   8.552  -6.075
  562    HG1  THR  73           HG1      THR  73   8.918  10.115  -7.491
  563   HG21  THR  73          3HG2      THR  73   5.999  10.303  -7.640
  564   HG22  THR  73          1HG2      THR  73   6.975   8.974  -8.310
  565   HG23  THR  73          2HG2      THR  73   5.698   8.629  -7.119
  566    H    VAL  74           H        VAL  74   6.922   7.769  -3.852
  567    HA   VAL  74           HA       VAL  74   4.439   6.687  -4.944
  568    HB   VAL  74           HB       VAL  74   6.341   5.662  -2.796
  569   HG11  VAL  74          1HG1      VAL  74   5.171   3.503  -3.083
  570   HG12  VAL  74          2HG1      VAL  74   4.060   4.759  -2.491
  571   HG13  VAL  74          3HG1      VAL  74   4.023   4.274  -4.202
  572   HG21  VAL  74          3HG2      VAL  74   7.359   5.799  -4.989
  573   HG22  VAL  74          1HG2      VAL  74   7.078   4.104  -4.527
  574   HG23  VAL  74          2HG2      VAL  74   5.998   4.896  -5.699
  575    H    LEU  75           H        LEU  75   5.362   7.928  -1.734
  576    HA   LEU  75           HA       LEU  75   3.209   6.542  -0.434
  577    HB2  LEU  75           1HB      LEU  75   5.203   7.204   0.577
  578    HB3  LEU  75           2HB      LEU  75   4.868   8.948   0.500
  579    HG   LEU  75           HG       LEU  75   2.821   8.525   1.914
  580   HD11  LEU  75          1HD1      LEU  75   2.771   6.381   3.215
  581   HD12  LEU  75          2HD1      LEU  75   2.626   6.080   1.467
  582   HD13  LEU  75          3HD1      LEU  75   4.179   5.807   2.293
  583   HD21  LEU  75          3HD2      LEU  75   4.847   9.447   2.871
  584   HD22  LEU  75          1HD2      LEU  75   4.073   8.346   4.035
  585   HD23  LEU  75          2HD2      LEU  75   5.507   7.814   3.123
  586    HA   PRO  76           HA       PRO  76   1.055  10.976  -0.548
  587    HB2  PRO  76           2HB      PRO  76   1.693  12.710  -2.074
  588    HB3  PRO  76           1HB      PRO  76   2.130  11.565  -3.349
  589    HG2  PRO  76           1HG      PRO  76   4.261  12.225  -2.527
  590    HG3  PRO  76           2HG      PRO  76   3.698  12.322  -0.854
  591    HD2  PRO  76           1HD      PRO  76   4.382   9.851  -2.492
  592    HD3  PRO  76           2HD      PRO  76   4.695  10.171  -0.781
  593    H    LYS  77           H        LYS  77   1.732   9.052  -3.469
  594    HA   LYS  77           HA       LYS  77  -1.011   9.206  -4.405
  595    HB2  LYS  77           1HB      LYS  77   1.268   7.326  -5.032
  596    HB3  LYS  77           2HB      LYS  77  -0.312   7.295  -5.848
  597    HG2  LYS  77           1HG      LYS  77   0.049   9.558  -6.695
  598    HG3  LYS  77           2HG      LYS  77   1.599   9.654  -5.827
  599    HD2  LYS  77           1HD      LYS  77   2.447   7.749  -7.162
  600    HD3  LYS  77           2HD      LYS  77   0.908   7.710  -8.055
  601    HE2  LYS  77           1HE      LYS  77   1.300   9.990  -8.860
  602    HE3  LYS  77           2HE      LYS  77   2.824  10.060  -7.944
  603    HZ1  LYS  77           3HZ      LYS  77   2.236   8.197 -10.156
  604    HZ2  LYS  77           1HZ      LYS  77   3.197   9.532 -10.258
  605    HZ3  LYS  77           2HZ      LYS  77   3.648   8.261  -9.307
  606    H    VAL  78           H        VAL  78   0.840   6.748  -2.610
  607    HA   VAL  78           HA       VAL  78  -1.217   4.782  -2.392
  608    HB   VAL  78           HB       VAL  78   0.974   5.578  -0.433
  609   HG11  VAL  78          1HG1      VAL  78   0.558   3.381   0.620
  610   HG12  VAL  78          2HG1      VAL  78  -0.879   4.425   0.727
  611   HG13  VAL  78          3HG1      VAL  78  -0.818   3.115  -0.476
  612   HG21  VAL  78          3HG2      VAL  78   1.815   4.786  -2.562
  613   HG22  VAL  78          1HG2      VAL  78   2.115   3.590  -1.280
  614   HG23  VAL  78          2HG2      VAL  78   0.794   3.331  -2.447
  615    H    GLU  79           H        GLU  79  -0.483   7.420  -0.101
  616    HA   GLU  79           HA       GLU  79  -2.685   6.937   1.621
  617    HB2  GLU  79           1HB      GLU  79  -0.808   8.452   2.101
  618    HB3  GLU  79           2HB      GLU  79  -1.420   9.575   0.864
  619    HG2  GLU  79           1HG      GLU  79  -3.524   9.893   2.259
  620    HG3  GLU  79           2HG      GLU  79  -2.802   8.707   3.370
  621    H    ALA  80           H        ALA  80  -2.496   8.979  -1.289
  622    HA   ALA  80           HA       ALA  80  -5.106  10.046  -1.149
  623    HB1  ALA  80           3HB      ALA  80  -3.494   9.294  -3.611
  624    HB2  ALA  80           1HB      ALA  80  -4.906  10.374  -3.584
  625    HB3  ALA  80           2HB      ALA  80  -3.412  10.841  -2.737
  626    H    VAL  81           H        VAL  81  -3.980   6.949  -2.457
  627    HA   VAL  81           HA       VAL  81  -6.550   6.196  -3.606
  628    HB   VAL  81           HB       VAL  81  -4.115   4.563  -2.782
  629   HG11  VAL  81          1HG1      VAL  81  -5.149   2.726  -4.073
  630   HG12  VAL  81          2HG1      VAL  81  -6.169   3.191  -2.692
  631   HG13  VAL  81          3HG1      VAL  81  -6.599   3.725  -4.335
  632   HG21  VAL  81          3HG2      VAL  81  -3.696   6.085  -4.620
  633   HG22  VAL  81          1HG2      VAL  81  -3.719   4.400  -5.188
  634   HG23  VAL  81          2HG2      VAL  81  -5.117   5.459  -5.488
  635    H    PHE  82           H        PHE  82  -5.029   5.653  -0.462
  636    HA   PHE  82           HA       PHE  82  -7.237   3.912   0.399
  637    HB2  PHE  82           1HB      PHE  82  -4.860   5.121   1.876
  638    HB3  PHE  82           2HB      PHE  82  -6.046   4.020   2.612
  639    HD1  PHE  82           HD1      PHE  82  -6.314   2.333  -0.006
  640    HD2  PHE  82           HD2      PHE  82  -3.021   3.682   2.357
  641    HE1  PHE  82           HE1      PHE  82  -4.982   0.391  -0.756
  642    HE2  PHE  82           HE2      PHE  82  -1.685   1.742   1.607
  643    HZ   PHE  82           HZ       PHE  82  -2.667   0.096   0.051
  644    H    GLU  83           H        GLU  83  -7.155   7.098  -0.195
  645    HA   GLU  83           HA       GLU  83  -8.815   7.842   2.169
  646    HB2  GLU  83           1HB      GLU  83  -7.498   9.360  -0.064
  647    HB3  GLU  83           2HB      GLU  83  -8.808  10.082   0.900
  648    HG2  GLU  83           1HG      GLU  83  -7.398   9.783   2.984
  649    HG3  GLU  83           2HG      GLU  83  -6.220   8.983   1.918
  650    H    LEU  84           H        LEU  84  -9.901   5.877   0.511
  651    HA   LEU  84           HA       LEU  84 -11.748   6.955  -1.401
  652    HB2  LEU  84           1HB      LEU  84 -11.711   4.601   0.357
  653    HB3  LEU  84           2HB      LEU  84 -13.028   4.746  -0.828
  654    HG   LEU  84           HG       LEU  84 -10.055   4.523  -1.442
  655   HD11  LEU  84          1HD1      LEU  84 -10.700   2.320  -2.455
  656   HD12  LEU  84          2HD1      LEU  84 -11.094   2.374  -0.721
  657   HD13  LEU  84          3HD1      LEU  84 -12.380   2.589  -1.934
  658   HD21  LEU  84          3HD2      LEU  84 -11.178   5.961  -3.038
  659   HD22  LEU  84          1HD2      LEU  84 -10.754   4.416  -3.809
  660   HD23  LEU  84          2HD2      LEU  84 -12.435   4.730  -3.310
  661    H    GLU  85           H        GLU  85 -11.916   6.550   2.100
  662    HA   GLU  85           HA       GLU  85 -13.560   7.162   3.630
  663    HB2  GLU  85           1HB      GLU  85 -14.121   9.246   1.515
  664    HB3  GLU  85           2HB      GLU  85 -14.702   9.279   3.197
  665    HG2  GLU  85           1HG      GLU  85 -12.265   9.428   3.964
  666    HG3  GLU  85           2HG      GLU  85 -11.877   9.394   2.230
  667    H    HIS  86           H        HIS  86 -14.267   5.022   2.065
  668    HA   HIS  86           HA       HIS  86 -17.146   5.549   1.423
  669    HB2  HIS  86           1HB      HIS  86 -15.199   3.429   0.426
  670    HB3  HIS  86           2HB      HIS  86 -16.956   3.339   0.167
  671    HD2  HIS  86           HD2      HIS  86 -16.830   6.890  -0.556
  672    HE1  HIS  86           HE1      HIS  86 -14.987   5.141  -3.961
  673    HE2  HIS  86           HE2      HIS  86 -16.122   7.273  -2.925
  674    H    HIS  87           H        HIS  87 -18.758   4.235   2.164
  675    HA   HIS  87           HA       HIS  87 -18.253   2.882   4.706
  676    HB2  HIS  87           1HB      HIS  87 -20.652   2.414   4.690
  677    HB3  HIS  87           2HB      HIS  87 -20.399   4.102   4.185
  678    HD2  HIS  87           HD2      HIS  87 -22.151   0.865   2.848
  679    HE1  HIS  87           HE1      HIS  87 -22.013   3.759  -0.257
  680    HE2  HIS  87           HE2      HIS  87 -22.990   1.463   0.570
  681    H    HIS  88           H        HIS  88 -18.263   1.963   1.381
  682    HA   HIS  88           HA       HIS  88 -18.372  -0.923   2.153
  683    HB2  HIS  88           1HB      HIS  88 -18.706  -1.367  -0.241
  684    HB3  HIS  88           2HB      HIS  88 -19.903  -0.174   0.314
  685    HD1  HIS  88           HD1      HIS  88 -16.809  -0.521  -1.801
  686    HD2  HIS  88           HD2      HIS  88 -19.773   2.368  -1.010
  687    HE1  HIS  88           HE1      HIS  88 -16.432   1.284  -3.402
  688    H    HIS  89           H        HIS  89 -16.948  -2.326   0.678
  689    HA   HIS  89           HA       HIS  89 -14.526  -1.155  -0.379
  690    HB2  HIS  89           1HB      HIS  89 -12.908  -2.115   1.182
  691    HB3  HIS  89           2HB      HIS  89 -14.005  -1.045   2.085
  692    HD1  HIS  89           HD1      HIS  89 -13.170  -4.681   1.543
  693    HD2  HIS  89           HD2      HIS  89 -15.479  -2.337   4.174
  694    HE1  HIS  89           HE1      HIS  89 -13.946  -6.199   3.293
  695    H    HIS  90           H        HIS  90 -13.013  -2.756  -1.198
  696    HA   HIS  90           HA       HIS  90 -14.454  -5.039  -2.333
  697    HB2  HIS  90           1HB      HIS  90 -12.704  -3.702  -3.594
  698    HB3  HIS  90           2HB      HIS  90 -11.478  -4.407  -2.513
  699    HD2  HIS  90           HD2      HIS  90 -13.347  -5.322  -5.830
  700    HE1  HIS  90           HE1      HIS  90 -11.282  -8.749  -4.401
  701    HE2  HIS  90           HE2      HIS  90 -12.595  -7.642  -6.390
  702    H    HIS  91           H        HIS  91 -14.275  -7.152  -1.925
  703    HA   HIS  91           HA       HIS  91 -12.082  -8.316  -0.488
  704    HB2  HIS  91           1HB      HIS  91 -13.323  -7.148   1.427
  705    HB3  HIS  91           2HB      HIS  91 -14.666  -8.272   1.116
  706    HD1  HIS  91           HD1      HIS  91 -14.216 -10.817   1.573
  707    HD2  HIS  91           HD2      HIS  91 -11.115  -8.280   2.881
  708    HE1  HIS  91           HE1      HIS  91 -12.898 -12.127   3.158
  Start of MODEL   16
    1    H1   MET   1           1H       MET   1 -12.983   3.676   1.901
    2    H2   MET   1           2H       MET   1 -13.814   3.469   3.132
    3    H3   MET   1           3H       MET   1 -13.424   4.856   2.715
    4    HA   MET   1           HA       MET   1 -11.962   3.245   4.536
    5    HB2  MET   1           1HB      MET   1 -10.573   3.808   1.919
    6    HB3  MET   1           2HB      MET   1  -9.737   3.344   3.421
    7    HG2  MET   1           1HG      MET   1 -10.695   1.182   3.412
    8    HG3  MET   1           2HG      MET   1 -11.901   1.636   2.185
    9    HE1  MET   1           3HE      MET   1 -11.468  -0.376   0.597
   10    HE2  MET   1           1HE      MET   1  -9.849  -0.949   0.130
   11    HE3  MET   1           2HE      MET   1 -10.370  -1.043   1.829
   12    H    LYS   2           H        LYS   2 -10.868   4.419   5.969
   13    HA   LYS   2           HA       LYS   2 -10.004   7.163   5.182
   14    HB2  LYS   2           1HB      LYS   2 -12.208   7.321   6.289
   15    HB3  LYS   2           2HB      LYS   2 -11.523   6.491   7.706
   16    HG2  LYS   2           1HG      LYS   2  -9.991   8.334   8.104
   17    HG3  LYS   2           2HG      LYS   2 -10.531   9.145   6.614
   18    HD2  LYS   2           1HD      LYS   2 -12.780   9.403   7.540
   19    HD3  LYS   2           2HD      LYS   2 -12.290   8.531   9.012
   20    HE2  LYS   2           1HE      LYS   2 -10.664  10.280   9.530
   21    HE3  LYS   2           2HE      LYS   2 -11.092  11.141   8.036
   22    HZ1  LYS   2           3HZ      LYS   2 -12.911  10.629  10.301
   23    HZ2  LYS   2           1HZ      LYS   2 -12.200  12.076   9.951
   24    HZ3  LYS   2           2HZ      LYS   2 -13.310  11.429   8.914
   25    H    ILE   3           H        ILE   3  -8.005   7.555   5.677
   26    HA   ILE   3           HA       ILE   3  -6.469   5.573   7.205
   27    HB   ILE   3           HB       ILE   3  -5.701   8.264   5.982
   28   HG12  ILE   3          1HG1      ILE   3  -5.064   5.473   5.066
   29   HG13  ILE   3          2HG1      ILE   3  -6.388   6.475   4.427
   30   HG21  ILE   3          1HG2      ILE   3  -3.369   7.534   6.356
   31   HG22  ILE   3          2HG2      ILE   3  -4.248   7.679   7.896
   32   HG23  ILE   3          3HG2      ILE   3  -3.958   6.075   7.187
   33   HD11  ILE   3          3HD1      ILE   3  -3.427   7.156   4.316
   34   HD12  ILE   3          1HD1      ILE   3  -4.412   6.568   2.957
   35   HD13  ILE   3          2HD1      ILE   3  -4.751   8.160   3.680
   36    H    ILE   4           H        ILE   4  -5.947   5.495   9.206
   37    HA   ILE   4           HA       ILE   4  -6.621   7.834  10.944
   38    HB   ILE   4           HB       ILE   4  -5.863   4.949  11.594
   39   HG12  ILE   4          1HG1      ILE   4  -8.460   6.394  12.031
   40   HG13  ILE   4          2HG1      ILE   4  -8.105   5.360  10.628
   41   HG21  ILE   4          1HG2      ILE   4  -6.371   5.558  13.935
   42   HG22  ILE   4          2HG2      ILE   4  -5.016   6.523  13.302
   43   HG23  ILE   4          3HG2      ILE   4  -6.636   7.246  13.438
   44   HD11  ILE   4          3HD1      ILE   4  -8.113   4.472  13.533
   45   HD12  ILE   4          1HD1      ILE   4  -9.384   4.131  12.338
   46   HD13  ILE   4          2HD1      ILE   4  -7.758   3.437  12.130
   47    H    SER   5           H        SER   5  -3.884   5.716  10.156
   48    HA   SER   5           HA       SER   5  -1.992   7.954  10.673
   49    HB2  SER   5           1HB      SER   5  -2.383   7.345  12.875
   50    HB3  SER   5           2HB      SER   5  -2.036   5.638  12.514
   51    HG   SER   5           HG       SER   5  -0.227   6.752  13.369
   52    H    ILE   6           H        ILE   6  -0.228   7.695   9.430
   53    HA   ILE   6           HA       ILE   6   0.405   4.941   8.398
   54    HB   ILE   6           HB       ILE   6   1.124   7.675   7.243
   55   HG12  ILE   6          1HG1      ILE   6  -0.737   5.554   6.203
   56   HG13  ILE   6          2HG1      ILE   6  -1.221   7.078   6.982
   57   HG21  ILE   6          1HG2      ILE   6   2.052   6.372   5.360
   58   HG22  ILE   6          2HG2      ILE   6   2.884   5.978   6.880
   59   HG23  ILE   6          3HG2      ILE   6   1.672   4.860   6.217
   60   HD11  ILE   6          3HD1      ILE   6   0.334   6.824   4.384
   61   HD12  ILE   6          1HD1      ILE   6  -1.388   7.240   4.529
   62   HD13  ILE   6          2HD1      ILE   6  -0.149   8.349   5.164
   63    H    SER   7           H        SER   7   1.958   3.941   9.311
   64    HA   SER   7           HA       SER   7   4.064   5.550  10.781
   65    HB2  SER   7           1HB      SER   7   4.276   3.837  12.277
   66    HB3  SER   7           2HB      SER   7   2.573   4.341  12.179
   67    HG   SER   7           HG       SER   7   3.727   2.063  10.943
   68    H    GLU   8           H        GLU   8   6.169   4.532  10.914
   69    HA   GLU   8           HA       GLU   8   6.931   3.125   8.408
   70    HB2  GLU   8           1HB      GLU   8   8.554   4.262  10.690
   71    HB3  GLU   8           2HB      GLU   8   9.229   3.457   9.253
   72    HG2  GLU   8           1HG      GLU   8   8.239   5.307   7.810
   73    HG3  GLU   8           2HG      GLU   8   7.594   5.958   9.336
   74    H    THR   9           H        THR   9   8.637   1.412   8.630
   75    HA   THR   9           HA       THR   9   8.002  -0.402  10.925
   76    HB   THR   9           HB       THR   9   7.775  -2.296   9.496
   77    HG1  THR   9           HG1      THR   9   8.152  -0.806   7.134
   78   HG21  THR   9          3HG2      THR   9   6.312   0.024   8.174
   79   HG22  THR   9          1HG2      THR   9   5.887  -1.696   8.020
   80   HG23  THR   9          2HG2      THR   9   5.751  -0.883   9.597
   81    HA   PRO  10           HA       PRO  10  12.214  -1.331  11.439
   82    HB2  PRO  10           2HB      PRO  10  12.431  -3.597  12.165
   83    HB3  PRO  10           1HB      PRO  10  11.605  -4.236  10.736
   84    HG2  PRO  10           1HG      PRO  10   9.917  -4.450  12.389
   85    HG3  PRO  10           2HG      PRO  10  10.405  -2.970  13.226
   86    HD2  PRO  10           1HD      PRO  10   8.792  -3.262  10.663
   87    HD3  PRO  10           2HD      PRO  10   8.586  -2.099  11.978
   88    H    ASN  11           H        ASN  11  10.684  -2.719   8.571
   89    HA   ASN  11           HA       ASN  11  13.237  -2.200   7.099
   90    HB2  ASN  11           1HB      ASN  11  11.897  -4.513   6.670
   91    HB3  ASN  11           2HB      ASN  11  10.756  -3.242   6.166
   92   HD21  ASN  11          2HD2      ASN  11  11.920  -5.432   4.640
   93   HD22  ASN  11          1HD2      ASN  11  12.739  -4.704   3.297
   94    H    HIS  12           H        HIS  12  13.506  -0.262   6.333
   95    HA   HIS  12           HA       HIS  12  11.332   1.642   6.342
   96    HB2  HIS  12           1HB      HIS  12  12.980   3.245   5.573
   97    HB3  HIS  12           2HB      HIS  12  13.784   2.185   6.756
   98    HD2  HIS  12           HD2      HIS  12  14.218   3.300   3.009
   99    HE1  HIS  12           HE1      HIS  12  16.965   0.182   3.890
  100    HE2  HIS  12           HE2      HIS  12  16.215   2.039   2.187
  101    H    ASN  13           H        ASN  13  12.322  -0.662   4.058
  102    HA   ASN  13           HA       ASN  13  11.602   0.804   1.653
  103    HB2  ASN  13           1HB      ASN  13  11.937  -2.271   1.995
  104    HB3  ASN  13           2HB      ASN  13  11.414  -1.195   0.676
  105   HD21  ASN  13          2HD2      ASN  13  13.697  -2.970   0.799
  106   HD22  ASN  13          1HD2      ASN  13  15.101  -1.985   0.560
  107    H    THR  14           H        THR  14   9.805  -0.806   4.117
  108    HA   THR  14           HA       THR  14   7.330  -0.362   2.482
  109    HB   THR  14           HB       THR  14   7.699  -2.788   2.682
  110    HG1  THR  14           HG1      THR  14   5.714  -3.163   4.050
  111   HG21  THR  14          3HG2      THR  14   7.701  -2.258   5.680
  112   HG22  THR  14          1HG2      THR  14   7.716  -3.861   4.906
  113   HG23  THR  14          2HG2      THR  14   9.105  -2.765   4.714
  114    H    MET  15           H        MET  15   5.525   0.381   3.505
  115    HA   MET  15           HA       MET  15   5.934   1.317   6.326
  116    HB2  MET  15           1HB      MET  15   4.762   2.802   3.977
  117    HB3  MET  15           2HB      MET  15   4.592   3.312   5.673
  118    HG2  MET  15           1HG      MET  15   7.023   3.546   5.858
  119    HG3  MET  15           2HG      MET  15   7.211   3.008   4.171
  120    HE1  MET  15           3HE      MET  15   6.296   5.897   6.600
  121    HE2  MET  15           1HE      MET  15   5.450   7.060   5.551
  122    HE3  MET  15           2HE      MET  15   4.681   5.507   5.960
  123    H    LYS  16           H        LYS  16   3.987   1.783   7.501
  124    HA   LYS  16           HA       LYS  16   1.858  -0.180   6.723
  125    HB2  LYS  16           1HB      LYS  16   3.070  -0.781   8.735
  126    HB3  LYS  16           2HB      LYS  16   2.751   0.825   9.428
  127    HG2  LYS  16           1HG      LYS  16   0.307   0.308   9.364
  128    HG3  LYS  16           2HG      LYS  16   0.710  -1.335   8.814
  129    HD2  LYS  16           1HD      LYS  16   1.936  -1.770  10.865
  130    HD3  LYS  16           2HD      LYS  16   1.694  -0.093  11.402
  131    HE2  LYS  16           1HE      LYS  16  -0.737  -0.460  11.455
  132    HE3  LYS  16           2HE      LYS  16  -0.492  -2.140  10.926
  133    HZ1  LYS  16           3HZ      LYS  16   0.510  -0.973  13.444
  134    HZ2  LYS  16           1HZ      LYS  16  -0.782  -1.990  13.306
  135    HZ3  LYS  16           2HZ      LYS  16   0.737  -2.532  12.953
  136    H    ILE  17           H        ILE  17  -0.037   0.526   6.190
  137    HA   ILE  17           HA       ILE  17  -0.822   3.298   7.065
  138    HB   ILE  17           HB       ILE  17  -1.649   1.735   4.574
  139   HG12  ILE  17          1HG1      ILE  17   0.019   4.226   4.808
  140   HG13  ILE  17          2HG1      ILE  17   0.653   2.584   4.549
  141   HG21  ILE  17          1HG2      ILE  17  -2.813   3.821   3.942
  142   HG22  ILE  17          2HG2      ILE  17  -3.455   3.166   5.466
  143   HG23  ILE  17          3HG2      ILE  17  -2.343   4.554   5.494
  144   HD11  ILE  17          3HD1      ILE  17  -1.213   4.083   2.680
  145   HD12  ILE  17          1HD1      ILE  17   0.530   3.834   2.430
  146   HD13  ILE  17          2HD1      ILE  17  -0.579   2.441   2.421
  147    H    THR  18           H        THR  18  -2.127   3.292   8.668
  148    HA   THR  18           HA       THR  18  -3.913   0.960   9.079
  149    HB   THR  18           HB       THR  18  -3.394   3.419  10.804
  150    HG1  THR  18           HG1      THR  18  -2.242   1.849  12.076
  151   HG21  THR  18          3HG2      THR  18  -4.908   0.844  11.393
  152   HG22  THR  18          1HG2      THR  18  -4.572   2.144  12.560
  153   HG23  THR  18          2HG2      THR  18  -5.639   2.451  11.168
  154    H    LEU  19           H        LEU  19  -5.936   0.860   8.554
  155    HA   LEU  19           HA       LEU  19  -7.351   3.424   7.914
  156    HB2  LEU  19           1HB      LEU  19  -7.914   0.635   7.146
  157    HB3  LEU  19           2HB      LEU  19  -8.847   1.996   6.483
  158    HG   LEU  19           HG       LEU  19  -5.910   1.382   5.970
  159   HD11  LEU  19          1HD1      LEU  19  -6.677   1.016   3.610
  160   HD12  LEU  19          2HD1      LEU  19  -7.486  -0.101   4.734
  161   HD13  LEU  19          3HD1      LEU  19  -8.352   1.328   4.123
  162   HD21  LEU  19          3HD2      LEU  19  -6.294   3.774   6.077
  163   HD22  LEU  19          1HD2      LEU  19  -5.986   3.282   4.394
  164   HD23  LEU  19          2HD2      LEU  19  -7.646   3.637   4.928
  165    H    SER  20           H        SER  20  -9.451   3.769   8.585
  166    HA   SER  20           HA       SER  20 -10.292   2.633  11.147
  167    HB2  SER  20           1HB      SER  20 -12.165   3.924  10.968
  168    HB3  SER  20           2HB      SER  20 -10.738   4.873  10.489
  169    HG   SER  20           HG       SER  20 -12.535   5.180   9.095
  170    H    GLU  21           H        GLU  21 -11.293   2.230   7.723
  171    HA   GLU  21           HA       GLU  21 -12.033  -0.559   8.354
  172    HB2  GLU  21           1HB      GLU  21 -14.108   0.696   8.716
  173    HB3  GLU  21           2HB      GLU  21 -13.971   1.379   7.078
  174    HG2  GLU  21           1HG      GLU  21 -14.285  -0.913   6.097
  175    HG3  GLU  21           2HG      GLU  21 -14.214  -1.518   7.768
  176    H    SER  22           H        SER  22 -11.150  -1.817   6.938
  177    HA   SER  22           HA       SER  22 -10.203  -0.759   4.308
  178    HB2  SER  22           1HB      SER  22  -8.814  -2.083   5.809
  179    HB3  SER  22           2HB      SER  22  -9.847  -3.473   5.403
  180    HG   SER  22           HG       SER  22  -8.108  -3.390   3.994
  181    H    ARG  23           H        ARG  23 -10.310  -3.109   2.873
  182    HA   ARG  23           HA       ARG  23 -12.877  -2.974   1.639
  183    HB2  ARG  23           1HB      ARG  23 -12.270  -4.751   0.300
  184    HB3  ARG  23           2HB      ARG  23 -10.855  -3.696   0.525
  185    HG2  ARG  23           1HG      ARG  23  -9.970  -5.298   2.202
  186    HG3  ARG  23           2HG      ARG  23 -11.355  -6.368   1.874
  187    HD2  ARG  23           1HD      ARG  23 -10.621  -6.685  -0.376
  188    HD3  ARG  23           2HD      ARG  23  -9.290  -5.530  -0.135
  189    HE   ARG  23           HE       ARG  23  -8.086  -7.338   1.070
  190   HH11  ARG  23          1HH1      ARG  23 -11.342  -8.323   0.308
  191   HH12  ARG  23          2HH1      ARG  23 -10.928  -9.988   0.661
  192   HH21  ARG  23          2HH2      ARG  23  -8.792 -10.513   1.336
  193   HH22  ARG  23          1HH2      ARG  23  -7.597  -9.239   1.486
  194    H    GLU  24           H        GLU  24 -14.343  -4.827   1.293
  195    HA   GLU  24           HA       GLU  24 -15.809  -5.434   3.556
  196    HB2  GLU  24           1HB      GLU  24 -16.474  -5.902   1.223
  197    HB3  GLU  24           2HB      GLU  24 -15.358  -7.291   1.215
  198    HG2  GLU  24           1HG      GLU  24 -16.750  -8.387   3.024
  199    HG3  GLU  24           2HG      GLU  24 -17.714  -6.893   3.012
  200    H    GLY  25           H        GLY  25 -13.312  -7.588   2.172
  201    HA2  GLY  25           1HA      GLY  25 -13.385  -9.251   4.595
  202    HA3  GLY  25           2HA      GLY  25 -12.366  -9.499   3.158
  203    H    MET  26           H        MET  26 -12.031  -9.163   6.275
  204    HA   MET  26           HA       MET  26  -9.791  -7.179   6.158
  205    HB2  MET  26           1HB      MET  26 -11.135  -8.468   8.532
  206    HB3  MET  26           2HB      MET  26  -9.872  -7.214   8.572
  207    HG2  MET  26           1HG      MET  26 -12.667  -6.886   7.438
  208    HG3  MET  26           2HG      MET  26 -12.119  -6.296   9.026
  209    HE1  MET  26           3HE      MET  26 -13.166  -3.904   8.152
  210    HE2  MET  26           1HE      MET  26 -12.575  -3.071   6.694
  211    HE3  MET  26           2HE      MET  26 -13.492  -4.590   6.541
  212    H    THR  27           H        THR  27 -10.118 -10.252   5.432
  213    HA   THR  27           HA       THR  27  -8.143 -11.502   7.183
  214    HB   THR  27           HB       THR  27  -8.271 -13.399   5.642
  215    HG1  THR  27           HG1      THR  27  -9.839 -11.646   4.013
  216   HG21  THR  27          3HG2      THR  27 -11.007 -12.141   6.091
  217   HG22  THR  27          1HG2      THR  27 -10.693 -13.862   5.761
  218   HG23  THR  27          2HG2      THR  27 -10.108 -13.123   7.271
  219    H    SER  28           H        SER  28  -6.186 -12.547   6.340
  220    HA   SER  28           HA       SER  28  -4.396 -10.474   5.282
  221    HB2  SER  28           1HB      SER  28  -2.687 -11.934   5.639
  222    HB3  SER  28           2HB      SER  28  -3.791 -11.972   7.034
  223    HG   SER  28           HG       SER  28  -3.107 -14.059   6.384
  224    H    ASP  29           H        ASP  29  -3.325 -10.439   3.340
  225    HA   ASP  29           HA       ASP  29  -3.426 -12.678   1.476
  226    HB2  ASP  29           1HB      ASP  29  -5.697 -11.194   1.198
  227    HB3  ASP  29           2HB      ASP  29  -4.459 -10.156   0.449
  228    H    THR  30           H        THR  30  -2.159 -12.355  -0.423
  229    HA   THR  30           HA       THR  30  -0.204 -10.096  -0.121
  230    HB   THR  30           HB       THR  30   0.358 -12.944  -1.052
  231    HG1  THR  30           HG1      THR  30   1.643 -12.959   0.888
  232   HG21  THR  30          3HG2      THR  30   2.200 -10.548  -0.677
  233   HG22  THR  30          1HG2      THR  30   2.710 -12.194  -1.116
  234   HG23  THR  30          2HG2      THR  30   1.706 -11.246  -2.238
  235    H    TYR  31           H        TYR  31   0.098  -8.826  -1.772
  236    HA   TYR  31           HA       TYR  31  -0.977  -9.715  -4.431
  237    HB2  TYR  31           1HB      TYR  31  -1.083  -6.959  -3.189
  238    HB3  TYR  31           2HB      TYR  31  -1.633  -7.399  -4.825
  239    HD1  TYR  31           HD1      TYR  31  -2.592  -7.063  -1.394
  240    HD2  TYR  31           HD2      TYR  31  -3.506  -9.177  -4.981
  241    HE1  TYR  31           HE1      TYR  31  -4.831  -7.615  -0.487
  242    HE2  TYR  31           HE2      TYR  31  -5.744  -9.738  -4.094
  243    HH   TYR  31           HH       TYR  31  -6.812  -8.662  -0.859
  244    H    THR  32           H        THR  32   0.164  -9.316  -6.209
  245    HA   THR  32           HA       THR  32   2.821  -7.982  -5.815
  246    HB   THR  32           HB       THR  32   3.752  -9.664  -7.427
  247    HG1  THR  32           HG1      THR  32   2.493 -11.551  -7.791
  248   HG21  THR  32          3HG2      THR  32   2.538 -10.834  -4.893
  249   HG22  THR  32          1HG2      THR  32   3.906 -11.518  -5.801
  250   HG23  THR  32          2HG2      THR  32   4.073  -9.941  -4.993
  251    H    LYS  33           H        LYS  33   1.071  -9.426  -8.569
  252    HA   LYS  33           HA       LYS  33   1.579  -6.869 -10.046
  253    HB2  LYS  33           1HB      LYS  33   1.050  -9.680 -11.018
  254    HB3  LYS  33           2HB      LYS  33   1.193  -8.248 -12.065
  255    HG2  LYS  33           1HG      LYS  33   3.515  -7.928 -11.282
  256    HG3  LYS  33           2HG      LYS  33   3.367  -9.387 -10.274
  257    HD2  LYS  33           1HD      LYS  33   2.962 -10.742 -12.287
  258    HD3  LYS  33           2HD      LYS  33   3.097  -9.283 -13.297
  259    HE2  LYS  33           1HE      LYS  33   5.416  -8.968 -12.515
  260    HE3  LYS  33           2HE      LYS  33   5.277 -10.448 -11.538
  261    HZ1  LYS  33           3HZ      LYS  33   5.062 -10.308 -14.477
  262    HZ2  LYS  33           1HZ      LYS  33   6.368 -10.866 -13.637
  263    HZ3  LYS  33           2HZ      LYS  33   4.935 -11.680 -13.572
  264    H    VAL  34           H        VAL  34   0.013  -5.935 -11.326
  265    HA   VAL  34           HA       VAL  34  -2.603  -5.802 -10.162
  266    HB   VAL  34           HB       VAL  34  -1.619  -5.025 -12.939
  267   HG11  VAL  34          1HG1      VAL  34  -3.687  -3.678 -13.077
  268   HG12  VAL  34          2HG1      VAL  34  -4.060  -5.411 -12.931
  269   HG13  VAL  34          3HG1      VAL  34  -4.226  -4.344 -11.517
  270   HG21  VAL  34          3HG2      VAL  34  -0.530  -3.806 -11.150
  271   HG22  VAL  34          1HG2      VAL  34  -1.647  -2.749 -12.047
  272   HG23  VAL  34          2HG2      VAL  34  -2.111  -3.384 -10.449
  273    H    ASP  35           H        ASP  35  -4.429  -6.795 -10.373
  274    HA   ASP  35           HA       ASP  35  -4.945  -8.611 -12.619
  275    HB2  ASP  35           1HB      ASP  35  -3.441  -9.867 -10.741
  276    HB3  ASP  35           2HB      ASP  35  -5.025  -9.755  -9.938
  277    H    ASP  36           H        ASP  36  -7.040  -9.620 -12.519
  278    HA   ASP  36           HA       ASP  36  -8.996  -7.672 -11.570
  279    HB2  ASP  36           1HB      ASP  36  -9.339 -10.389 -12.975
  280    HB3  ASP  36           2HB      ASP  36 -10.586  -9.275 -12.366
  281    H    SER  37           H        SER  37  -7.815 -10.789 -10.477
  282    HA   SER  37           HA       SER  37  -9.899 -11.441  -8.579
  283    HB2  SER  37           1HB      SER  37  -8.432 -12.915  -7.636
  284    HB3  SER  37           2HB      SER  37  -8.302 -12.991  -9.408
  285    HG   SER  37           HG       SER  37  -6.262 -13.013  -8.366
  286    H    GLN  38           H        GLN  38  -7.410  -9.007  -8.619
  287    HA   GLN  38           HA       GLN  38  -7.386  -8.751  -5.665
  288    HB2  GLN  38           1HB      GLN  38  -6.016  -7.029  -7.734
  289    HB3  GLN  38           2HB      GLN  38  -5.665  -7.133  -5.991
  290    HG2  GLN  38           1HG      GLN  38  -4.766  -9.633  -6.485
  291    HG3  GLN  38           2HG      GLN  38  -5.384  -9.120  -8.071
  292   HE21  GLN  38          2HE2      GLN  38  -2.716 -10.046  -7.404
  293   HE22  GLN  38          1HE2      GLN  38  -1.628  -8.752  -7.781
  294    HA   PRO  39           HA       PRO  39 -10.290  -5.405  -5.280
  295    HB2  PRO  39           2HB      PRO  39  -9.780  -4.444  -3.165
  296    HB3  PRO  39           1HB      PRO  39  -8.084  -4.177  -3.589
  297    HG2  PRO  39           1HG      PRO  39  -7.897  -6.025  -2.121
  298    HG3  PRO  39           2HG      PRO  39  -9.436  -6.724  -2.641
  299    HD2  PRO  39           1HD      PRO  39  -6.742  -6.786  -4.062
  300    HD3  PRO  39           2HD      PRO  39  -7.947  -8.072  -3.914
  301    H    ALA  40           H        ALA  40 -10.699  -3.725  -6.443
  302    HA   ALA  40           HA       ALA  40  -8.978  -2.828  -8.474
  303    HB1  ALA  40           3HB      ALA  40 -11.225  -1.304  -7.110
  304    HB2  ALA  40           1HB      ALA  40 -10.502  -0.902  -8.683
  305    HB3  ALA  40           2HB      ALA  40 -11.399  -2.424  -8.480
  306    H    PHE  41           H        PHE  41  -9.456  -1.503  -5.210
  307    HA   PHE  41           HA       PHE  41  -7.763   0.802  -5.623
  308    HB2  PHE  41           1HB      PHE  41  -8.093   1.239  -3.345
  309    HB3  PHE  41           2HB      PHE  41  -9.545   0.291  -3.740
  310    HD1  PHE  41           HD1      PHE  41  -6.336   0.319  -1.985
  311    HD2  PHE  41           HD2      PHE  41  -9.844  -1.935  -2.914
  312    HE1  PHE  41           HE1      PHE  41  -5.787  -1.275  -0.179
  313    HE2  PHE  41           HE2      PHE  41  -9.299  -3.531  -1.106
  314    HZ   PHE  41           HZ       PHE  41  -7.269  -3.200   0.261
  315    H    ILE  42           H        ILE  42  -7.149  -2.504  -4.545
  316    HA   ILE  42           HA       ILE  42  -4.338  -2.102  -3.954
  317    HB   ILE  42           HB       ILE  42  -5.959  -4.532  -4.819
  318   HG12  ILE  42          1HG1      ILE  42  -6.379  -3.646  -2.597
  319   HG13  ILE  42          2HG1      ILE  42  -5.682  -5.283  -2.592
  320   HG21  ILE  42          1HG2      ILE  42  -3.948  -5.876  -4.310
  321   HG22  ILE  42          2HG2      ILE  42  -3.644  -4.755  -5.657
  322   HG23  ILE  42          3HG2      ILE  42  -3.019  -4.384  -4.033
  323   HD11  ILE  42          3HD1      ILE  42  -4.172  -2.706  -2.035
  324   HD12  ILE  42          1HD1      ILE  42  -4.692  -3.891  -0.816
  325   HD13  ILE  42          2HD1      ILE  42  -3.474  -4.342  -2.031
  326    H    ASN  43           H        ASN  43  -6.086  -2.815  -6.941
  327    HA   ASN  43           HA       ASN  43  -3.737  -3.117  -8.574
  328    HB2  ASN  43           1HB      ASN  43  -6.574  -2.249  -9.514
  329    HB3  ASN  43           2HB      ASN  43  -4.995  -2.500 -10.296
  330   HD21  ASN  43          2HD2      ASN  43  -7.710  -3.870 -10.365
  331   HD22  ASN  43          1HD2      ASN  43  -7.333  -5.550 -10.180
  332    H    ASP  44           H        ASP  44  -5.736  -0.270  -7.797
  333    HA   ASP  44           HA       ASP  44  -4.269   1.641  -9.298
  334    HB2  ASP  44           1HB      ASP  44  -5.732   1.968  -6.610
  335    HB3  ASP  44           2HB      ASP  44  -4.912   3.197  -7.602
  336    H    ILE  45           H        ILE  45  -3.709   0.470  -5.978
  337    HA   ILE  45           HA       ILE  45  -1.451   2.161  -5.442
  338    HB   ILE  45           HB       ILE  45  -2.157  -0.614  -4.386
  339   HG12  ILE  45          1HG1      ILE  45  -2.462   2.047  -3.036
  340   HG13  ILE  45          2HG1      ILE  45  -3.745   1.279  -3.997
  341   HG21  ILE  45          1HG2      ILE  45  -0.573  -0.104  -2.560
  342   HG22  ILE  45          2HG2      ILE  45   0.255  -0.134  -4.134
  343   HG23  ILE  45          3HG2      ILE  45  -0.135   1.420  -3.366
  344   HD11  ILE  45          3HD1      ILE  45  -2.431   0.104  -1.523
  345   HD12  ILE  45          1HD1      ILE  45  -4.050   0.838  -1.592
  346   HD13  ILE  45          2HD1      ILE  45  -3.716  -0.665  -2.484
  347    H    LEU  46           H        LEU  46  -1.587  -1.124  -6.792
  348    HA   LEU  46           HA       LEU  46   1.239  -1.398  -7.129
  349    HB2  LEU  46           1HB      LEU  46  -1.114  -2.417  -8.571
  350    HB3  LEU  46           2HB      LEU  46   0.489  -3.066  -8.990
  351    HG   LEU  46           HG       LEU  46  -0.901  -3.286  -6.291
  352   HD11  LEU  46          1HD1      LEU  46  -0.969  -5.738  -6.820
  353   HD12  LEU  46          2HD1      LEU  46  -1.862  -4.789  -8.032
  354   HD13  LEU  46          3HD1      LEU  46  -0.233  -5.401  -8.404
  355   HD21  LEU  46          3HD2      LEU  46   1.500  -3.070  -6.037
  356   HD22  LEU  46          1HD2      LEU  46   0.998  -4.734  -5.659
  357   HD23  LEU  46          2HD2      LEU  46   1.773  -4.371  -7.220
  358    H    LYS  47           H        LYS  47  -1.215   0.184  -9.097
  359    HA   LYS  47           HA       LYS  47   0.531   0.485 -11.412
  360    HB2  LYS  47           1HB      LYS  47  -2.079   1.748 -10.582
  361    HB3  LYS  47           2HB      LYS  47  -1.232   2.154 -12.092
  362    HG2  LYS  47           1HG      LYS  47  -1.446  -0.143 -12.873
  363    HG3  LYS  47           2HG      LYS  47  -2.196  -0.621 -11.333
  364    HD2  LYS  47           1HD      LYS  47  -4.082   0.895 -11.773
  365    HD3  LYS  47           2HD      LYS  47  -3.332   1.384 -13.312
  366    HE2  LYS  47           1HE      LYS  47  -3.463  -0.947 -14.103
  367    HE3  LYS  47           2HE      LYS  47  -4.243  -1.415 -12.574
  368    HZ1  LYS  47           3HZ      LYS  47  -5.334   0.494 -14.539
  369    HZ2  LYS  47           1HZ      LYS  47  -5.852  -1.055 -14.319
  370    HZ3  LYS  47           2HZ      LYS  47  -6.056   0.062 -13.121
  371    H    VAL  48           H        VAL  48   0.095   2.201  -8.445
  372    HA   VAL  48           HA       VAL  48   1.327   4.705  -9.223
  373    HB   VAL  48           HB       VAL  48   1.351   3.215  -6.566
  374   HG11  VAL  48          1HG1      VAL  48   1.982   5.403  -5.603
  375   HG12  VAL  48          2HG1      VAL  48   3.213   4.830  -6.751
  376   HG13  VAL  48          3HG1      VAL  48   2.065   6.098  -7.238
  377   HG21  VAL  48          3HG2      VAL  48  -0.890   3.786  -7.287
  378   HG22  VAL  48          1HG2      VAL  48  -0.390   4.799  -5.912
  379   HG23  VAL  48          2HG2      VAL  48  -0.392   5.474  -7.560
  380    H    GLU  49           H        GLU  49   3.192   5.146  -9.972
  381    HA   GLU  49           HA       GLU  49   5.198   3.167 -10.402
  382    HB2  GLU  49           1HB      GLU  49   4.941   5.264 -11.681
  383    HB3  GLU  49           2HB      GLU  49   5.509   6.170 -10.258
  384    HG2  GLU  49           1HG      GLU  49   7.744   4.969 -10.443
  385    HG3  GLU  49           2HG      GLU  49   7.010   4.104 -11.812
  386    H    GLY  50           H        GLY  50   6.573   2.216  -9.144
  387    HA2  GLY  50           1HA      GLY  50   8.579   2.590  -7.759
  388    HA3  GLY  50           2HA      GLY  50   7.637   3.768  -6.816
  389    H    VAL  51           H        VAL  51   5.263   1.845  -7.112
  390    HA   VAL  51           HA       VAL  51   5.727   0.405  -4.588
  391    HB   VAL  51           HB       VAL  51   3.393   0.358  -6.547
  392   HG11  VAL  51          1HG1      VAL  51   2.157  -0.700  -4.687
  393   HG12  VAL  51          2HG1      VAL  51   3.535  -1.704  -5.192
  394   HG13  VAL  51          3HG1      VAL  51   3.643  -0.724  -3.711
  395   HG21  VAL  51          3HG2      VAL  51   3.709   2.544  -5.549
  396   HG22  VAL  51          1HG2      VAL  51   2.258   1.754  -4.894
  397   HG23  VAL  51          2HG2      VAL  51   3.748   1.819  -3.925
  398    H    LYS  52           H        LYS  52   6.458  -1.493  -4.240
  399    HA   LYS  52           HA       LYS  52   7.033  -3.205  -6.611
  400    HB2  LYS  52           1HB      LYS  52   8.871  -2.632  -5.103
  401    HB3  LYS  52           2HB      LYS  52   7.978  -3.354  -3.744
  402    HG2  LYS  52           1HG      LYS  52   8.090  -5.558  -4.840
  403    HG3  LYS  52           2HG      LYS  52   8.983  -4.835  -6.198
  404    HD2  LYS  52           1HD      LYS  52  10.792  -4.178  -4.653
  405    HD3  LYS  52           2HD      LYS  52   9.902  -4.921  -3.304
  406    HE2  LYS  52           1HE      LYS  52  10.040  -7.108  -4.393
  407    HE3  LYS  52           2HE      LYS  52  10.886  -6.377  -5.777
  408    HZ1  LYS  52           3HZ      LYS  52  11.894  -6.465  -3.007
  409    HZ2  LYS  52           1HZ      LYS  52  12.418  -7.417  -4.247
  410    HZ3  LYS  52           2HZ      LYS  52  12.678  -5.788  -4.289
  411    H    SER  53           H        SER  53   5.795  -3.622  -3.276
  412    HA   SER  53           HA       SER  53   4.029  -5.867  -4.254
  413    HB2  SER  53           1HB      SER  53   4.766  -7.376  -2.705
  414    HB3  SER  53           2HB      SER  53   6.123  -6.857  -3.731
  415    HG   SER  53           HG       SER  53   6.680  -6.967  -1.513
  416    H    ILE  54           H        ILE  54   2.357  -6.382  -2.798
  417    HA   ILE  54           HA       ILE  54   1.974  -4.489  -0.498
  418    HB   ILE  54           HB       ILE  54  -0.158  -5.434  -2.469
  419   HG12  ILE  54          1HG1      ILE  54   0.856  -2.644  -2.007
  420   HG13  ILE  54          2HG1      ILE  54   1.416  -3.713  -3.315
  421   HG21  ILE  54          1HG2      ILE  54  -1.651  -3.941  -1.184
  422   HG22  ILE  54          2HG2      ILE  54  -0.980  -5.221  -0.147
  423   HG23  ILE  54          3HG2      ILE  54  -0.319  -3.572  -0.064
  424   HD11  ILE  54          3HD1      ILE  54  -1.438  -2.752  -2.900
  425   HD12  ILE  54          1HD1      ILE  54  -0.299  -2.140  -4.123
  426   HD13  ILE  54          2HD1      ILE  54  -0.878  -3.822  -4.208
  427    H    PHE  55           H        PHE  55   1.496  -5.311   1.366
  428    HA   PHE  55           HA       PHE  55   0.205  -8.023   1.373
  429    HB2  PHE  55           1HB      PHE  55   2.466  -8.139   2.367
  430    HB3  PHE  55           2HB      PHE  55   2.052  -6.814   3.477
  431    HD1  PHE  55           HD1      PHE  55   0.823 -10.189   2.458
  432    HD2  PHE  55           HD2      PHE  55   1.365  -7.325   5.580
  433    HE1  PHE  55           HE1      PHE  55  -0.011 -11.831   4.106
  434    HE2  PHE  55           HE2      PHE  55   0.533  -8.964   7.233
  435    HZ   PHE  55           HZ       PHE  55  -0.156 -11.218   6.494
  436    H    HIS  56           H        HIS  56  -1.769  -8.112   2.076
  437    HA   HIS  56           HA       HIS  56  -2.802  -5.722   3.571
  438    HB2  HIS  56           1HB      HIS  56  -3.636  -5.918   1.197
  439    HB3  HIS  56           2HB      HIS  56  -4.343  -7.493   1.625
  440    HD1  HIS  56           HD1      HIS  56  -6.344  -5.675   0.628
  441    HD2  HIS  56           HD2      HIS  56  -5.234  -5.524   4.690
  442    HE1  HIS  56           HE1      HIS  56  -8.163  -4.521   1.781
  443    H    VAL  57           H        VAL  57  -3.268  -6.114   5.572
  444    HA   VAL  57           HA       VAL  57  -4.664  -8.656   6.300
  445    HB   VAL  57           HB       VAL  57  -2.250  -9.120   6.668
  446   HG11  VAL  57          1HG1      VAL  57  -1.017  -7.814   8.365
  447   HG12  VAL  57          2HG1      VAL  57  -1.489  -6.791   6.988
  448   HG13  VAL  57          3HG1      VAL  57  -2.400  -6.703   8.516
  449   HG21  VAL  57          3HG2      VAL  57  -3.901 -10.121   8.132
  450   HG22  VAL  57          1HG2      VAL  57  -2.410  -9.739   9.027
  451   HG23  VAL  57          2HG2      VAL  57  -3.844  -8.698   9.199
  452    H    MET  58           H        MET  58  -6.100  -8.523   7.838
  453    HA   MET  58           HA       MET  58  -7.526  -7.528   9.383
  454    HB2  MET  58           1HB      MET  58  -5.225  -7.201  10.484
  455    HB3  MET  58           2HB      MET  58  -5.366  -5.516   9.930
  456    HG2  MET  58           1HG      MET  58  -7.484  -5.305  11.191
  457    HG3  MET  58           2HG      MET  58  -7.277  -6.969  11.784
  458    HE1  MET  58           3HE      MET  58  -4.259  -7.264  12.435
  459    HE2  MET  58           1HE      MET  58  -4.188  -6.711  14.126
  460    HE3  MET  58           2HE      MET  58  -5.551  -7.714  13.575
  461    H    ASP  59           H        ASP  59  -6.668  -4.437   9.780
  462    HA   ASP  59           HA       ASP  59  -8.119  -3.475   7.337
  463    HB2  ASP  59           1HB      ASP  59  -9.296  -1.792   8.737
  464    HB3  ASP  59           2HB      ASP  59  -9.503  -3.489   9.235
  465    H    PHE  60           H        PHE  60  -5.312  -3.742   7.610
  466    HA   PHE  60           HA       PHE  60  -4.689  -0.921   6.950
  467    HB2  PHE  60           1HB      PHE  60  -2.669  -0.862   8.313
  468    HB3  PHE  60           2HB      PHE  60  -4.050  -1.214   9.374
  469    HD1  PHE  60           HD1      PHE  60  -1.007  -2.537   7.832
  470    HD2  PHE  60           HD2      PHE  60  -4.290  -3.336  10.446
  471    HE1  PHE  60           HE1      PHE  60   0.168  -4.535   8.695
  472    HE2  PHE  60           HE2      PHE  60  -3.118  -5.333  11.312
  473    HZ   PHE  60           HZ       PHE  60  -0.888  -5.932  10.434
  474    H    ILE  61           H        ILE  61  -2.650  -0.673   5.826
  475    HA   ILE  61           HA       ILE  61  -2.096  -3.131   4.180
  476    HB   ILE  61           HB       ILE  61  -1.978  -0.214   3.292
  477   HG12  ILE  61          1HG1      ILE  61  -4.253  -0.856   3.782
  478   HG13  ILE  61          2HG1      ILE  61  -3.973  -0.583   2.046
  479   HG21  ILE  61          1HG2      ILE  61  -1.784  -1.203   1.035
  480   HG22  ILE  61          2HG2      ILE  61  -0.456  -1.744   2.086
  481   HG23  ILE  61          3HG2      ILE  61  -1.821  -2.834   1.746
  482   HD11  ILE  61          3HD1      ILE  61  -4.155  -3.291   3.415
  483   HD12  ILE  61          1HD1      ILE  61  -5.422  -2.541   2.418
  484   HD13  ILE  61          2HD1      ILE  61  -3.875  -3.018   1.678
  485    H    SER  62           H        SER  62  -0.144  -3.850   3.955
  486    HA   SER  62           HA       SER  62   2.180  -2.151   4.861
  487    HB2  SER  62           1HB      SER  62   2.068  -4.246   5.851
  488    HB3  SER  62           2HB      SER  62   1.992  -5.041   4.263
  489    HG   SER  62           HG       SER  62   4.114  -4.951   5.186
  490    H    VAL  63           H        VAL  63   2.821  -0.823   3.236
  491    HA   VAL  63           HA       VAL  63   2.851  -1.902   0.424
  492    HB   VAL  63           HB       VAL  63   2.939   0.973   1.429
  493   HG11  VAL  63          1HG1      VAL  63   2.658   1.543  -0.959
  494   HG12  VAL  63          2HG1      VAL  63   4.159   0.623  -0.693
  495   HG13  VAL  63          3HG1      VAL  63   2.729  -0.183  -1.381
  496   HG21  VAL  63          3HG2      VAL  63   0.760  -0.014   1.808
  497   HG22  VAL  63          1HG2      VAL  63   0.695   1.174   0.485
  498   HG23  VAL  63          2HG2      VAL  63   0.696  -0.566   0.117
  499    H    ASP  64           H        ASP  64   4.630  -2.592  -0.347
  500    HA   ASP  64           HA       ASP  64   7.179  -1.426   0.723
  501    HB2  ASP  64           1HB      ASP  64   6.804  -3.962   1.101
  502    HB3  ASP  64           2HB      ASP  64   6.680  -3.975  -0.674
  503    H    LYS  65           H        LYS  65   8.370  -0.240  -0.528
  504    HA   LYS  65           HA       LYS  65   7.634  -0.106  -3.417
  505    HB2  LYS  65           1HB      LYS  65   8.688   2.020  -3.440
  506    HB3  LYS  65           2HB      LYS  65   7.580   1.950  -2.049
  507    HG2  LYS  65           1HG      LYS  65   9.399   1.714  -0.507
  508    HG3  LYS  65           2HG      LYS  65  10.564   1.466  -1.828
  509    HD2  LYS  65           1HD      LYS  65  10.198   3.760  -2.606
  510    HD3  LYS  65           2HD      LYS  65   8.988   4.014  -1.326
  511    HE2  LYS  65           1HE      LYS  65  11.033   5.003  -0.581
  512    HE3  LYS  65           2HE      LYS  65  10.778   3.516   0.358
  513    HZ1  LYS  65           3HZ      LYS  65  12.568   3.786  -1.970
  514    HZ2  LYS  65           1HZ      LYS  65  13.050   3.714  -0.395
  515    HZ3  LYS  65           2HZ      LYS  65  12.332   2.405  -1.100
  516    H    GLU  66           H        GLU  66   9.595   0.664  -4.801
  517    HA   GLU  66           HA       GLU  66  11.638  -1.445  -4.636
  518    HB2  GLU  66           1HB      GLU  66  11.212   0.893  -6.499
  519    HB3  GLU  66           2HB      GLU  66  12.555  -0.266  -6.638
  520    HG2  GLU  66           1HG      GLU  66   9.606  -1.124  -6.788
  521    HG3  GLU  66           2HG      GLU  66  10.635  -0.612  -8.144
  522    H    ASN  67           H        ASN  67  13.906  -1.055  -4.678
  523    HA   ASN  67           HA       ASN  67  14.754   0.669  -2.535
  524    HB2  ASN  67           1HB      ASN  67  16.567  -0.790  -4.604
  525    HB3  ASN  67           2HB      ASN  67  16.836   0.312  -3.231
  526   HD21  ASN  67          2HD2      ASN  67  17.568  -2.528  -3.718
  527   HD22  ASN  67          1HD2      ASN  67  16.960  -3.390  -2.345
  528    H    ASP  68           H        ASP  68  14.860   1.005  -6.066
  529    HA   ASP  68           HA       ASP  68  16.269   3.542  -6.001
  530    HB2  ASP  68           1HB      ASP  68  14.558   2.230  -8.199
  531    HB3  ASP  68           2HB      ASP  68  15.397   3.802  -8.210
  532    H    ALA  69           H        ALA  69  12.851   2.610  -6.071
  533    HA   ALA  69           HA       ALA  69  11.797   5.213  -6.507
  534    HB1  ALA  69           3HB      ALA  69  10.604   2.893  -4.950
  535    HB2  ALA  69           1HB      ALA  69   9.714   4.314  -5.543
  536    HB3  ALA  69           2HB      ALA  69  10.443   3.176  -6.700
  537    H    ASN  70           H        ASN  70  10.719   6.644  -5.049
  538    HA   ASN  70           HA       ASN  70  11.806   6.550  -2.253
  539    HB2  ASN  70           1HB      ASN  70  11.454   9.222  -3.798
  540    HB3  ASN  70           2HB      ASN  70  11.838   8.691  -2.144
  541   HD21  ASN  70          2HD2      ASN  70  12.986   9.153  -5.357
  542   HD22  ASN  70          1HD2      ASN  70  14.648   8.766  -5.061
  543    H    TRP  71           H        TRP  71  10.533   7.353  -0.606
  544    HA   TRP  71           HA       TRP  71   7.692   6.869  -0.962
  545    HB2  TRP  71           1HB      TRP  71   9.414   7.854   1.335
  546    HB3  TRP  71           2HB      TRP  71   7.638   7.820   1.446
  547    HD1  TRP  71           HD1      TRP  71  10.360   5.971   2.429
  548    HE1  TRP  71           HE1      TRP  71   9.807   3.348   2.781
  549    HE3  TRP  71           HE3      TRP  71   5.977   5.794  -0.140
  550    HZ2  TRP  71           HZ2      TRP  71   7.770   1.648   2.012
  551    HZ3  TRP  71           HZ3      TRP  71   4.761   3.714  -0.324
  552    HH2  TRP  71           HH2      TRP  71   5.586   1.643   0.711
  553    H    GLU  72           H        GLU  72   9.723   9.674  -1.170
  554    HA   GLU  72           HA       GLU  72   7.847  11.746  -0.743
  555    HB2  GLU  72           1HB      GLU  72  10.244  12.071  -1.158
  556    HB3  GLU  72           2HB      GLU  72  10.008  11.568  -2.848
  557    HG2  GLU  72           1HG      GLU  72   8.521  13.596  -3.205
  558    HG3  GLU  72           2HG      GLU  72   8.793  13.930  -1.479
  559    H    THR  73           H        THR  73   8.378   9.763  -3.643
  560    HA   THR  73           HA       THR  73   6.087  11.072  -4.986
  561    HB   THR  73           HB       THR  73   7.853   8.740  -5.845
  562    HG1  THR  73           HG1      THR  73   8.711  10.372  -7.265
  563   HG21  THR  73          3HG2      THR  73   5.785  10.358  -7.387
  564   HG22  THR  73          1HG2      THR  73   6.844   9.103  -8.071
  565   HG23  THR  73          2HG2      THR  73   5.605   8.665  -6.869
  566    H    VAL  74           H        VAL  74   6.913   7.867  -3.650
  567    HA   VAL  74           HA       VAL  74   4.514   6.623  -4.725
  568    HB   VAL  74           HB       VAL  74   6.444   5.749  -2.536
  569   HG11  VAL  74          1HG1      VAL  74   5.425   3.513  -2.819
  570   HG12  VAL  74          2HG1      VAL  74   4.222   4.699  -2.259
  571   HG13  VAL  74          3HG1      VAL  74   4.248   4.195  -3.966
  572   HG21  VAL  74          3HG2      VAL  74   7.488   5.932  -4.714
  573   HG22  VAL  74          1HG2      VAL  74   7.313   4.226  -4.238
  574   HG23  VAL  74          2HG2      VAL  74   6.202   4.934  -5.436
  575    H    LEU  75           H        LEU  75   5.310   7.974  -1.533
  576    HA   LEU  75           HA       LEU  75   3.221   6.534  -0.202
  577    HB2  LEU  75           1HB      LEU  75   5.077   7.337   0.873
  578    HB3  LEU  75           2HB      LEU  75   4.764   9.064   0.585
  579    HG   LEU  75           HG       LEU  75   2.651   8.824   1.928
  580   HD11  LEU  75          1HD1      LEU  75   2.477   6.826   3.436
  581   HD12  LEU  75          2HD1      LEU  75   2.415   6.350   1.723
  582   HD13  LEU  75          3HD1      LEU  75   3.916   6.131   2.654
  583   HD21  LEU  75          3HD2      LEU  75   4.650   9.797   2.899
  584   HD22  LEU  75          1HD2      LEU  75   3.785   8.835   4.124
  585   HD23  LEU  75          2HD2      LEU  75   5.251   8.184   3.349
  586    HA   PRO  76           HA       PRO  76   0.687  10.617  -0.330
  587    HB2  PRO  76           2HB      PRO  76   2.004  12.537  -0.806
  588    HB3  PRO  76           1HB      PRO  76   1.353  12.342  -2.440
  589    HG2  PRO  76           1HG      PRO  76   3.256  11.156  -3.206
  590    HG3  PRO  76           2HG      PRO  76   3.990  12.305  -2.079
  591    HD2  PRO  76           1HD      PRO  76   4.488   9.688  -1.756
  592    HD3  PRO  76           2HD      PRO  76   4.161  10.667  -0.321
  593    H    LYS  77           H        LYS  77   1.886   9.283  -3.384
  594    HA   LYS  77           HA       LYS  77  -0.655   9.538  -4.751
  595    HB2  LYS  77           1HB      LYS  77   1.771   7.798  -5.186
  596    HB3  LYS  77           2HB      LYS  77   0.341   7.773  -6.245
  597    HG2  LYS  77           1HG      LYS  77   0.690  10.189  -6.717
  598    HG3  LYS  77           2HG      LYS  77   2.169  10.143  -5.729
  599    HD2  LYS  77           1HD      LYS  77   3.138   8.469  -7.239
  600    HD3  LYS  77           2HD      LYS  77   1.652   8.479  -8.217
  601    HE2  LYS  77           1HE      LYS  77   2.010  10.882  -8.691
  602    HE3  LYS  77           2HE      LYS  77   3.528  10.821  -7.768
  603    HZ1  LYS  77           3HZ      LYS  77   2.941   9.270 -10.208
  604    HZ2  LYS  77           1HZ      LYS  77   3.912  10.600 -10.127
  605    HZ3  LYS  77           2HZ      LYS  77   4.349   9.211  -9.351
  606    H    VAL  78           H        VAL  78   0.908   6.863  -2.993
  607    HA   VAL  78           HA       VAL  78  -1.316   5.020  -3.286
  608    HB   VAL  78           HB       VAL  78   0.885   5.231  -1.189
  609   HG11  VAL  78          1HG1      VAL  78   0.233   2.930  -0.564
  610   HG12  VAL  78          2HG1      VAL  78  -1.103   4.071  -0.287
  611   HG13  VAL  78          3HG1      VAL  78  -1.126   3.003  -1.709
  612   HG21  VAL  78          3HG2      VAL  78   1.714   4.762  -3.418
  613   HG22  VAL  78          1HG2      VAL  78   1.861   3.329  -2.374
  614   HG23  VAL  78          2HG2      VAL  78   0.560   3.416  -3.585
  615    H    GLU  79           H        GLU  79  -0.530   7.467  -0.849
  616    HA   GLU  79           HA       GLU  79  -2.568   6.866   1.010
  617    HB2  GLU  79           1HB      GLU  79  -0.878   8.509   1.460
  618    HB3  GLU  79           2HB      GLU  79  -1.444   9.520   0.108
  619    HG2  GLU  79           1HG      GLU  79  -3.630   9.888   1.379
  620    HG3  GLU  79           2HG      GLU  79  -2.906   8.848   2.627
  621    H    ALA  80           H        ALA  80  -2.771   8.686  -2.024
  622    HA   ALA  80           HA       ALA  80  -5.371   9.726  -1.689
  623    HB1  ALA  80           3HB      ALA  80  -4.030   8.765  -4.240
  624    HB2  ALA  80           1HB      ALA  80  -5.453   9.828  -4.151
  625    HB3  ALA  80           2HB      ALA  80  -3.883  10.387  -3.525
  626    H    VAL  81           H        VAL  81  -4.320   6.492  -2.595
  627    HA   VAL  81           HA       VAL  81  -6.773   5.525  -3.721
  628    HB   VAL  81           HB       VAL  81  -4.608   4.075  -2.144
  629   HG11  VAL  81          1HG1      VAL  81  -5.559   2.015  -3.128
  630   HG12  VAL  81          2HG1      VAL  81  -6.748   2.837  -2.090
  631   HG13  VAL  81          3HG1      VAL  81  -6.869   2.971  -3.861
  632   HG21  VAL  81          3HG2      VAL  81  -3.789   5.089  -4.186
  633   HG22  VAL  81          1HG2      VAL  81  -3.849   3.317  -4.340
  634   HG23  VAL  81          2HG2      VAL  81  -5.099   4.320  -5.116
  635    H    PHE  82           H        PHE  82  -5.739   5.783  -0.350
  636    HA   PHE  82           HA       PHE  82  -8.262   4.467   0.509
  637    HB2  PHE  82           1HB      PHE  82  -6.073   5.591   2.291
  638    HB3  PHE  82           2HB      PHE  82  -7.281   4.343   2.674
  639    HD1  PHE  82           HD1      PHE  82  -3.972   5.009   1.561
  640    HD2  PHE  82           HD2      PHE  82  -7.133   2.137   1.409
  641    HE1  PHE  82           HE1      PHE  82  -2.344   3.249   0.958
  642    HE2  PHE  82           HE2      PHE  82  -5.506   0.375   0.810
  643    HZ   PHE  82           HZ       PHE  82  -3.110   0.932   0.583
  644    H    GLU  83           H        GLU  83  -8.416   7.021  -0.849
  645    HA   GLU  83           HA       GLU  83  -9.750   8.529   1.375
  646    HB2  GLU  83           1HB      GLU  83  -8.994   9.410  -1.415
  647    HB3  GLU  83           2HB      GLU  83  -9.846  10.397  -0.204
  648    HG2  GLU  83           1HG      GLU  83  -7.766  10.251   1.280
  649    HG3  GLU  83           2HG      GLU  83  -7.077   9.284  -0.044
  650    H    LEU  84           H        LEU  84 -10.892   6.143   0.495
  651    HA   LEU  84           HA       LEU  84 -12.835   6.805  -1.629
  652    HB2  LEU  84           1HB      LEU  84 -12.448   4.445   0.096
  653    HB3  LEU  84           2HB      LEU  84 -13.528   4.388  -1.315
  654    HG   LEU  84           HG       LEU  84 -10.507   4.749  -1.362
  655   HD11  LEU  84          1HD1      LEU  84 -10.520   2.503  -2.480
  656   HD12  LEU  84          2HD1      LEU  84 -11.228   2.418  -0.851
  657   HD13  LEU  84          3HD1      LEU  84 -12.286   2.433  -2.281
  658   HD21  LEU  84          3HD2      LEU  84 -11.572   6.009  -3.136
  659   HD22  LEU  84          1HD2      LEU  84 -10.725   4.601  -3.818
  660   HD23  LEU  84          2HD2      LEU  84 -12.497   4.574  -3.641
  661    H    GLU  85           H        GLU  85 -14.715   7.674  -1.325
  662    HA   GLU  85           HA       GLU  85 -15.953   8.036   1.239
  663    HB2  GLU  85           1HB      GLU  85 -16.448   9.404  -0.727
  664    HB3  GLU  85           2HB      GLU  85 -17.167   7.985  -1.527
  665    HG2  GLU  85           1HG      GLU  85 -18.954   7.932   0.294
  666    HG3  GLU  85           2HG      GLU  85 -18.093   9.330   0.976
  667    H    HIS  86           H        HIS  86 -16.638   5.688  -1.364
  668    HA   HIS  86           HA       HIS  86 -18.265   4.118   0.577
  669    HB2  HIS  86           1HB      HIS  86 -17.858   3.808  -2.432
  670    HB3  HIS  86           2HB      HIS  86 -18.900   2.775  -1.425
  671    HD1  HIS  86           HD1      HIS  86 -21.020   3.942  -0.349
  672    HD2  HIS  86           HD2      HIS  86 -19.065   6.259  -3.277
  673    HE1  HIS  86           HE1      HIS  86 -22.634   5.635  -1.057
  674    H    HIS  87           H        HIS  87 -17.776   2.160   1.316
  675    HA   HIS  87           HA       HIS  87 -14.947   1.465   1.327
  676    HB2  HIS  87           1HB      HIS  87 -17.382   0.012   2.460
  677    HB3  HIS  87           2HB      HIS  87 -15.685  -0.427   2.770
  678    HD2  HIS  87           HD2      HIS  87 -18.421   1.738   4.417
  679    HE1  HIS  87           HE1      HIS  87 -14.648   3.116   5.801
  680    HE2  HIS  87           HE2      HIS  87 -17.259   3.168   6.108
  681    H    HIS  88           H        HIS  88 -13.856  -0.119   0.368
  682    HA   HIS  88           HA       HIS  88 -14.870  -0.962  -2.198
  683    HB2  HIS  88           1HB      HIS  88 -12.405  -0.553  -1.518
  684    HB3  HIS  88           2HB      HIS  88 -12.468  -2.176  -0.788
  685    HD1  HIS  88           HD1      HIS  88 -13.085  -4.166  -2.498
  686    HD2  HIS  88           HD2      HIS  88 -11.895  -0.550  -4.307
  687    HE1  HIS  88           HE1      HIS  88 -12.389  -4.746  -4.768
  688    H    HIS  89           H        HIS  89 -15.896  -2.681  -2.864
  689    HA   HIS  89           HA       HIS  89 -16.743  -4.613  -0.768
  690    HB2  HIS  89           1HB      HIS  89 -17.791  -4.117  -3.593
  691    HB3  HIS  89           2HB      HIS  89 -18.474  -5.274  -2.425
  692    HD2  HIS  89           HD2      HIS  89 -18.993  -1.577  -3.459
  693    HE1  HIS  89           HE1      HIS  89 -20.703  -2.139   0.388
  694    HE2  HIS  89           HE2      HIS  89 -20.475  -0.574  -1.712
  695    H    HIS  90           H        HIS  90 -14.753  -5.726  -0.625
  696    HA   HIS  90           HA       HIS  90 -14.603  -7.904  -2.623
  697    HB2  HIS  90           1HB      HIS  90 -13.016  -6.174  -3.491
  698    HB3  HIS  90           2HB      HIS  90 -12.161  -6.211  -1.930
  699    HD2  HIS  90           HD2      HIS  90 -11.879  -7.923  -5.368
  700    HE1  HIS  90           HE1      HIS  90  -9.963 -10.417  -2.512
  701    HE2  HIS  90           HE2      HIS  90 -10.361  -9.886  -5.055
  702    H    HIS  91           H        HIS  91 -14.257  -9.792  -1.747
  703    HA   HIS  91           HA       HIS  91 -13.204  -9.848   1.059
  704    HB2  HIS  91           1HB      HIS  91 -15.674 -10.171   1.065
  705    HB3  HIS  91           2HB      HIS  91 -15.487 -11.529  -0.068
  706    HD2  HIS  91           HD2      HIS  91 -15.228 -14.015   1.226
  707    HE1  HIS  91           HE1      HIS  91 -14.188 -12.390   5.012
  708    HE2  HIS  91           HE2      HIS  91 -14.742 -14.551   3.621
  Start of MODEL   17
    1    H1   MET   1           1H       MET   1 -13.335   0.843   2.281
    2    H2   MET   1           2H       MET   1 -13.587   1.094   3.739
    3    H3   MET   1           3H       MET   1 -13.433   2.249   2.794
    4    HA   MET   1           HA       MET   1 -11.318   1.095   4.292
    5    HB2  MET   1           1HB      MET   1 -11.209   0.649   1.318
    6    HB3  MET   1           2HB      MET   1  -9.753   0.698   2.342
    7    HG2  MET   1           1HG      MET   1 -10.438  -1.237   3.557
    8    HG3  MET   1           2HG      MET   1 -12.061  -1.199   2.826
    9    HE1  MET   1           3HE      MET   1 -12.108  -1.138  -0.063
   10    HE2  MET   1           1HE      MET   1 -11.684  -2.785  -0.589
   11    HE3  MET   1           2HE      MET   1 -12.726  -2.546   0.832
   12    H    LYS   2           H        LYS   2 -10.595   2.885   5.117
   13    HA   LYS   2           HA       LYS   2  -9.695   5.038   3.257
   14    HB2  LYS   2           1HB      LYS   2 -11.969   5.593   4.037
   15    HB3  LYS   2           2HB      LYS   2 -11.394   5.475   5.718
   16    HG2  LYS   2           1HG      LYS   2  -9.920   7.366   5.408
   17    HG3  LYS   2           2HG      LYS   2 -10.294   7.425   3.669
   18    HD2  LYS   2           1HD      LYS   2 -12.580   8.053   4.115
   19    HD3  LYS   2           2HD      LYS   2 -12.355   7.802   5.863
   20    HE2  LYS   2           1HE      LYS   2 -10.800   9.646   5.984
   21    HE3  LYS   2           2HE      LYS   2 -10.832   9.841   4.216
   22    HZ1  LYS   2           3HZ      LYS   2 -13.121  10.260   6.028
   23    HZ2  LYS   2           1HZ      LYS   2 -12.234  11.452   5.312
   24    HZ3  LYS   2           2HZ      LYS   2 -13.152  10.440   4.388
   25    H    ILE   3           H        ILE   3  -7.788   5.821   3.695
   26    HA   ILE   3           HA       ILE   3  -6.208   4.688   5.850
   27    HB   ILE   3           HB       ILE   3  -5.303   5.548   3.612
   28   HG12  ILE   3          1HG1      ILE   3  -4.018   6.747   6.048
   29   HG13  ILE   3          2HG1      ILE   3  -3.974   5.015   5.640
   30   HG21  ILE   3          1HG2      ILE   3  -4.804   7.967   3.495
   31   HG22  ILE   3          2HG2      ILE   3  -6.557   7.678   3.570
   32   HG23  ILE   3          3HG2      ILE   3  -5.681   8.223   5.021
   33   HD11  ILE   3          3HD1      ILE   3  -2.869   7.274   3.932
   34   HD12  ILE   3          1HD1      ILE   3  -1.909   6.152   4.923
   35   HD13  ILE   3          2HD1      ILE   3  -2.827   5.543   3.524
   36    H    ILE   4           H        ILE   4  -5.357   5.526   7.663
   37    HA   ILE   4           HA       ILE   4  -6.661   8.054   8.649
   38    HB   ILE   4           HB       ILE   4  -5.625   5.653  10.228
   39   HG12  ILE   4          1HG1      ILE   4  -8.430   6.701   9.961
   40   HG13  ILE   4          2HG1      ILE   4  -7.763   5.332   9.042
   41   HG21  ILE   4          1HG2      ILE   4  -6.490   6.869  12.199
   42   HG22  ILE   4          2HG2      ILE   4  -5.217   7.801  11.381
   43   HG23  ILE   4          3HG2      ILE   4  -6.926   8.245  11.161
   44   HD11  ILE   4          3HD1      ILE   4  -8.027   5.484  12.065
   45   HD12  ILE   4          1HD1      ILE   4  -9.076   4.550  10.974
   46   HD13  ILE   4          2HD1      ILE   4  -7.359   4.115  11.146
   47    H    SER   5           H        SER   5  -3.663   6.154   8.670
   48    HA   SER   5           HA       SER   5  -2.055   8.652   8.571
   49    HB2  SER   5           1HB      SER   5  -0.936   8.459  10.547
   50    HB3  SER   5           2HB      SER   5  -2.679   8.593  10.869
   51    HG   SER   5           HG       SER   5  -1.658   6.998  12.157
   52    H    ILE   6           H        ILE   6   0.245   8.160   8.464
   53    HA   ILE   6           HA       ILE   6   0.828   5.333   7.616
   54    HB   ILE   6           HB       ILE   6   2.222   7.951   6.891
   55   HG12  ILE   6          1HG1      ILE   6   1.581   6.757   4.565
   56   HG13  ILE   6          2HG1      ILE   6   0.212   6.260   5.586
   57   HG21  ILE   6          1HG2      ILE   6   3.670   6.540   5.470
   58   HG22  ILE   6          2HG2      ILE   6   3.830   6.097   7.186
   59   HG23  ILE   6          3HG2      ILE   6   2.860   5.083   6.092
   60   HD11  ILE   6          3HD1      ILE   6   1.133   9.118   5.111
   61   HD12  ILE   6          1HD1      ILE   6  -0.292   8.347   4.376
   62   HD13  ILE   6          2HD1      ILE   6  -0.236   8.621   6.134
   63    H    SER   7           H        SER   7   1.986   4.111   8.803
   64    HA   SER   7           HA       SER   7   3.464   5.328  11.139
   65    HB2  SER   7           1HB      SER   7   1.792   3.909  11.799
   66    HB3  SER   7           2HB      SER   7   2.352   2.626  10.703
   67    HG   SER   7           HG       SER   7   4.337   2.662  11.901
   68    H    GLU   8           H        GLU   8   5.614   5.058  11.363
   69    HA   GLU   8           HA       GLU   8   7.195   3.827   9.226
   70    HB2  GLU   8           1HB      GLU   8   7.954   4.867  11.960
   71    HB3  GLU   8           2HB      GLU   8   9.094   4.331  10.703
   72    HG2  GLU   8           1HG      GLU   8   8.205   6.224   9.208
   73    HG3  GLU   8           2HG      GLU   8   7.181   6.624  10.606
   74    H    THR   9           H        THR   9   8.878   2.225   9.678
   75    HA   THR   9           HA       THR   9   7.964   0.141  11.607
   76    HB   THR   9           HB       THR   9   8.076  -1.599   9.888
   77    HG1  THR   9           HG1      THR   9   8.213  -0.830   7.640
   78   HG21  THR   9          3HG2      THR   9   6.288   0.709   9.032
   79   HG22  THR   9          1HG2      THR   9   6.076  -0.995   8.571
   80   HG23  THR   9          2HG2      THR   9   5.896  -0.504  10.273
   81    HA   PRO  10           HA       PRO  10  12.224  -0.797  12.266
   82    HB2  PRO  10           2HB      PRO  10  12.274  -3.007  13.132
   83    HB3  PRO  10           1HB      PRO  10  11.526  -3.690  11.682
   84    HG2  PRO  10           1HG      PRO  10   9.723  -3.802  13.210
   85    HG3  PRO  10           2HG      PRO  10  10.204  -2.319  14.047
   86    HD2  PRO  10           1HD      PRO  10   8.784  -2.615  11.363
   87    HD3  PRO  10           2HD      PRO  10   8.465  -1.459  12.663
   88    H    ASN  11           H        ASN  11  10.543  -1.992   9.436
   89    HA   ASN  11           HA       ASN  11  13.140  -2.271   8.003
   90    HB2  ASN  11           1HB      ASN  11  10.321  -3.018   6.920
   91    HB3  ASN  11           2HB      ASN  11  11.975  -2.927   6.268
   92   HD21  ASN  11          2HD2      ASN  11   9.953  -5.136   6.846
   93   HD22  ASN  11          1HD2      ASN  11  10.882  -6.335   7.683
   94    H    HIS  12           H        HIS  12  13.468  -1.295   5.941
   95    HA   HIS  12           HA       HIS  12  12.579   1.543   6.084
   96    HB2  HIS  12           1HB      HIS  12  15.031   1.091   6.038
   97    HB3  HIS  12           2HB      HIS  12  14.833   0.266   4.473
   98    HD2  HIS  12           HD2      HIS  12  15.130   1.989   2.263
   99    HE1  HIS  12           HE1      HIS  12  14.651   5.577   4.489
  100    HE2  HIS  12           HE2      HIS  12  15.191   4.488   2.158
  101    H    ASN  13           H        ASN  13  12.831  -1.139   3.750
  102    HA   ASN  13           HA       ASN  13  11.909   0.556   1.561
  103    HB2  ASN  13           1HB      ASN  13  12.354  -2.524   1.533
  104    HB3  ASN  13           2HB      ASN  13  11.728  -1.317   0.382
  105   HD21  ASN  13          2HD2      ASN  13  14.042  -3.022   0.135
  106   HD22  ASN  13          1HD2      ASN  13  15.411  -1.976  -0.056
  107    H    THR  14           H        THR  14  10.345  -1.158   4.046
  108    HA   THR  14           HA       THR  14   7.745  -0.725   2.631
  109    HB   THR  14           HB       THR  14   8.211  -3.145   2.504
  110    HG1  THR  14           HG1      THR  14   6.297  -2.615   4.559
  111   HG21  THR  14          3HG2      THR  14   8.405  -2.975   5.538
  112   HG22  THR  14          1HG2      THR  14   8.416  -4.472   4.577
  113   HG23  THR  14          2HG2      THR  14   9.754  -3.308   4.428
  114    H    MET  15           H        MET  15   6.081  -0.011   3.816
  115    HA   MET  15           HA       MET  15   6.663   0.566   6.702
  116    HB2  MET  15           1HB      MET  15   5.541   2.408   4.593
  117    HB3  MET  15           2HB      MET  15   5.491   2.730   6.342
  118    HG2  MET  15           1HG      MET  15   7.940   2.733   6.421
  119    HG3  MET  15           2HG      MET  15   8.004   2.380   4.677
  120    HE1  MET  15           3HE      MET  15   7.415   5.034   7.460
  121    HE2  MET  15           1HE      MET  15   6.645   6.377   6.580
  122    HE3  MET  15           2HE      MET  15   5.758   4.854   6.835
  123    H    LYS  16           H        LYS  16   4.611   1.464   7.778
  124    HA   LYS  16           HA       LYS  16   2.466  -0.529   7.138
  125    HB2  LYS  16           1HB      LYS  16   3.521  -0.866   9.286
  126    HB3  LYS  16           2HB      LYS  16   3.242   0.836   9.719
  127    HG2  LYS  16           1HG      LYS  16   0.789   0.418   9.603
  128    HG3  LYS  16           2HG      LYS  16   1.127  -1.300   9.292
  129    HD2  LYS  16           1HD      LYS  16   2.227  -1.523  11.445
  130    HD3  LYS  16           2HD      LYS  16   2.058   0.222  11.749
  131    HE2  LYS  16           1HE      LYS  16  -0.387  -0.007  11.730
  132    HE3  LYS  16           2HE      LYS  16  -0.226  -1.748  11.414
  133    HZ1  LYS  16           3HZ      LYS  16   0.738  -0.348  13.825
  134    HZ2  LYS  16           1HZ      LYS  16  -0.606  -1.298  13.743
  135    HZ3  LYS  16           2HZ      LYS  16   0.888  -1.963  13.533
  136    H    ILE  17           H        ILE  17   0.541   0.078   6.553
  137    HA   ILE  17           HA       ILE  17  -0.202   2.970   6.921
  138    HB   ILE  17           HB       ILE  17  -1.208   0.961   4.852
  139   HG12  ILE  17          1HG1      ILE  17   1.067   1.573   4.413
  140   HG13  ILE  17          2HG1      ILE  17  -0.045   2.269   3.210
  141   HG21  ILE  17          1HG2      ILE  17  -2.328   2.929   3.861
  142   HG22  ILE  17          2HG2      ILE  17  -2.897   2.639   5.521
  143   HG23  ILE  17          3HG2      ILE  17  -1.731   3.943   5.195
  144   HD11  ILE  17          3HD1      ILE  17   1.208   3.758   5.544
  145   HD12  ILE  17          1HD1      ILE  17   1.706   3.882   3.841
  146   HD13  ILE  17          2HD1      ILE  17   0.096   4.453   4.341
  147    H    THR  18           H        THR  18  -1.766   3.515   8.156
  148    HA   THR  18           HA       THR  18  -3.438   1.341   9.324
  149    HB   THR  18           HB       THR  18  -3.097   4.258  10.137
  150    HG1  THR  18           HG1      THR  18  -1.983   3.264  11.921
  151   HG21  THR  18          3HG2      THR  18  -4.571   1.964  11.491
  152   HG22  THR  18          1HG2      THR  18  -4.343   3.595  12.163
  153   HG23  THR  18          2HG2      THR  18  -5.331   3.365  10.701
  154    H    LEU  19           H        LEU  19  -5.473   1.025   8.895
  155    HA   LEU  19           HA       LEU  19  -6.962   3.188   7.456
  156    HB2  LEU  19           1HB      LEU  19  -6.789   0.292   6.971
  157    HB3  LEU  19           2HB      LEU  19  -8.093   1.214   6.184
  158    HG   LEU  19           HG       LEU  19  -5.853   2.632   5.448
  159   HD11  LEU  19          1HD1      LEU  19  -4.216   0.930   4.599
  160   HD12  LEU  19          2HD1      LEU  19  -4.357   0.864   6.371
  161   HD13  LEU  19          3HD1      LEU  19  -5.177  -0.354   5.366
  162   HD21  LEU  19          3HD2      LEU  19  -7.715   2.045   4.009
  163   HD22  LEU  19          1HD2      LEU  19  -6.180   1.617   3.220
  164   HD23  LEU  19          2HD2      LEU  19  -7.183   0.348   3.964
  165    H    SER  20           H        SER  20  -9.229   3.163   7.652
  166    HA   SER  20           HA       SER  20 -10.120   2.456  10.390
  167    HB2  SER  20           1HB      SER  20 -12.058   3.606   9.895
  168    HB3  SER  20           2HB      SER  20 -10.619   4.563   9.474
  169    HG   SER  20           HG       SER  20 -12.523   4.385   7.939
  170    H    GLU  21           H        GLU  21 -11.256   1.788   7.043
  171    HA   GLU  21           HA       GLU  21 -12.538  -0.719   8.082
  172    HB2  GLU  21           1HB      GLU  21 -13.178   0.982   5.668
  173    HB3  GLU  21           2HB      GLU  21 -13.936  -0.582   6.048
  174    HG2  GLU  21           1HG      GLU  21 -14.831   0.470   8.213
  175    HG3  GLU  21           2HG      GLU  21 -14.038   1.950   7.629
  176    H    SER  22           H        SER  22 -12.583  -2.559   6.683
  177    HA   SER  22           HA       SER  22 -10.093  -2.759   4.955
  178    HB2  SER  22           1HB      SER  22  -9.670  -4.834   5.691
  179    HB3  SER  22           2HB      SER  22  -9.923  -3.819   7.130
  180    HG   SER  22           HG       SER  22 -11.959  -5.422   5.997
  181    H    ARG  23           H        ARG  23 -10.381  -5.051   3.748
  182    HA   ARG  23           HA       ARG  23 -12.694  -5.181   2.087
  183    HB2  ARG  23           1HB      ARG  23 -10.997  -7.471   2.968
  184    HB3  ARG  23           2HB      ARG  23 -12.109  -7.403   1.582
  185    HG2  ARG  23           1HG      ARG  23 -10.710  -5.719   0.506
  186    HG3  ARG  23           2HG      ARG  23  -9.618  -5.704   1.912
  187    HD2  ARG  23           1HD      ARG  23 -10.119  -8.062   0.127
  188    HD3  ARG  23           2HD      ARG  23  -8.745  -6.940   0.001
  189    HE   ARG  23           HE       ARG  23  -7.867  -7.986   2.135
  190   HH11  ARG  23          1HH1      ARG  23 -10.734  -9.530   0.886
  191   HH12  ARG  23          2HH1      ARG  23 -10.370 -10.971   1.817
  192   HH21  ARG  23          2HH2      ARG  23  -8.493 -11.027   3.144
  193   HH22  ARG  23          1HH2      ARG  23  -7.441  -9.627   3.212
  194    H    GLU  24           H        GLU  24 -14.119  -7.228   2.098
  195    HA   GLU  24           HA       GLU  24 -16.156  -6.815   3.907
  196    HB2  GLU  24           1HB      GLU  24 -16.269  -8.297   1.948
  197    HB3  GLU  24           2HB      GLU  24 -15.287  -9.498   2.821
  198    HG2  GLU  24           1HG      GLU  24 -17.163  -9.716   4.532
  199    HG3  GLU  24           2HG      GLU  24 -17.993  -8.475   3.567
  200    H    GLY  25           H        GLY  25 -13.513  -9.172   4.373
  201    HA2  GLY  25           1HA      GLY  25 -14.177  -9.102   7.292
  202    HA3  GLY  25           2HA      GLY  25 -13.424 -10.486   6.464
  203    H    MET  26           H        MET  26 -12.126  -9.728   8.621
  204    HA   MET  26           HA       MET  26  -9.935  -7.888   7.763
  205    HB2  MET  26           1HB      MET  26 -10.605  -9.154  10.419
  206    HB3  MET  26           2HB      MET  26  -9.198  -8.108  10.107
  207    HG2  MET  26           1HG      MET  26 -12.094  -7.266   9.787
  208    HG3  MET  26           2HG      MET  26 -11.098  -6.937  11.224
  209    HE1  MET  26           3HE      MET  26 -12.054  -4.353  10.622
  210    HE2  MET  26           1HE      MET  26 -11.595  -3.506   9.124
  211    HE3  MET  26           2HE      MET  26 -12.708  -4.894   9.057
  212    H    THR  27           H        THR  27 -10.153 -10.352   6.418
  213    HA   THR  27           HA       THR  27  -8.029 -12.068   7.548
  214    HB   THR  27           HB       THR  27  -8.359 -13.447   5.556
  215    HG1  THR  27           HG1      THR  27 -10.411 -11.748   4.630
  216   HG21  THR  27          3HG2      THR  27 -11.015 -12.488   6.693
  217   HG22  THR  27          1HG2      THR  27 -10.743 -14.026   5.844
  218   HG23  THR  27          2HG2      THR  27  -9.964 -13.727   7.416
  219    H    SER  28           H        SER  28  -6.206 -12.739   6.180
  220    HA   SER  28           HA       SER  28  -4.715 -10.310   5.301
  221    HB2  SER  28           1HB      SER  28  -2.835 -11.604   5.327
  222    HB3  SER  28           2HB      SER  28  -3.751 -11.851   6.831
  223    HG   SER  28           HG       SER  28  -2.954 -13.806   5.945
  224    H    ASP  29           H        ASP  29  -3.572 -10.251   3.306
  225    HA   ASP  29           HA       ASP  29  -3.979 -12.242   1.235
  226    HB2  ASP  29           1HB      ASP  29  -6.215 -10.707   1.332
  227    HB3  ASP  29           2HB      ASP  29  -5.028  -9.591   0.616
  228    H    THR  30           H        THR  30  -2.847 -11.810  -0.698
  229    HA   THR  30           HA       THR  30  -0.713  -9.734  -0.300
  230    HB   THR  30           HB       THR  30  -0.432 -12.506  -1.535
  231    HG1  THR  30           HG1      THR  30   0.925 -12.828   0.326
  232   HG21  THR  30          3HG2      THR  30   1.617 -10.317  -1.011
  233   HG22  THR  30          1HG2      THR  30   1.970 -11.944  -1.641
  234   HG23  THR  30          2HG2      THR  30   1.003 -10.806  -2.609
  235    H    TYR  31           H        TYR  31  -0.359  -8.343  -1.841
  236    HA   TYR  31           HA       TYR  31  -1.619  -8.870  -4.514
  237    HB2  TYR  31           1HB      TYR  31  -1.474  -6.224  -3.058
  238    HB3  TYR  31           2HB      TYR  31  -2.216  -6.541  -4.646
  239    HD1  TYR  31           HD1      TYR  31  -2.798  -6.337  -1.126
  240    HD2  TYR  31           HD2      TYR  31  -4.186  -8.228  -4.686
  241    HE1  TYR  31           HE1      TYR  31  -4.957  -6.827  -0.013
  242    HE2  TYR  31           HE2      TYR  31  -6.346  -8.725  -3.592
  243    HH   TYR  31           HH       TYR  31  -7.584  -8.563  -1.686
  244    H    THR  32           H        THR  32   0.007  -9.294  -5.805
  245    HA   THR  32           HA       THR  32   2.304  -7.362  -5.799
  246    HB   THR  32           HB       THR  32   3.715  -9.191  -6.659
  247    HG1  THR  32           HG1      THR  32   2.829 -11.334  -6.634
  248   HG21  THR  32          3HG2      THR  32   2.242  -9.951  -4.106
  249   HG22  THR  32          1HG2      THR  32   3.844 -10.548  -4.598
  250   HG23  THR  32          2HG2      THR  32   3.614  -8.824  -4.217
  251    H    LYS  33           H        LYS  33  -0.049  -9.156  -7.669
  252    HA   LYS  33           HA       LYS  33   0.816  -7.591 -10.078
  253    HB2  LYS  33           1HB      LYS  33  -0.188 -10.437  -9.932
  254    HB3  LYS  33           2HB      LYS  33   0.023  -9.502 -11.432
  255    HG2  LYS  33           1HG      LYS  33   2.444  -9.316 -10.958
  256    HG3  LYS  33           2HG      LYS  33   2.218 -10.295  -9.488
  257    HD2  LYS  33           1HD      LYS  33   1.401 -12.169 -10.861
  258    HD3  LYS  33           2HD      LYS  33   1.630 -11.191 -12.331
  259    HE2  LYS  33           1HE      LYS  33   4.036 -11.034 -11.846
  260    HE3  LYS  33           2HE      LYS  33   3.805 -12.021 -10.385
  261    HZ1  LYS  33           3HZ      LYS  33   3.282 -12.904 -13.151
  262    HZ2  LYS  33           1HZ      LYS  33   4.583 -13.339 -12.235
  263    HZ3  LYS  33           2HZ      LYS  33   3.067 -13.820 -11.795
  264    H    VAL  34           H        VAL  34  -0.763  -6.940 -11.519
  265    HA   VAL  34           HA       VAL  34  -3.319  -6.228 -10.310
  266    HB   VAL  34           HB       VAL  34  -2.341  -6.111 -13.192
  267   HG11  VAL  34          1HG1      VAL  34  -4.266  -4.603 -13.556
  268   HG12  VAL  34          2HG1      VAL  34  -4.807  -6.224 -13.062
  269   HG13  VAL  34          3HG1      VAL  34  -4.806  -4.888 -11.886
  270   HG21  VAL  34          3HG2      VAL  34  -1.063  -4.688 -11.704
  271   HG22  VAL  34          1HG2      VAL  34  -2.102  -3.715 -12.772
  272   HG23  VAL  34          2HG2      VAL  34  -2.565  -3.969 -11.072
  273    H    ASP  35           H        ASP  35  -5.231  -7.079 -10.349
  274    HA   ASP  35           HA       ASP  35  -5.908  -9.280 -12.165
  275    HB2  ASP  35           1HB      ASP  35  -4.469 -10.299 -10.156
  276    HB3  ASP  35           2HB      ASP  35  -5.929  -9.785  -9.275
  277    H    ASP  36           H        ASP  36  -8.056  -9.818 -12.194
  278    HA   ASP  36           HA       ASP  36  -9.781  -7.595 -11.539
  279    HB2  ASP  36           1HB      ASP  36 -10.432 -10.427 -12.554
  280    HB3  ASP  36           2HB      ASP  36 -11.543  -9.092 -12.165
  281    H    SER  37           H        SER  37  -9.027 -10.620  -9.938
  282    HA   SER  37           HA       SER  37 -11.276 -10.676  -8.086
  283    HB2  SER  37           1HB      SER  37 -10.125 -12.273  -6.923
  284    HB3  SER  37           2HB      SER  37 -10.001 -12.588  -8.670
  285    HG   SER  37           HG       SER  37  -7.900 -11.842  -8.621
  286    H    GLN  38           H        GLN  38  -8.458  -8.691  -8.356
  287    HA   GLN  38           HA       GLN  38  -8.409  -8.083  -5.447
  288    HB2  GLN  38           1HB      GLN  38  -6.731  -7.015  -7.727
  289    HB3  GLN  38           2HB      GLN  38  -6.473  -6.714  -5.993
  290    HG2  GLN  38           1HG      GLN  38  -5.865  -9.303  -5.747
  291    HG3  GLN  38           2HG      GLN  38  -6.469  -9.230  -7.418
  292   HE21  GLN  38          2HE2      GLN  38  -5.066  -6.655  -7.924
  293   HE22  GLN  38          1HE2      GLN  38  -3.398  -7.071  -8.130
  294    HA   PRO  39           HA       PRO  39 -10.771  -4.356  -5.546
  295    HB2  PRO  39           2HB      PRO  39 -10.096  -3.146  -3.610
  296    HB3  PRO  39           1HB      PRO  39  -8.388  -3.171  -4.071
  297    HG2  PRO  39           1HG      PRO  39  -8.410  -4.787  -2.343
  298    HG3  PRO  39           2HG      PRO  39 -10.038  -5.348  -2.747
  299    HD2  PRO  39           1HD      PRO  39  -7.406  -5.988  -4.135
  300    HD3  PRO  39           2HD      PRO  39  -8.781  -7.053  -3.817
  301    H    ALA  40           H        ALA  40 -11.016  -2.788  -6.907
  302    HA   ALA  40           HA       ALA  40  -9.303  -2.454  -9.105
  303    HB1  ALA  40           3HB      ALA  40 -11.248  -0.442  -7.923
  304    HB2  ALA  40           1HB      ALA  40 -10.563  -0.387  -9.564
  305    HB3  ALA  40           2HB      ALA  40 -11.644  -1.720  -9.095
  306    H    PHE  41           H        PHE  41  -9.478  -0.507  -6.125
  307    HA   PHE  41           HA       PHE  41  -7.448   1.372  -7.009
  308    HB2  PHE  41           1HB      PHE  41  -7.575   2.260  -4.762
  309    HB3  PHE  41           2HB      PHE  41  -9.230   1.840  -5.258
  310    HD1  PHE  41           HD1      PHE  41  -6.442   1.040  -3.039
  311    HD2  PHE  41           HD2      PHE  41 -10.405   0.002  -4.251
  312    HE1  PHE  41           HE1      PHE  41  -6.706  -0.325  -0.997
  313    HE2  PHE  41           HE2      PHE  41 -10.674  -1.364  -2.208
  314    HZ   PHE  41           HZ       PHE  41  -8.822  -1.529  -0.582
  315    H    ILE  42           H        ILE  42  -7.383  -1.714  -5.362
  316    HA   ILE  42           HA       ILE  42  -4.539  -1.576  -4.695
  317    HB   ILE  42           HB       ILE  42  -6.496  -3.887  -5.042
  318   HG12  ILE  42          1HG1      ILE  42  -6.880  -2.506  -3.118
  319   HG13  ILE  42          2HG1      ILE  42  -6.304  -4.129  -2.668
  320   HG21  ILE  42          1HG2      ILE  42  -4.713  -5.331  -4.125
  321   HG22  ILE  42          2HG2      ILE  42  -4.221  -4.616  -5.678
  322   HG23  ILE  42          3HG2      ILE  42  -3.583  -3.956  -4.152
  323   HD11  ILE  42          3HD1      ILE  42  -4.625  -1.597  -2.717
  324   HD12  ILE  42          1HD1      ILE  42  -5.263  -2.394  -1.262
  325   HD13  ILE  42          2HD1      ILE  42  -4.049  -3.219  -2.267
  326    H    ASN  43           H        ASN  43  -6.382  -2.601  -7.518
  327    HA   ASN  43           HA       ASN  43  -4.089  -3.525  -9.011
  328    HB2  ASN  43           1HB      ASN  43  -6.784  -2.473 -10.158
  329    HB3  ASN  43           2HB      ASN  43  -5.251  -3.062 -10.845
  330   HD21  ASN  43          2HD2      ASN  43  -8.123  -4.057 -10.745
  331   HD22  ASN  43          1HD2      ASN  43  -7.972  -5.713 -10.257
  332    H    ASP  44           H        ASP  44  -5.677  -0.348  -8.754
  333    HA   ASP  44           HA       ASP  44  -3.989   0.982 -10.647
  334    HB2  ASP  44           1HB      ASP  44  -5.530   2.103  -8.231
  335    HB3  ASP  44           2HB      ASP  44  -4.550   2.963  -9.443
  336    H    ILE  45           H        ILE  45  -3.710   0.646  -7.107
  337    HA   ILE  45           HA       ILE  45  -1.390   2.364  -6.915
  338    HB   ILE  45           HB       ILE  45  -2.989   1.623  -5.006
  339   HG12  ILE  45          1HG1      ILE  45  -0.037   1.380  -4.500
  340   HG13  ILE  45          2HG1      ILE  45  -0.888   2.914  -4.795
  341   HG21  ILE  45          1HG2      ILE  45  -2.276  -0.411  -3.798
  342   HG22  ILE  45          2HG2      ILE  45  -2.839  -0.805  -5.439
  343   HG23  ILE  45          3HG2      ILE  45  -1.096  -0.761  -5.083
  344   HD11  ILE  45          3HD1      ILE  45  -1.430   0.993  -2.506
  345   HD12  ILE  45          1HD1      ILE  45  -0.551   2.533  -2.385
  346   HD13  ILE  45          2HD1      ILE  45  -2.283   2.525  -2.801
  347    H    LEU  46           H        LEU  46  -1.751  -1.108  -7.404
  348    HA   LEU  46           HA       LEU  46   1.048  -1.726  -7.295
  349    HB2  LEU  46           1HB      LEU  46  -1.283  -2.782  -8.734
  350    HB3  LEU  46           2HB      LEU  46   0.267  -3.631  -8.938
  351    HG   LEU  46           HG       LEU  46  -1.234  -3.241  -6.319
  352   HD11  LEU  46          1HD1      LEU  46  -1.562  -5.725  -6.429
  353   HD12  LEU  46          2HD1      LEU  46  -2.308  -4.912  -7.825
  354   HD13  LEU  46          3HD1      LEU  46  -0.747  -5.748  -8.010
  355   HD21  LEU  46          3HD2      LEU  46   1.168  -3.240  -5.992
  356   HD22  LEU  46          1HD2      LEU  46   0.472  -4.750  -5.363
  357   HD23  LEU  46          2HD2      LEU  46   1.326  -4.747  -6.924
  358    H    LYS  47           H        LYS  47  -0.996  -0.425  -9.864
  359    HA   LYS  47           HA       LYS  47   1.096  -0.602 -11.889
  360    HB2  LYS  47           1HB      LYS  47  -1.501   0.923 -11.704
  361    HB3  LYS  47           2HB      LYS  47  -0.414   0.992 -13.111
  362    HG2  LYS  47           1HG      LYS  47  -0.684  -1.440 -13.430
  363    HG3  LYS  47           2HG      LYS  47  -1.788  -1.494 -12.037
  364    HD2  LYS  47           1HD      LYS  47  -3.339   0.020 -13.191
  365    HD3  LYS  47           2HD      LYS  47  -2.229   0.107 -14.579
  366    HE2  LYS  47           1HE      LYS  47  -2.469  -2.336 -14.894
  367    HE3  LYS  47           2HE      LYS  47  -3.630  -2.377 -13.548
  368    HZ1  LYS  47           3HZ      LYS  47  -3.978  -0.881 -16.066
  369    HZ2  LYS  47           1HZ      LYS  47  -4.738  -2.292 -15.676
  370    HZ3  LYS  47           2HZ      LYS  47  -5.055  -0.919 -14.818
  371    H    VAL  48           H        VAL  48   0.341   1.598  -9.341
  372    HA   VAL  48           HA       VAL  48   1.583   3.978 -10.430
  373    HB   VAL  48           HB       VAL  48   1.210   3.032  -7.559
  374   HG11  VAL  48          1HG1      VAL  48   1.677   5.379  -6.942
  375   HG12  VAL  48          2HG1      VAL  48   3.080   4.637  -7.744
  376   HG13  VAL  48          3HG1      VAL  48   2.031   5.757  -8.644
  377   HG21  VAL  48          3HG2      VAL  48  -0.882   3.392  -8.729
  378   HG22  VAL  48          1HG2      VAL  48  -0.612   4.660  -7.510
  379   HG23  VAL  48          2HG2      VAL  48  -0.341   5.012  -9.234
  380    H    GLU  49           H        GLU  49   3.522   4.373 -10.995
  381    HA   GLU  49           HA       GLU  49   5.762   2.679 -10.427
  382    HB2  GLU  49           1HB      GLU  49   5.619   4.291 -12.293
  383    HB3  GLU  49           2HB      GLU  49   5.720   5.622 -11.115
  384    HG2  GLU  49           1HG      GLU  49   8.042   4.809 -10.463
  385    HG3  GLU  49           2HG      GLU  49   7.764   3.505 -11.639
  386    H    GLY  50           H        GLY  50   7.068   2.448  -8.793
  387    HA2  GLY  50           1HA      GLY  50   8.357   3.463  -6.960
  388    HA3  GLY  50           2HA      GLY  50   6.953   4.504  -6.621
  389    H    VAL  51           H        VAL  51   4.989   2.391  -6.983
  390    HA   VAL  51           HA       VAL  51   5.322   0.971  -4.379
  391    HB   VAL  51           HB       VAL  51   2.979   1.105  -6.323
  392   HG11  VAL  51          1HG1      VAL  51   1.700   0.085  -4.470
  393   HG12  VAL  51          2HG1      VAL  51   3.020  -0.981  -4.999
  394   HG13  VAL  51          3HG1      VAL  51   3.190  -0.029  -3.505
  395   HG21  VAL  51          3HG2      VAL  51   3.417   3.257  -5.298
  396   HG22  VAL  51          1HG2      VAL  51   1.930   2.536  -4.643
  397   HG23  VAL  51          2HG2      VAL  51   3.427   2.506  -3.684
  398    H    LYS  52           H        LYS  52   5.950  -0.979  -4.118
  399    HA   LYS  52           HA       LYS  52   6.393  -2.611  -6.581
  400    HB2  LYS  52           1HB      LYS  52   8.332  -2.113  -5.171
  401    HB3  LYS  52           2HB      LYS  52   7.511  -2.865  -3.783
  402    HG2  LYS  52           1HG      LYS  52   7.527  -5.032  -4.933
  403    HG3  LYS  52           2HG      LYS  52   8.315  -4.288  -6.343
  404    HD2  LYS  52           1HD      LYS  52  10.243  -3.672  -4.913
  405    HD3  LYS  52           2HD      LYS  52   9.459  -4.486  -3.537
  406    HE2  LYS  52           1HE      LYS  52   9.524  -6.615  -4.725
  407    HE3  LYS  52           2HE      LYS  52  10.232  -5.820  -6.150
  408    HZ1  LYS  52           3HZ      LYS  52  11.496  -6.016  -3.492
  409    HZ2  LYS  52           1HZ      LYS  52  11.905  -6.908  -4.816
  410    HZ3  LYS  52           2HZ      LYS  52  12.153  -5.278  -4.813
  411    H    SER  53           H        SER  53   5.168  -2.939  -3.242
  412    HA   SER  53           HA       SER  53   3.453  -5.259  -4.128
  413    HB2  SER  53           1HB      SER  53   5.478  -6.265  -3.570
  414    HB3  SER  53           2HB      SER  53   5.484  -5.455  -1.986
  415    HG   SER  53           HG       SER  53   4.633  -7.579  -1.893
  416    H    ILE  54           H        ILE  54   1.544  -5.292  -3.093
  417    HA   ILE  54           HA       ILE  54   1.264  -3.691  -0.558
  418    HB   ILE  54           HB       ILE  54  -0.863  -4.291  -2.666
  419   HG12  ILE  54          1HG1      ILE  54   0.774  -2.679  -3.436
  420   HG13  ILE  54          2HG1      ILE  54  -0.845  -1.981  -3.208
  421   HG21  ILE  54          1HG2      ILE  54  -2.268  -2.778  -1.310
  422   HG22  ILE  54          2HG2      ILE  54  -1.742  -4.185  -0.358
  423   HG23  ILE  54          3HG2      ILE  54  -0.948  -2.609  -0.127
  424   HD11  ILE  54          3HD1      ILE  54   1.505  -1.683  -1.303
  425   HD12  ILE  54          1HD1      ILE  54   0.907  -0.438  -2.424
  426   HD13  ILE  54          2HD1      ILE  54  -0.115  -0.985  -1.075
  427    H    PHE  55           H        PHE  55   0.787  -4.671   1.195
  428    HA   PHE  55           HA       PHE  55  -0.359  -7.439   0.983
  429    HB2  PHE  55           1HB      PHE  55   2.042  -7.553   1.583
  430    HB3  PHE  55           2HB      PHE  55   1.756  -6.447   2.945
  431    HD1  PHE  55           HD1      PHE  55   0.490  -9.689   1.583
  432    HD2  PHE  55           HD2      PHE  55   1.463  -7.334   5.013
  433    HE1  PHE  55           HE1      PHE  55  -0.003 -11.619   3.046
  434    HE2  PHE  55           HE2      PHE  55   0.973  -9.263   6.479
  435    HZ   PHE  55           HZ       PHE  55   0.238 -11.407   5.495
  436    H    HIS  56           H        HIS  56  -2.185  -7.747   1.962
  437    HA   HIS  56           HA       HIS  56  -3.030  -5.798   4.063
  438    HB2  HIS  56           1HB      HIS  56  -4.655  -6.073   2.256
  439    HB3  HIS  56           2HB      HIS  56  -4.616  -7.842   2.446
  440    HD2  HIS  56           HD2      HIS  56  -5.017  -5.716   5.789
  441    HE1  HIS  56           HE1      HIS  56  -8.725  -7.477   4.694
  442    HE2  HIS  56           HE2      HIS  56  -7.368  -6.157   6.519
  443    H    VAL  57           H        VAL  57  -2.863  -6.267   6.098
  444    HA   VAL  57           HA       VAL  57  -3.413  -9.093   6.958
  445    HB   VAL  57           HB       VAL  57  -0.986  -8.845   7.135
  446   HG11  VAL  57          1HG1      VAL  57   0.001  -7.056   8.530
  447   HG12  VAL  57          2HG1      VAL  57  -0.881  -6.374   7.143
  448   HG13  VAL  57          3HG1      VAL  57  -1.613  -6.349   8.766
  449   HG21  VAL  57          3HG2      VAL  57  -2.125 -10.064   8.891
  450   HG22  VAL  57          1HG2      VAL  57  -0.718  -9.189   9.540
  451   HG23  VAL  57          2HG2      VAL  57  -2.359  -8.557   9.811
  452    H    MET  58           H        MET  58  -4.837  -9.336   8.450
  453    HA   MET  58           HA       MET  58  -6.529  -8.744   9.937
  454    HB2  MET  58           1HB      MET  58  -4.484  -8.429  11.312
  455    HB3  MET  58           2HB      MET  58  -4.493  -6.711  10.847
  456    HG2  MET  58           1HG      MET  58  -6.706  -6.451  11.905
  457    HG3  MET  58           2HG      MET  58  -6.658  -8.160  12.400
  458    HE1  MET  58           3HE      MET  58  -3.803  -8.733  13.382
  459    HE2  MET  58           1HE      MET  58  -3.883  -8.262  15.098
  460    HE3  MET  58           2HE      MET  58  -5.253  -9.112  14.343
  461    H    ASP  59           H        ASP  59  -5.537  -5.497  10.383
  462    HA   ASP  59           HA       ASP  59  -7.772  -4.574   8.613
  463    HB2  ASP  59           1HB      ASP  59  -8.684  -3.190  10.438
  464    HB3  ASP  59           2HB      ASP  59  -8.484  -4.910  10.852
  465    H    PHE  60           H        PHE  60  -4.764  -4.529   8.490
  466    HA   PHE  60           HA       PHE  60  -4.639  -1.693   7.650
  467    HB2  PHE  60           1HB      PHE  60  -2.565  -1.235   8.846
  468    HB3  PHE  60           2HB      PHE  60  -3.799  -1.725  10.028
  469    HD1  PHE  60           HD1      PHE  60  -0.621  -2.525   8.475
  470    HD2  PHE  60           HD2      PHE  60  -3.702  -3.923  11.084
  471    HE1  PHE  60           HE1      PHE  60   0.910  -4.257   9.351
  472    HE2  PHE  60           HE2      PHE  60  -2.174  -5.656  11.963
  473    HZ   PHE  60           HZ       PHE  60   0.133  -5.824  11.095
  474    H    ILE  61           H        ILE  61  -2.539  -1.232   6.514
  475    HA   ILE  61           HA       ILE  61  -1.956  -3.618   4.776
  476    HB   ILE  61           HB       ILE  61  -2.533  -0.737   3.951
  477   HG12  ILE  61          1HG1      ILE  61  -3.964  -3.288   3.257
  478   HG13  ILE  61          2HG1      ILE  61  -4.484  -2.118   4.492
  479   HG21  ILE  61          1HG2      ILE  61  -2.146  -1.536   1.645
  480   HG22  ILE  61          2HG2      ILE  61  -0.680  -1.710   2.637
  481   HG23  ILE  61          3HG2      ILE  61  -1.684  -3.133   2.275
  482   HD11  ILE  61          3HD1      ILE  61  -4.191  -1.557   1.518
  483   HD12  ILE  61          1HD1      ILE  61  -5.724  -1.803   2.386
  484   HD13  ILE  61          2HD1      ILE  61  -4.711  -0.386   2.754
  485    H    SER  62           H        SER  62   0.026  -4.153   4.560
  486    HA   SER  62           HA       SER  62   2.234  -2.253   5.245
  487    HB2  SER  62           1HB      SER  62   2.411  -4.368   6.132
  488    HB3  SER  62           2HB      SER  62   2.217  -5.123   4.534
  489    HG   SER  62           HG       SER  62   4.395  -4.976   5.073
  490    H    VAL  63           H        VAL  63   3.205  -1.045   3.751
  491    HA   VAL  63           HA       VAL  63   2.876  -1.784   0.844
  492    HB   VAL  63           HB       VAL  63   3.214   0.968   2.108
  493   HG11  VAL  63          1HG1      VAL  63   2.849   1.787  -0.195
  494   HG12  VAL  63          2HG1      VAL  63   4.295   0.755  -0.104
  495   HG13  VAL  63          3HG1      VAL  63   2.782   0.109  -0.783
  496   HG21  VAL  63          3HG2      VAL  63   0.997   0.084   2.516
  497   HG22  VAL  63          1HG2      VAL  63   0.943   1.400   1.319
  498   HG23  VAL  63          2HG2      VAL  63   0.807  -0.293   0.787
  499    H    ASP  64           H        ASP  64   4.555  -2.487  -0.118
  500    HA   ASP  64           HA       ASP  64   7.233  -1.504   0.807
  501    HB2  ASP  64           1HB      ASP  64   6.811  -4.066   0.844
  502    HB3  ASP  64           2HB      ASP  64   6.525  -3.807  -0.892
  503    H    LYS  65           H        LYS  65   8.421  -0.270  -0.418
  504    HA   LYS  65           HA       LYS  65   7.282   0.454  -3.079
  505    HB2  LYS  65           1HB      LYS  65   8.469   2.482  -2.892
  506    HB3  LYS  65           2HB      LYS  65   7.639   2.199  -1.345
  507    HG2  LYS  65           1HG      LYS  65   9.671   1.614  -0.250
  508    HG3  LYS  65           2HG      LYS  65  10.551   1.497  -1.792
  509    HD2  LYS  65           1HD      LYS  65  10.335   3.899  -2.142
  510    HD3  LYS  65           2HD      LYS  65   9.352   4.049  -0.665
  511    HE2  LYS  65           1HE      LYS  65  11.524   4.729  -0.037
  512    HE3  LYS  65           2HE      LYS  65  11.340   3.075   0.591
  513    HZ1  LYS  65           3HZ      LYS  65  12.742   3.818  -1.895
  514    HZ2  LYS  65           1HZ      LYS  65  13.467   3.388  -0.477
  515    HZ3  LYS  65           2HZ      LYS  65  12.571   2.284  -1.313
  516    H    GLU  66           H        GLU  66   9.093   1.361  -4.591
  517    HA   GLU  66           HA       GLU  66  10.931  -0.894  -5.112
  518    HB2  GLU  66           1HB      GLU  66  10.438   1.707  -6.570
  519    HB3  GLU  66           2HB      GLU  66  11.521   0.404  -7.117
  520    HG2  GLU  66           1HG      GLU  66   9.535  -1.127  -7.366
  521    HG3  GLU  66           2HG      GLU  66   8.576   0.188  -6.653
  522    H    ASN  67           H        ASN  67  13.175  -0.611  -5.541
  523    HA   ASN  67           HA       ASN  67  14.454   0.651  -3.286
  524    HB2  ASN  67           1HB      ASN  67  15.835  -0.596  -5.783
  525    HB3  ASN  67           2HB      ASN  67  16.387   0.244  -4.314
  526   HD21  ASN  67          2HD2      ASN  67  16.755  -2.529  -5.315
  527   HD22  ASN  67          1HD2      ASN  67  16.238  -3.551  -4.015
  528    H    ASP  68           H        ASP  68  14.115   1.570  -6.691
  529    HA   ASP  68           HA       ASP  68  15.905   3.851  -6.467
  530    HB2  ASP  68           1HB      ASP  68  13.785   3.136  -8.583
  531    HB3  ASP  68           2HB      ASP  68  14.848   4.563  -8.488
  532    H    ALA  69           H        ALA  69  12.396   3.407  -6.222
  533    HA   ALA  69           HA       ALA  69  11.813   6.225  -6.147
  534    HB1  ALA  69           3HB      ALA  69  10.205   3.860  -5.122
  535    HB2  ALA  69           1HB      ALA  69   9.591   5.513  -5.353
  536    HB3  ALA  69           2HB      ALA  69  10.121   4.555  -6.756
  537    H    ASN  70           H        ASN  70  10.974   7.447  -4.367
  538    HA   ASN  70           HA       ASN  70  11.972   6.506  -1.694
  539    HB2  ASN  70           1HB      ASN  70  11.901   9.509  -2.482
  540    HB3  ASN  70           2HB      ASN  70  12.248   8.518  -1.044
  541   HD21  ASN  70          2HD2      ASN  70  13.413   9.761  -4.022
  542   HD22  ASN  70          1HD2      ASN  70  15.022   9.126  -3.923
  543    H    TRP  71           H        TRP  71  10.815   7.231   0.153
  544    HA   TRP  71           HA       TRP  71   7.983   6.773  -0.194
  545    HB2  TRP  71           1HB      TRP  71   9.735   7.535   2.163
  546    HB3  TRP  71           2HB      TRP  71   7.962   7.441   2.305
  547    HD1  TRP  71           HD1      TRP  71  10.776   5.561   2.972
  548    HE1  TRP  71           HE1      TRP  71  10.285   2.904   3.052
  549    HE3  TRP  71           HE3      TRP  71   6.279   5.574   0.602
  550    HZ2  TRP  71           HZ2      TRP  71   8.242   1.254   2.191
  551    HZ3  TRP  71           HZ3      TRP  71   5.091   3.500   0.241
  552    HH2  TRP  71           HH2      TRP  71   6.001   1.346   0.999
  553    H    GLU  72           H        GLU  72   9.953   9.647  -0.004
  554    HA   GLU  72           HA       GLU  72   7.926  11.563   0.573
  555    HB2  GLU  72           1HB      GLU  72  10.385  11.693  -1.173
  556    HB3  GLU  72           2HB      GLU  72   9.350  13.096  -0.810
  557    HG2  GLU  72           1HG      GLU  72   9.913  12.849   1.642
  558    HG3  GLU  72           2HG      GLU  72  10.811  11.391   1.162
  559    H    THR  73           H        THR  73   8.782   9.948  -2.459
  560    HA   THR  73           HA       THR  73   6.663  11.377  -3.925
  561    HB   THR  73           HB       THR  73   8.343   8.952  -4.696
  562    HG1  THR  73           HG1      THR  73   9.445  10.556  -5.971
  563   HG21  THR  73          3HG2      THR  73   6.551  10.763  -6.364
  564   HG22  THR  73          1HG2      THR  73   7.578   9.453  -6.991
  565   HG23  THR  73          2HG2      THR  73   6.203   9.074  -5.925
  566    H    VAL  74           H        VAL  74   7.146   8.125  -2.544
  567    HA   VAL  74           HA       VAL  74   4.838   7.017  -3.928
  568    HB   VAL  74           HB       VAL  74   6.448   6.023  -1.540
  569   HG11  VAL  74          1HG1      VAL  74   5.354   3.848  -1.967
  570   HG12  VAL  74          2HG1      VAL  74   4.157   5.093  -1.534
  571   HG13  VAL  74          3HG1      VAL  74   4.356   4.599  -3.234
  572   HG21  VAL  74          3HG2      VAL  74   7.747   6.166  -3.579
  573   HG22  VAL  74          1HG2      VAL  74   7.429   4.469  -3.150
  574   HG23  VAL  74          2HG2      VAL  74   6.504   5.243  -4.458
  575    H    LEU  75           H        LEU  75   5.313   8.236  -0.615
  576    HA   LEU  75           HA       LEU  75   2.990   6.906   0.392
  577    HB2  LEU  75           1HB      LEU  75   4.653   9.180   1.184
  578    HB3  LEU  75           2HB      LEU  75   3.279   8.801   2.250
  579    HG   LEU  75           HG       LEU  75   5.646   7.005   1.591
  580   HD11  LEU  75          1HD1      LEU  75   6.098   7.184   4.053
  581   HD12  LEU  75          2HD1      LEU  75   6.120   8.783   3.273
  582   HD13  LEU  75          3HD1      LEU  75   4.699   8.271   4.215
  583   HD21  LEU  75          3HD2      LEU  75   3.612   5.693   1.722
  584   HD22  LEU  75          1HD2      LEU  75   4.628   5.381   3.149
  585   HD23  LEU  75          2HD2      LEU  75   3.199   6.435   3.286
  586    HA   PRO  76           HA       PRO  76   0.830  11.311  -0.273
  587    HB2  PRO  76           2HB      PRO  76   1.685  12.949  -1.805
  588    HB3  PRO  76           1HB      PRO  76   2.365  11.727  -2.887
  589    HG2  PRO  76           1HG      PRO  76   4.299  12.523  -1.752
  590    HG3  PRO  76           2HG      PRO  76   3.442  12.716  -0.217
  591    HD2  PRO  76           1HD      PRO  76   4.473  10.164  -1.513
  592    HD3  PRO  76           2HD      PRO  76   4.448  10.610   0.198
  593    H    LYS  77           H        LYS  77   2.006   9.227  -2.914
  594    HA   LYS  77           HA       LYS  77  -0.544   9.314  -4.306
  595    HB2  LYS  77           1HB      LYS  77   1.834   7.462  -4.492
  596    HB3  LYS  77           2HB      LYS  77   0.412   7.384  -5.561
  597    HG2  LYS  77           1HG      LYS  77   0.886   9.671  -6.350
  598    HG3  LYS  77           2HG      LYS  77   2.313   9.737  -5.290
  599    HD2  LYS  77           1HD      LYS  77   3.266   7.789  -6.502
  600    HD3  LYS  77           2HD      LYS  77   1.865   7.815  -7.598
  601    HE2  LYS  77           1HE      LYS  77   2.453  10.104  -8.290
  602    HE3  LYS  77           2HE      LYS  77   3.864  10.065  -7.206
  603    HZ1  LYS  77           3HZ      LYS  77   3.425   8.281  -9.515
  604    HZ2  LYS  77           1HZ      LYS  77   4.471   9.557  -9.473
  605    HZ3  LYS  77           2HZ      LYS  77   4.733   8.244  -8.509
  606    H    VAL  78           H        VAL  78   1.022   6.936  -2.166
  607    HA   VAL  78           HA       VAL  78  -1.046   4.964  -2.190
  608    HB   VAL  78           HB       VAL  78   0.804   5.840   0.067
  609   HG11  VAL  78          1HG1      VAL  78   0.264   3.648   1.074
  610   HG12  VAL  78          2HG1      VAL  78  -1.192   4.659   0.924
  611   HG13  VAL  78          3HG1      VAL  78  -0.906   3.337  -0.229
  612   HG21  VAL  78          3HG2      VAL  78   1.999   5.041  -1.881
  613   HG22  VAL  78          1HG2      VAL  78   2.109   3.869  -0.548
  614   HG23  VAL  78          2HG2      VAL  78   1.005   3.564  -1.911
  615    H    GLU  79           H        GLU  79  -0.678   7.752   0.007
  616    HA   GLU  79           HA       GLU  79  -3.089   7.373   1.439
  617    HB2  GLU  79           1HB      GLU  79  -1.356   9.006   2.017
  618    HB3  GLU  79           2HB      GLU  79  -1.782   9.958   0.576
  619    HG2  GLU  79           1HG      GLU  79  -4.096  10.341   1.585
  620    HG3  GLU  79           2HG      GLU  79  -3.509   9.349   2.938
  621    H    ALA  80           H        ALA  80  -2.556   9.118  -1.618
  622    HA   ALA  80           HA       ALA  80  -5.204  10.036  -1.974
  623    HB1  ALA  80           3HB      ALA  80  -3.209   9.131  -4.079
  624    HB2  ALA  80           1HB      ALA  80  -4.657  10.121  -4.376
  625    HB3  ALA  80           2HB      ALA  80  -3.330  10.763  -3.381
  626    H    VAL  81           H        VAL  81  -3.747   6.906  -2.811
  627    HA   VAL  81           HA       VAL  81  -6.077   5.835  -4.161
  628    HB   VAL  81           HB       VAL  81  -3.782   4.458  -2.706
  629   HG11  VAL  81          1HG1      VAL  81  -4.507   2.429  -3.922
  630   HG12  VAL  81          2HG1      VAL  81  -5.784   3.012  -2.826
  631   HG13  VAL  81          3HG1      VAL  81  -5.902   3.320  -4.576
  632   HG21  VAL  81          3HG2      VAL  81  -3.052   5.760  -4.614
  633   HG22  VAL  81          1HG2      VAL  81  -2.929   4.019  -4.954
  634   HG23  VAL  81          2HG2      VAL  81  -4.268   4.968  -5.646
  635    H    PHE  82           H        PHE  82  -5.069   5.840  -0.772
  636    HA   PHE  82           HA       PHE  82  -7.554   4.357  -0.068
  637    HB2  PHE  82           1HB      PHE  82  -5.308   5.342   1.741
  638    HB3  PHE  82           2HB      PHE  82  -6.598   4.194   2.158
  639    HD1  PHE  82           HD1      PHE  82  -6.333   2.820  -0.682
  640    HD2  PHE  82           HD2      PHE  82  -3.634   3.773   2.488
  641    HE1  PHE  82           HE1      PHE  82  -4.880   0.938  -1.358
  642    HE2  PHE  82           HE2      PHE  82  -2.177   1.892   1.814
  643    HZ   PHE  82           HZ       PHE  82  -2.802   0.473  -0.106
  644    H    GLU  83           H        GLU  83  -7.291   7.271  -1.056
  645    HA   GLU  83           HA       GLU  83  -9.240   8.239   1.012
  646    HB2  GLU  83           1HB      GLU  83  -7.265   9.775  -0.673
  647    HB3  GLU  83           2HB      GLU  83  -8.656  10.531   0.139
  648    HG2  GLU  83           1HG      GLU  83  -6.464   9.002   1.660
  649    HG3  GLU  83           2HG      GLU  83  -6.494  10.740   1.282
  650    H    LEU  84           H        LEU  84  -9.552   6.555  -1.438
  651    HA   LEU  84           HA       LEU  84 -10.910   8.247  -3.384
  652    HB2  LEU  84           1HB      LEU  84 -10.830   5.366  -2.793
  653    HB3  LEU  84           2HB      LEU  84 -11.739   5.923  -4.218
  654    HG   LEU  84           HG       LEU  84  -8.752   6.285  -3.761
  655   HD11  LEU  84          1HD1      LEU  84  -8.507   4.627  -5.629
  656   HD12  LEU  84          2HD1      LEU  84  -9.366   3.918  -4.242
  657   HD13  LEU  84          3HD1      LEU  84 -10.276   4.445  -5.678
  658   HD21  LEU  84          3HD2      LEU  84  -9.718   8.097  -5.052
  659   HD22  LEU  84          1HD2      LEU  84  -8.718   7.068  -6.105
  660   HD23  LEU  84          2HD2      LEU  84 -10.493   6.937  -6.157
  661    H    GLU  85           H        GLU  85 -11.913   6.275  -0.628
  662    HA   GLU  85           HA       GLU  85 -13.998   5.980   0.359
  663    HB2  GLU  85           1HB      GLU  85 -14.486   8.714  -0.835
  664    HB3  GLU  85           2HB      GLU  85 -15.459   7.930   0.432
  665    HG2  GLU  85           1HG      GLU  85 -13.387   7.989   1.947
  666    HG3  GLU  85           2HG      GLU  85 -12.605   8.802   0.573
  667    H    HIS  86           H        HIS  86 -13.582   5.024  -2.364
  668    HA   HIS  86           HA       HIS  86 -16.469   4.954  -3.179
  669    HB2  HIS  86           1HB      HIS  86 -13.978   4.505  -4.886
  670    HB3  HIS  86           2HB      HIS  86 -15.659   4.328  -5.442
  671    HD1  HIS  86           HD1      HIS  86 -17.089   6.738  -4.813
  672    HD2  HIS  86           HD2      HIS  86 -12.969   6.993  -5.661
  673    HE1  HIS  86           HE1      HIS  86 -16.696   9.029  -5.567
  674    H    HIS  87           H        HIS  87 -14.468   3.313  -1.326
  675    HA   HIS  87           HA       HIS  87 -15.339   0.640  -2.337
  676    HB2  HIS  87           1HB      HIS  87 -12.487   1.319  -1.487
  677    HB3  HIS  87           2HB      HIS  87 -13.090  -0.269  -2.014
  678    HD1  HIS  87           HD1      HIS  87 -13.847  -0.431  -4.570
  679    HD2  HIS  87           HD2      HIS  87 -11.620   3.015  -3.604
  680    HE1  HIS  87           HE1      HIS  87 -12.980   0.426  -6.687
  681    H    HIS  88           H        HIS  88 -16.897   1.054  -0.597
  682    HA   HIS  88           HA       HIS  88 -16.201   1.218   2.138
  683    HB2  HIS  88           1HB      HIS  88 -18.533   1.413   1.384
  684    HB3  HIS  88           2HB      HIS  88 -18.519  -0.279   0.835
  685    HD1  HIS  88           HD1      HIS  88 -18.792  -2.110   2.579
  686    HD2  HIS  88           HD2      HIS  88 -18.696   1.733   4.304
  687    HE1  HIS  88           HE1      HIS  88 -19.604  -2.378   4.869
  688    H    HIS  89           H        HIS  89 -16.627  -1.705   0.136
  689    HA   HIS  89           HA       HIS  89 -14.596  -3.062   1.788
  690    HB2  HIS  89           1HB      HIS  89 -16.006  -4.977   2.346
  691    HB3  HIS  89           2HB      HIS  89 -16.775  -3.504   2.985
  692    HD2  HIS  89           HD2      HIS  89 -17.569  -6.406   0.405
  693    HE1  HIS  89           HE1      HIS  89 -20.777  -3.622   0.510
  694    HE2  HIS  89           HE2      HIS  89 -19.915  -5.957  -0.337
  695    H    HIS  90           H        HIS  90 -14.457  -5.460   0.976
  696    HA   HIS  90           HA       HIS  90 -15.017  -5.649  -1.931
  697    HB2  HIS  90           1HB      HIS  90 -12.735  -4.613  -1.754
  698    HB3  HIS  90           2HB      HIS  90 -12.206  -6.023  -0.805
  699    HD2  HIS  90           HD2      HIS  90 -11.240  -8.157  -2.386
  700    HE1  HIS  90           HE1      HIS  90 -12.756  -6.635  -6.051
  701    HE2  HIS  90           HE2      HIS  90 -11.308  -8.481  -4.866
  702    H    HIS  91           H        HIS  91 -15.336  -7.645  -2.681
  703    HA   HIS  91           HA       HIS  91 -15.506  -9.758  -0.589
  704    HB2  HIS  91           1HB      HIS  91 -16.678  -9.625  -3.404
  705    HB3  HIS  91           2HB      HIS  91 -16.941 -10.938  -2.233
  706    HD1  HIS  91           HD1      HIS  91 -18.221 -10.212   0.024
  707    HD2  HIS  91           HD2      HIS  91 -18.500  -7.464  -3.160
  708    HE1  HIS  91           HE1      HIS  91 -20.160  -8.810   0.512
  Start of MODEL   18
    1    H1   MET   1           1H       MET   1 -12.156   1.438   2.413
    2    H2   MET   1           2H       MET   1 -12.410   1.248   3.879
    3    H3   MET   1           3H       MET   1 -12.289   2.632   3.312
    4    HA   MET   1           HA       MET   1 -10.141   1.145   4.420
    5    HB2  MET   1           1HB      MET   1 -10.076   1.535   1.442
    6    HB3  MET   1           2HB      MET   1  -8.585   1.429   2.409
    7    HG2  MET   1           1HG      MET   1  -9.226  -0.797   3.184
    8    HG3  MET   1           2HG      MET   1 -10.748  -0.693   2.266
    9    HE1  MET   1           3HE      MET   1  -6.885  -1.224   2.155
   10    HE2  MET   1           1HE      MET   1  -6.516  -1.087   0.419
   11    HE3  MET   1           2HE      MET   1  -7.026   0.351   1.336
   12    H    LYS   2           H        LYS   2 -11.294   3.453   5.153
   13    HA   LYS   2           HA       LYS   2  -9.667   5.707   4.150
   14    HB2  LYS   2           1HB      LYS   2 -12.067   5.948   4.692
   15    HB3  LYS   2           2HB      LYS   2 -11.691   5.570   6.389
   16    HG2  LYS   2           1HG      LYS   2 -10.374   7.581   6.612
   17    HG3  LYS   2           2HG      LYS   2 -10.521   7.923   4.872
   18    HD2  LYS   2           1HD      LYS   2 -12.962   8.180   5.134
   19    HD3  LYS   2           2HD      LYS   2 -12.801   7.860   6.878
   20    HE2  LYS   2           1HE      LYS   2 -11.521   9.854   7.210
   21    HE3  LYS   2           2HE      LYS   2 -11.364  10.115   5.459
   22    HZ1  LYS   2           3HZ      LYS   2 -13.882  10.244   6.989
   23    HZ2  LYS   2           1HZ      LYS   2 -13.036  11.543   6.421
   24    HZ3  LYS   2           2HZ      LYS   2 -13.735  10.486   5.364
   25    H    ILE   3           H        ILE   3  -8.065   6.752   5.165
   26    HA   ILE   3           HA       ILE   3  -6.563   4.986   6.989
   27    HB   ILE   3           HB       ILE   3  -5.863   7.677   5.725
   28   HG12  ILE   3          1HG1      ILE   3  -4.931   4.910   5.008
   29   HG13  ILE   3          2HG1      ILE   3  -6.209   5.812   4.161
   30   HG21  ILE   3          1HG2      ILE   3  -3.549   7.146   6.414
   31   HG22  ILE   3          2HG2      ILE   3  -4.624   7.269   7.825
   32   HG23  ILE   3          3HG2      ILE   3  -4.128   5.671   7.223
   33   HD11  ILE   3          3HD1      ILE   3  -3.307   6.669   4.424
   34   HD12  ILE   3          1HD1      ILE   3  -4.062   5.982   2.967
   35   HD13  ILE   3          2HD1      ILE   3  -4.585   7.571   3.577
   36    H    ILE   4           H        ILE   4  -6.251   5.118   9.045
   37    HA   ILE   4           HA       ILE   4  -7.234   7.549  10.487
   38    HB   ILE   4           HB       ILE   4  -6.285   4.825  11.489
   39   HG12  ILE   4          1HG1      ILE   4  -9.024   6.057  11.598
   40   HG13  ILE   4          2HG1      ILE   4  -8.480   4.921  10.342
   41   HG21  ILE   4          1HG2      ILE   4  -7.014   5.621  13.711
   42   HG22  ILE   4          2HG2      ILE   4  -5.706   6.638  13.065
   43   HG23  ILE   4          3HG2      ILE   4  -7.388   7.217  13.017
   44   HD11  ILE   4          3HD1      ILE   4  -8.622   4.343  13.322
   45   HD12  ILE   4          1HD1      ILE   4  -9.769   3.761  12.093
   46   HD13  ILE   4          2HD1      ILE   4  -8.077   3.206  12.066
   47    H    SER   5           H        SER   5  -4.293   5.590  10.117
   48    HA   SER   5           HA       SER   5  -2.613   8.017  10.500
   49    HB2  SER   5           1HB      SER   5  -3.132   7.626  12.724
   50    HB3  SER   5           2HB      SER   5  -2.638   5.924  12.588
   51    HG   SER   5           HG       SER   5  -0.983   7.263  13.434
   52    H    ILE   6           H        ILE   6  -0.727   7.766   9.454
   53    HA   ILE   6           HA       ILE   6   0.012   5.021   8.491
   54    HB   ILE   6           HB       ILE   6   0.912   7.777   7.534
   55   HG12  ILE   6          1HG1      ILE   6  -0.862   5.755   6.191
   56   HG13  ILE   6          2HG1      ILE   6  -1.415   7.229   7.019
   57   HG21  ILE   6          1HG2      ILE   6   1.998   6.524   5.700
   58   HG22  ILE   6          2HG2      ILE   6   2.659   6.046   7.282
   59   HG23  ILE   6          3HG2      ILE   6   1.494   4.991   6.450
   60   HD11  ILE   6          3HD1      ILE   6   0.399   7.132   4.584
   61   HD12  ILE   6          1HD1      ILE   6  -1.326   7.559   4.579
   62   HD13  ILE   6          2HD1      ILE   6  -0.154   8.606   5.413
   63    H    SER   7           H        SER   7   1.412   3.944   9.548
   64    HA   SER   7           HA       SER   7   3.329   5.373  11.378
   65    HB2  SER   7           1HB      SER   7   1.988   3.840  12.437
   66    HB3  SER   7           2HB      SER   7   2.408   2.565  11.269
   67    HG   SER   7           HG       SER   7   4.581   2.780  11.980
   68    H    GLU   8           H        GLU   8   5.517   5.146  11.194
   69    HA   GLU   8           HA       GLU   8   6.650   3.892   8.782
   70    HB2  GLU   8           1HB      GLU   8   7.904   5.158  11.220
   71    HB3  GLU   8           2HB      GLU   8   8.807   4.526   9.822
   72    HG2  GLU   8           1HG      GLU   8   7.727   6.267   8.353
   73    HG3  GLU   8           2HG      GLU   8   6.759   6.704   9.779
   74    H    THR   9           H        THR   9   8.560   2.439   9.030
   75    HA   THR   9           HA       THR   9   8.179   0.489  11.262
   76    HB   THR   9           HB       THR   9   8.321  -1.395   9.726
   77    HG1  THR   9           HG1      THR   9   7.921  -0.080   7.381
   78   HG21  THR   9          3HG2      THR   9   6.221   0.601   8.795
   79   HG22  THR   9          1HG2      THR   9   6.168  -1.158   8.538
   80   HG23  THR   9          2HG2      THR   9   6.067  -0.495  10.188
   81    HA   PRO  10           HA       PRO  10  12.506   0.308  11.710
   82    HB2  PRO  10           2HB      PRO  10  13.017  -1.794  12.712
   83    HB3  PRO  10           1HB      PRO  10  12.250  -2.712  11.410
   84    HG2  PRO  10           1HG      PRO  10  10.633  -2.924  13.126
   85    HG3  PRO  10           2HG      PRO  10  10.957  -1.309  13.772
   86    HD2  PRO  10           1HD      PRO  10   9.330  -2.089  11.323
   87    HD3  PRO  10           2HD      PRO  10   9.015  -0.812  12.504
   88    H    ASN  11           H        ASN  11  11.115  -1.747   9.169
   89    HA   ASN  11           HA       ASN  11  13.494  -1.040   7.487
   90    HB2  ASN  11           1HB      ASN  11  12.737  -3.629   7.615
   91    HB3  ASN  11           2HB      ASN  11  11.310  -2.794   6.956
   92   HD21  ASN  11          2HD2      ASN  11  13.006  -4.925   5.846
   93   HD22  ASN  11          1HD2      ASN  11  13.558  -4.332   4.314
   94    H    HIS  12           H        HIS  12  13.314   0.657   6.261
   95    HA   HIS  12           HA       HIS  12  10.604   1.787   5.867
   96    HB2  HIS  12           1HB      HIS  12  13.424   2.886   5.616
   97    HB3  HIS  12           2HB      HIS  12  12.019   3.765   4.966
   98    HD2  HIS  12           HD2      HIS  12  10.337   5.014   6.974
   99    HE1  HIS  12           HE1      HIS  12  12.916   3.915  10.166
  100    HE2  HIS  12           HE2      HIS  12  10.844   5.339   9.402
  101    H    ASN  13           H        ASN  13  12.013  -0.510   4.261
  102    HA   ASN  13           HA       ASN  13  11.394   0.498   1.555
  103    HB2  ASN  13           1HB      ASN  13  12.034  -2.421   2.420
  104    HB3  ASN  13           2HB      ASN  13  11.456  -1.638   0.929
  105   HD21  ASN  13          2HD2      ASN  13  13.924  -3.114   1.497
  106   HD22  ASN  13          1HD2      ASN  13  15.220  -2.040   1.088
  107    H    THR  14           H        THR  14   9.613  -0.435   4.244
  108    HA   THR  14           HA       THR  14   7.190  -0.427   2.518
  109    HB   THR  14           HB       THR  14   7.614  -2.824   2.969
  110    HG1  THR  14           HG1      THR  14   5.561  -3.111   4.230
  111   HG21  THR  14          3HG2      THR  14   7.440  -1.990   5.892
  112   HG22  THR  14          1HG2      THR  14   7.521  -3.662   5.290
  113   HG23  THR  14          2HG2      THR  14   8.905  -2.565   5.060
  114    H    MET  15           H        MET  15   5.399   0.464   3.392
  115    HA   MET  15           HA       MET  15   5.770   1.700   6.105
  116    HB2  MET  15           1HB      MET  15   4.256   2.656   3.676
  117    HB3  MET  15           2HB      MET  15   4.134   3.389   5.294
  118    HG2  MET  15           1HG      MET  15   6.722   3.151   3.739
  119    HG3  MET  15           2HG      MET  15   5.663   4.580   3.674
  120    HE1  MET  15           3HE      MET  15   4.602   4.985   6.554
  121    HE2  MET  15           1HE      MET  15   5.862   6.015   7.276
  122    HE3  MET  15           2HE      MET  15   5.342   6.291   5.596
  123    H    LYS  16           H        LYS  16   3.995   1.890   7.471
  124    HA   LYS  16           HA       LYS  16   1.892  -0.182   6.940
  125    HB2  LYS  16           1HB      LYS  16   3.311  -0.682   8.841
  126    HB3  LYS  16           2HB      LYS  16   2.989   0.925   9.530
  127    HG2  LYS  16           1HG      LYS  16   0.581   0.313   9.719
  128    HG3  LYS  16           2HG      LYS  16   0.983  -1.320   9.142
  129    HD2  LYS  16           1HD      LYS  16   2.423  -1.692  11.063
  130    HD3  LYS  16           2HD      LYS  16   2.171  -0.021  11.615
  131    HE2  LYS  16           1HE      LYS  16  -0.218  -0.472  11.925
  132    HE3  LYS  16           2HE      LYS  16   0.017  -2.140  11.350
  133    HZ1  LYS  16           3HZ      LYS  16   1.242  -0.970  13.767
  134    HZ2  LYS  16           1HZ      LYS  16  -0.027  -2.024  13.749
  135    HZ3  LYS  16           2HZ      LYS  16   1.461  -2.516  13.234
  136    H    ILE  17           H        ILE  17  -0.087   0.417   6.615
  137    HA   ILE  17           HA       ILE  17  -0.909   3.170   7.514
  138    HB   ILE  17           HB       ILE  17  -1.784   1.641   5.020
  139   HG12  ILE  17          1HG1      ILE  17  -0.136   4.143   5.268
  140   HG13  ILE  17          2HG1      ILE  17   0.486   2.520   4.890
  141   HG21  ILE  17          1HG2      ILE  17  -3.016   3.713   4.479
  142   HG22  ILE  17          2HG2      ILE  17  -3.585   3.013   6.013
  143   HG23  ILE  17          3HG2      ILE  17  -2.501   4.423   6.028
  144   HD11  ILE  17          3HD1      ILE  17  -1.483   4.108   3.205
  145   HD12  ILE  17          1HD1      ILE  17   0.244   3.878   2.849
  146   HD13  ILE  17          2HD1      ILE  17  -0.862   2.484   2.827
  147    H    THR  18           H        THR  18  -2.188   3.111   9.130
  148    HA   THR  18           HA       THR  18  -3.904   0.763   9.602
  149    HB   THR  18           HB       THR  18  -3.643   3.390  11.125
  150    HG1  THR  18           HG1      THR  18  -2.461   2.023  12.588
  151   HG21  THR  18          3HG2      THR  18  -5.009   0.773  11.865
  152   HG22  THR  18          1HG2      THR  18  -4.827   2.188  12.928
  153   HG23  THR  18          2HG2      THR  18  -5.833   2.297  11.464
  154    H    LEU  19           H        LEU  19  -5.907   0.492   9.040
  155    HA   LEU  19           HA       LEU  19  -7.360   2.867   7.927
  156    HB2  LEU  19           1HB      LEU  19  -7.598  -0.014   7.359
  157    HB3  LEU  19           2HB      LEU  19  -8.562   1.190   6.472
  158    HG   LEU  19           HG       LEU  19  -5.546   0.802   6.351
  159   HD11  LEU  19          1HD1      LEU  19  -5.999   0.251   3.946
  160   HD12  LEU  19          2HD1      LEU  19  -6.861  -0.858   5.037
  161   HD13  LEU  19          3HD1      LEU  19  -7.739   0.467   4.240
  162   HD21  LEU  19          3HD2      LEU  19  -6.097   3.161   6.260
  163   HD22  LEU  19          1HD2      LEU  19  -5.558   2.601   4.659
  164   HD23  LEU  19          2HD2      LEU  19  -7.290   2.863   4.974
  165    H    SER  20           H        SER  20  -9.582   3.047   8.217
  166    HA   SER  20           HA       SER  20 -10.542   2.142  10.871
  167    HB2  SER  20           1HB      SER  20 -12.390   3.469  10.488
  168    HB3  SER  20           2HB      SER  20 -10.883   4.358  10.160
  169    HG   SER  20           HG       SER  20 -12.521   4.712   8.582
  170    H    GLU  21           H        GLU  21 -11.725   1.896   7.482
  171    HA   GLU  21           HA       GLU  21 -12.956  -0.743   8.213
  172    HB2  GLU  21           1HB      GLU  21 -13.952   1.373   6.299
  173    HB3  GLU  21           2HB      GLU  21 -14.634  -0.263   6.465
  174    HG2  GLU  21           1HG      GLU  21 -15.205   0.322   8.905
  175    HG3  GLU  21           2HG      GLU  21 -14.537   1.921   8.503
  176    H    SER  22           H        SER  22 -11.376  -2.072   7.547
  177    HA   SER  22           HA       SER  22 -10.006  -1.622   4.929
  178    HB2  SER  22           1HB      SER  22  -8.785  -2.120   6.944
  179    HB3  SER  22           2HB      SER  22  -9.526  -3.737   6.932
  180    HG   SER  22           HG       SER  22  -7.792  -4.081   5.750
  181    H    ARG  23           H        ARG  23  -9.437  -4.143   4.177
  182    HA   ARG  23           HA       ARG  23 -11.570  -5.077   2.629
  183    HB2  ARG  23           1HB      ARG  23  -9.319  -5.772   2.288
  184    HB3  ARG  23           2HB      ARG  23  -9.355  -6.698   3.806
  185    HG2  ARG  23           1HG      ARG  23 -11.166  -8.110   2.862
  186    HG3  ARG  23           2HG      ARG  23 -11.023  -7.219   1.326
  187    HD2  ARG  23           1HD      ARG  23  -8.770  -8.012   1.058
  188    HD3  ARG  23           2HD      ARG  23  -8.867  -8.859   2.619
  189    HE   ARG  23           HE       ARG  23 -10.904  -9.986   0.911
  190   HH11  ARG  23          1HH1      ARG  23  -7.423  -9.778   0.982
  191   HH12  ARG  23          2HH1      ARG  23  -7.308 -11.315   0.149
  192   HH21  ARG  23          2HH2      ARG  23  -9.226 -12.436  -0.444
  193   HH22  ARG  23          1HH2      ARG  23 -10.788 -11.742  -0.052
  194    H    GLU  24           H        GLU  24 -13.257  -6.390   2.809
  195    HA   GLU  24           HA       GLU  24 -14.691  -6.644   5.177
  196    HB2  GLU  24           1HB      GLU  24 -15.537  -7.156   2.922
  197    HB3  GLU  24           2HB      GLU  24 -14.578  -8.656   2.923
  198    HG2  GLU  24           1HG      GLU  24 -15.968  -9.459   4.918
  199    HG3  GLU  24           2HG      GLU  24 -16.821  -7.908   4.751
  200    H    GLY  25           H        GLY  25 -12.802  -9.356   3.787
  201    HA2  GLY  25           1HA      GLY  25 -12.622 -10.712   6.339
  202    HA3  GLY  25           2HA      GLY  25 -11.692 -11.083   4.868
  203    H    MET  26           H        MET  26 -11.397 -10.179   8.004
  204    HA   MET  26           HA       MET  26  -9.126  -8.299   7.609
  205    HB2  MET  26           1HB      MET  26 -10.433  -9.409  10.093
  206    HB3  MET  26           2HB      MET  26  -9.109  -8.219  10.060
  207    HG2  MET  26           1HG      MET  26 -11.914  -7.830   8.971
  208    HG3  MET  26           2HG      MET  26 -11.262  -7.129  10.471
  209    HE1  MET  26           3HE      MET  26 -12.260  -4.788   9.379
  210    HE2  MET  26           1HE      MET  26 -11.677  -4.130   7.831
  211    HE3  MET  26           2HE      MET  26 -12.658  -5.616   7.854
  212    H    THR  27           H        THR  27  -8.369 -10.464   6.387
  213    HA   THR  27           HA       THR  27  -6.514 -11.791   8.337
  214    HB   THR  27           HB       THR  27  -6.643 -13.845   7.053
  215    HG1  THR  27           HG1      THR  27  -7.017 -12.983   4.984
  216   HG21  THR  27          3HG2      THR  27  -9.438 -12.771   7.600
  217   HG22  THR  27          1HG2      THR  27  -8.998 -14.485   7.435
  218   HG23  THR  27          2HG2      THR  27  -8.364 -13.530   8.798
  219    H    SER  28           H        SER  28  -4.705 -12.949   7.065
  220    HA   SER  28           HA       SER  28  -3.147 -10.821   5.766
  221    HB2  SER  28           1HB      SER  28  -1.402 -12.291   5.732
  222    HB3  SER  28           2HB      SER  28  -2.209 -12.360   7.315
  223    HG   SER  28           HG       SER  28  -1.677 -14.432   6.498
  224    H    ASP  29           H        ASP  29  -2.596 -10.619   3.650
  225    HA   ASP  29           HA       ASP  29  -2.783 -12.812   1.768
  226    HB2  ASP  29           1HB      ASP  29  -5.274 -11.744   2.019
  227    HB3  ASP  29           2HB      ASP  29  -4.415 -10.499   1.078
  228    H    THR  30           H        THR  30  -1.948 -12.330  -0.297
  229    HA   THR  30           HA       THR  30  -0.295  -9.825  -0.291
  230    HB   THR  30           HB       THR  30   0.560 -12.602  -1.212
  231    HG1  THR  30           HG1      THR  30   2.035 -12.372   0.573
  232   HG21  THR  30          3HG2      THR  30   2.070  -9.961  -1.088
  233   HG22  THR  30          1HG2      THR  30   2.760 -11.534  -1.551
  234   HG23  THR  30          2HG2      THR  30   1.517 -10.773  -2.571
  235    H    TYR  31           H        TYR  31  -0.403  -8.595  -1.992
  236    HA   TYR  31           HA       TYR  31  -1.325  -9.818  -4.570
  237    HB2  TYR  31           1HB      TYR  31  -2.105  -7.131  -3.418
  238    HB3  TYR  31           2HB      TYR  31  -2.507  -7.726  -5.048
  239    HD1  TYR  31           HD1      TYR  31  -3.375  -7.829  -1.510
  240    HD2  TYR  31           HD2      TYR  31  -4.084  -9.641  -5.304
  241    HE1  TYR  31           HE1      TYR  31  -5.423  -8.891  -0.610
  242    HE2  TYR  31           HE2      TYR  31  -6.132 -10.709  -4.422
  243    HH   TYR  31           HH       TYR  31  -7.764 -10.448  -2.594
  244    H    THR  32           H        THR  32   0.100  -9.663  -6.091
  245    HA   THR  32           HA       THR  32   2.041  -7.376  -5.987
  246    HB   THR  32           HB       THR  32   3.753  -8.878  -6.902
  247    HG1  THR  32           HG1      THR  32   3.257 -11.149  -7.005
  248   HG21  THR  32          3HG2      THR  32   2.420 -10.044  -4.427
  249   HG22  THR  32          1HG2      THR  32   4.105 -10.315  -4.925
  250   HG23  THR  32          2HG2      THR  32   3.569  -8.686  -4.445
  251    H    LYS  33           H        LYS  33  -0.040  -9.418  -7.903
  252    HA   LYS  33           HA       LYS  33   0.877  -7.980 -10.373
  253    HB2  LYS  33           1HB      LYS  33   1.232 -10.412 -10.367
  254    HB3  LYS  33           2HB      LYS  33  -0.507 -10.650 -10.077
  255    HG2  LYS  33           1HG      LYS  33  -1.006  -9.567 -12.241
  256    HG3  LYS  33           2HG      LYS  33   0.739  -9.370 -12.533
  257    HD2  LYS  33           1HD      LYS  33   1.045 -11.794 -12.503
  258    HD3  LYS  33           2HD      LYS  33  -0.680 -12.025 -12.130
  259    HE2  LYS  33           1HE      LYS  33  -1.287 -10.985 -14.268
  260    HE3  LYS  33           2HE      LYS  33   0.434 -10.734 -14.641
  261    HZ1  LYS  33           3HZ      LYS  33  -0.876 -13.351 -14.272
  262    HZ2  LYS  33           1HZ      LYS  33  -0.433 -12.696 -15.719
  263    HZ3  LYS  33           2HZ      LYS  33   0.719 -13.119 -14.617
  264    H    VAL  34           H        VAL  34  -0.433  -6.705 -11.420
  265    HA   VAL  34           HA       VAL  34  -2.955  -5.882 -10.336
  266    HB   VAL  34           HB       VAL  34  -1.865  -5.630 -13.171
  267   HG11  VAL  34          1HG1      VAL  34  -3.528  -3.817 -13.411
  268   HG12  VAL  34          2HG1      VAL  34  -4.322  -5.378 -13.093
  269   HG13  VAL  34          3HG1      VAL  34  -4.158  -4.181 -11.788
  270   HG21  VAL  34          3HG2      VAL  34  -0.436  -4.572 -11.524
  271   HG22  VAL  34          1HG2      VAL  34  -1.283  -3.353 -12.505
  272   HG23  VAL  34          2HG2      VAL  34  -1.831  -3.699 -10.847
  273    H    ASP  35           H        ASP  35  -4.852  -6.689 -10.272
  274    HA   ASP  35           HA       ASP  35  -5.896  -8.276 -12.517
  275    HB2  ASP  35           1HB      ASP  35  -4.562  -9.848 -10.717
  276    HB3  ASP  35           2HB      ASP  35  -6.084  -9.471  -9.873
  277    H    ASP  36           H        ASP  36  -8.147  -9.080 -11.998
  278    HA   ASP  36           HA       ASP  36  -9.652  -6.731 -11.124
  279    HB2  ASP  36           1HB      ASP  36 -10.587  -9.500 -12.089
  280    HB3  ASP  36           2HB      ASP  36 -11.553  -8.113 -11.527
  281    H    SER  37           H        SER  37  -8.308  -9.357  -9.508
  282    HA   SER  37           HA       SER  37 -10.355  -9.864  -7.481
  283    HB2  SER  37           1HB      SER  37  -8.802 -11.088  -6.374
  284    HB3  SER  37           2HB      SER  37  -8.650 -11.422  -8.114
  285    HG   SER  37           HG       SER  37  -6.990  -9.490  -7.665
  286    H    GLN  38           H        GLN  38  -7.849  -7.443  -7.981
  287    HA   GLN  38           HA       GLN  38  -8.307  -6.364  -5.238
  288    HB2  GLN  38           1HB      GLN  38  -6.444  -5.414  -7.421
  289    HB3  GLN  38           2HB      GLN  38  -6.496  -4.846  -5.735
  290    HG2  GLN  38           1HG      GLN  38  -4.782  -6.595  -5.301
  291    HG3  GLN  38           2HG      GLN  38  -6.339  -7.426  -5.516
  292   HE21  GLN  38          2HE2      GLN  38  -3.145  -7.062  -6.630
  293   HE22  GLN  38          1HE2      GLN  38  -3.281  -7.989  -8.087
  294    HA   PRO  39           HA       PRO  39 -10.947  -2.976  -6.519
  295    HB2  PRO  39           2HB      PRO  39 -10.804  -1.460  -4.698
  296    HB3  PRO  39           1HB      PRO  39  -9.040  -1.367  -4.795
  297    HG2  PRO  39           1HG      PRO  39  -9.312  -2.693  -2.855
  298    HG3  PRO  39           2HG      PRO  39 -10.771  -3.481  -3.471
  299    HD2  PRO  39           1HD      PRO  39  -7.862  -4.020  -4.209
  300    HD3  PRO  39           2HD      PRO  39  -9.165  -5.180  -3.927
  301    H    ALA  40           H        ALA  40 -10.901  -1.469  -8.024
  302    HA   ALA  40           HA       ALA  40  -8.782  -1.296  -9.856
  303    HB1  ALA  40           3HB      ALA  40 -10.867   0.812  -9.199
  304    HB2  ALA  40           1HB      ALA  40  -9.873   0.757 -10.672
  305    HB3  ALA  40           2HB      ALA  40 -11.060  -0.528 -10.350
  306    H    PHE  41           H        PHE  41  -9.431   0.724  -7.007
  307    HA   PHE  41           HA       PHE  41  -7.271   2.586  -7.639
  308    HB2  PHE  41           1HB      PHE  41  -7.807   3.591  -5.475
  309    HB3  PHE  41           2HB      PHE  41  -9.321   3.234  -6.336
  310    HD1  PHE  41           HD1      PHE  41  -7.066   2.090  -3.638
  311    HD2  PHE  41           HD2      PHE  41 -10.933   1.815  -5.433
  312    HE1  PHE  41           HE1      PHE  41  -7.888   0.833  -1.673
  313    HE2  PHE  41           HE2      PHE  41 -11.759   0.562  -3.469
  314    HZ   PHE  41           HZ       PHE  41 -10.235   0.070  -1.588
  315    H    ILE  42           H        ILE  42  -7.519  -0.434  -5.931
  316    HA   ILE  42           HA       ILE  42  -4.799  -0.244  -4.825
  317    HB   ILE  42           HB       ILE  42  -6.654  -2.608  -5.353
  318   HG12  ILE  42          1HG1      ILE  42  -7.466  -1.154  -3.647
  319   HG13  ILE  42          2HG1      ILE  42  -6.893  -2.690  -2.957
  320   HG21  ILE  42          1HG2      ILE  42  -5.052  -3.920  -4.005
  321   HG22  ILE  42          2HG2      ILE  42  -4.282  -3.290  -5.479
  322   HG23  ILE  42          3HG2      ILE  42  -3.974  -2.507  -3.910
  323   HD11  ILE  42          3HD1      ILE  42  -5.388  -0.052  -2.917
  324   HD12  ILE  42          1HD1      ILE  42  -6.244  -0.780  -1.541
  325   HD13  ILE  42          2HD1      ILE  42  -4.814  -1.587  -2.227
  326    H    ASN  43           H        ASN  43  -6.260  -1.399  -7.813
  327    HA   ASN  43           HA       ASN  43  -3.844  -2.503  -8.920
  328    HB2  ASN  43           1HB      ASN  43  -6.277  -1.371 -10.498
  329    HB3  ASN  43           2HB      ASN  43  -4.705  -2.094 -10.922
  330   HD21  ASN  43          2HD2      ASN  43  -7.594  -2.924 -11.229
  331   HD22  ASN  43          1HD2      ASN  43  -7.639  -4.545 -10.617
  332    H    ASP  44           H        ASP  44  -5.196   0.780  -8.942
  333    HA   ASP  44           HA       ASP  44  -3.250   2.058 -10.536
  334    HB2  ASP  44           1HB      ASP  44  -4.673   3.095  -8.011
  335    HB3  ASP  44           2HB      ASP  44  -3.545   3.945  -9.096
  336    H    ILE  45           H        ILE  45  -3.094   1.299  -7.054
  337    HA   ILE  45           HA       ILE  45  -0.540   2.490  -6.575
  338    HB   ILE  45           HB       ILE  45  -1.894   0.086  -5.273
  339   HG12  ILE  45          1HG1      ILE  45  -1.599   2.911  -4.292
  340   HG13  ILE  45          2HG1      ILE  45  -3.030   2.277  -5.138
  341   HG21  ILE  45          1HG2      ILE  45  -0.280   0.410  -3.431
  342   HG22  ILE  45          2HG2      ILE  45   0.555   0.003  -4.948
  343   HG23  ILE  45          3HG2      ILE  45   0.534   1.685  -4.367
  344   HD11  ILE  45          3HD1      ILE  45  -1.932   1.260  -2.493
  345   HD12  ILE  45          1HD1      ILE  45  -3.371   2.286  -2.698
  346   HD13  ILE  45          2HD1      ILE  45  -3.363   0.626  -3.339
  347    H    LEU  46           H        LEU  46  -1.319  -0.845  -7.535
  348    HA   LEU  46           HA       LEU  46   1.370  -1.760  -7.679
  349    HB2  LEU  46           1HB      LEU  46  -1.081  -2.355  -9.190
  350    HB3  LEU  46           2HB      LEU  46   0.350  -3.377  -9.461
  351    HG   LEU  46           HG       LEU  46  -1.136  -3.040  -6.825
  352   HD11  LEU  46          1HD1      LEU  46  -1.799  -5.434  -7.179
  353   HD12  LEU  46          2HD1      LEU  46  -2.403  -4.395  -8.491
  354   HD13  LEU  46          3HD1      LEU  46  -0.967  -5.415  -8.751
  355   HD21  LEU  46          3HD2      LEU  46   1.238  -3.399  -6.491
  356   HD22  LEU  46          1HD2      LEU  46   0.331  -4.854  -6.013
  357   HD23  LEU  46          2HD2      LEU  46   1.204  -4.818  -7.565
  358    H    LYS  47           H        LYS  47  -0.555   0.107  -9.969
  359    HA   LYS  47           HA       LYS  47   1.397  -0.225 -12.127
  360    HB2  LYS  47           1HB      LYS  47  -1.007   1.563 -11.758
  361    HB3  LYS  47           2HB      LYS  47   0.008   1.544 -13.220
  362    HG2  LYS  47           1HG      LYS  47  -0.566  -0.815 -13.594
  363    HG3  LYS  47           2HG      LYS  47  -1.571  -0.808 -12.126
  364    HD2  LYS  47           1HD      LYS  47  -3.014   0.919 -13.118
  365    HD3  LYS  47           2HD      LYS  47  -2.008   0.917 -14.587
  366    HE2  LYS  47           1HE      LYS  47  -2.564  -1.452 -14.957
  367    HE3  LYS  47           2HE      LYS  47  -3.581  -1.439 -13.498
  368    HZ1  LYS  47           3HZ      LYS  47  -4.024   0.198 -15.912
  369    HZ2  LYS  47           1HZ      LYS  47  -4.884  -1.145 -15.493
  370    HZ3  LYS  47           2HZ      LYS  47  -4.967   0.212 -14.558
  371    H    VAL  48           H        VAL  48   0.997   1.908  -9.447
  372    HA   VAL  48           HA       VAL  48   2.529   4.160 -10.392
  373    HB   VAL  48           HB       VAL  48   2.233   2.960  -7.608
  374   HG11  VAL  48          1HG1      VAL  48   3.121   5.122  -6.801
  375   HG12  VAL  48          2HG1      VAL  48   4.320   4.270  -7.802
  376   HG13  VAL  48          3HG1      VAL  48   3.401   5.635  -8.483
  377   HG21  VAL  48          3HG2      VAL  48   0.147   3.768  -8.537
  378   HG22  VAL  48          1HG2      VAL  48   0.710   4.831  -7.227
  379   HG23  VAL  48          2HG2      VAL  48   0.904   5.333  -8.924
  380    H    GLU  49           H        GLU  49   4.455   4.331 -11.097
  381    HA   GLU  49           HA       GLU  49   6.379   2.216 -11.026
  382    HB2  GLU  49           1HB      GLU  49   6.341   4.081 -12.650
  383    HB3  GLU  49           2HB      GLU  49   6.834   5.187 -11.346
  384    HG2  GLU  49           1HG      GLU  49   9.006   3.871 -11.122
  385    HG3  GLU  49           2HG      GLU  49   8.348   2.840 -12.412
  386    H    GLY  50           H        GLY  50   7.192   1.355  -9.284
  387    HA2  GLY  50           1HA      GLY  50   9.215   1.914  -7.831
  388    HA3  GLY  50           2HA      GLY  50   8.196   3.209  -7.161
  389    H    VAL  51           H        VAL  51   5.823   1.300  -7.531
  390    HA   VAL  51           HA       VAL  51   5.964   0.114  -4.832
  391    HB   VAL  51           HB       VAL  51   3.820   0.006  -6.993
  392   HG11  VAL  51          1HG1      VAL  51   2.362  -0.839  -5.186
  393   HG12  VAL  51          2HG1      VAL  51   3.726  -1.945  -5.479
  394   HG13  VAL  51          3HG1      VAL  51   3.750  -0.854  -4.073
  395   HG21  VAL  51          3HG2      VAL  51   4.162   2.248  -6.141
  396   HG22  VAL  51          1HG2      VAL  51   2.614   1.583  -5.570
  397   HG23  VAL  51          2HG2      VAL  51   4.012   1.656  -4.469
  398    H    LYS  52           H        LYS  52   6.440  -1.811  -4.228
  399    HA   LYS  52           HA       LYS  52   7.204  -3.751  -6.356
  400    HB2  LYS  52           1HB      LYS  52   8.840  -3.182  -4.620
  401    HB3  LYS  52           2HB      LYS  52   7.701  -3.745  -3.374
  402    HG2  LYS  52           1HG      LYS  52   7.817  -6.022  -4.269
  403    HG3  LYS  52           2HG      LYS  52   8.913  -5.472  -5.559
  404    HD2  LYS  52           1HD      LYS  52  10.561  -4.787  -3.843
  405    HD3  LYS  52           2HD      LYS  52   9.470  -5.396  -2.574
  406    HE2  LYS  52           1HE      LYS  52   9.624  -7.651  -3.479
  407    HE3  LYS  52           2HE      LYS  52  10.635  -7.067  -4.822
  408    HZ1  LYS  52           3HZ      LYS  52  11.366  -6.992  -1.964
  409    HZ2  LYS  52           1HZ      LYS  52  11.955  -8.058  -3.077
  410    HZ3  LYS  52           2HZ      LYS  52  12.305  -6.451  -3.208
  411    H    SER  53           H        SER  53   5.414  -3.746  -3.258
  412    HA   SER  53           HA       SER  53   3.562  -5.857  -4.335
  413    HB2  SER  53           1HB      SER  53   3.924  -7.375  -2.668
  414    HB3  SER  53           2HB      SER  53   5.446  -7.066  -3.535
  415    HG   SER  53           HG       SER  53   5.718  -7.143  -1.262
  416    H    ILE  54           H        ILE  54   1.648  -6.013  -3.164
  417    HA   ILE  54           HA       ILE  54   1.298  -4.080  -0.883
  418    HB   ILE  54           HB       ILE  54  -0.787  -4.987  -2.922
  419   HG12  ILE  54          1HG1      ILE  54   0.416  -2.259  -2.548
  420   HG13  ILE  54          2HG1      ILE  54   0.916  -3.427  -3.793
  421   HG21  ILE  54          1HG2      ILE  54  -2.238  -3.336  -1.791
  422   HG22  ILE  54          2HG2      ILE  54  -1.704  -4.600  -0.660
  423   HG23  ILE  54          3HG2      ILE  54  -0.940  -2.994  -0.624
  424   HD11  ILE  54          3HD1      ILE  54  -1.856  -2.217  -3.500
  425   HD12  ILE  54          1HD1      ILE  54  -0.643  -1.757  -4.715
  426   HD13  ILE  54          2HD1      ILE  54  -1.357  -3.387  -4.744
  427    H    PHE  55           H        PHE  55   1.079  -4.945   0.968
  428    HA   PHE  55           HA       PHE  55  -0.112  -7.699   1.100
  429    HB2  PHE  55           1HB      PHE  55   2.279  -7.697   1.724
  430    HB3  PHE  55           2HB      PHE  55   1.974  -6.416   2.918
  431    HD1  PHE  55           HD1      PHE  55   0.884  -9.868   2.024
  432    HD2  PHE  55           HD2      PHE  55   1.570  -6.975   5.091
  433    HE1  PHE  55           HE1      PHE  55   0.419 -11.583   3.743
  434    HE2  PHE  55           HE2      PHE  55   1.108  -8.687   6.813
  435    HZ   PHE  55           HZ       PHE  55   0.531 -10.992   6.138
  436    H    HIS  56           H        HIS  56  -1.888  -7.991   2.193
  437    HA   HIS  56           HA       HIS  56  -2.684  -5.884   4.172
  438    HB2  HIS  56           1HB      HIS  56  -4.322  -6.184   2.337
  439    HB3  HIS  56           2HB      HIS  56  -4.417  -7.922   2.703
  440    HD1  HIS  56           HD1      HIS  56  -5.624  -8.615   4.905
  441    HD2  HIS  56           HD2      HIS  56  -5.877  -4.489   4.085
  442    HE1  HIS  56           HE1      HIS  56  -7.441  -7.762   6.296
  443    H    VAL  57           H        VAL  57  -2.998  -6.341   6.237
  444    HA   VAL  57           HA       VAL  57  -3.659  -9.102   7.069
  445    HB   VAL  57           HB       VAL  57  -1.158  -9.110   7.125
  446   HG11  VAL  57          1HG1      VAL  57  -0.012  -7.663   8.770
  447   HG12  VAL  57          2HG1      VAL  57  -0.815  -6.693   7.513
  448   HG13  VAL  57          3HG1      VAL  57  -1.552  -6.846   9.125
  449   HG21  VAL  57          3HG2      VAL  57  -2.424 -10.468   8.683
  450   HG22  VAL  57          1HG2      VAL  57  -0.942  -9.845   9.446
  451   HG23  VAL  57          2HG2      VAL  57  -2.517  -9.105   9.825
  452    H    MET  58           H        MET  58  -4.830  -9.251   8.838
  453    HA   MET  58           HA       MET  58  -6.318  -8.498  10.459
  454    HB2  MET  58           1HB      MET  58  -4.163  -7.834  11.513
  455    HB3  MET  58           2HB      MET  58  -4.352  -6.229  10.767
  456    HG2  MET  58           1HG      MET  58  -6.468  -5.929  12.014
  457    HG3  MET  58           2HG      MET  58  -6.213  -7.506  12.795
  458    HE1  MET  58           3HE      MET  58  -3.218  -7.675  13.495
  459    HE2  MET  58           1HE      MET  58  -3.154  -6.905  15.098
  460    HE3  MET  58           2HE      MET  58  -4.510  -7.981  14.680
  461    H    ASP  59           H        ASP  59  -5.554  -5.184  10.283
  462    HA   ASP  59           HA       ASP  59  -7.715  -4.649   8.304
  463    HB2  ASP  59           1HB      ASP  59  -8.951  -3.182   9.863
  464    HB3  ASP  59           2HB      ASP  59  -8.688  -4.841  10.452
  465    H    PHE  60           H        PHE  60  -4.813  -4.374   8.281
  466    HA   PHE  60           HA       PHE  60  -4.780  -1.507   7.503
  467    HB2  PHE  60           1HB      PHE  60  -2.673  -1.080   8.676
  468    HB3  PHE  60           2HB      PHE  60  -3.904  -1.588   9.853
  469    HD1  PHE  60           HD1      PHE  60  -0.812  -2.507   8.124
  470    HD2  PHE  60           HD2      PHE  60  -3.743  -3.678  11.003
  471    HE1  PHE  60           HE1      PHE  60   0.711  -4.267   8.957
  472    HE2  PHE  60           HE2      PHE  60  -2.222  -5.438  11.840
  473    HZ   PHE  60           HZ       PHE  60   0.005  -5.734  10.815
  474    H    ILE  61           H        ILE  61  -2.762  -0.945   6.324
  475    HA   ILE  61           HA       ILE  61  -2.135  -3.249   4.493
  476    HB   ILE  61           HB       ILE  61  -2.245  -0.260   3.878
  477   HG12  ILE  61          1HG1      ILE  61  -4.437  -1.248   4.312
  478   HG13  ILE  61          2HG1      ILE  61  -4.215  -0.653   2.650
  479   HG21  ILE  61          1HG2      ILE  61  -1.968  -0.992   1.534
  480   HG22  ILE  61          2HG2      ILE  61  -0.584  -1.499   2.530
  481   HG23  ILE  61          3HG2      ILE  61  -1.834  -2.680   2.077
  482   HD11  ILE  61          3HD1      ILE  61  -4.072  -3.557   3.532
  483   HD12  ILE  61          1HD1      ILE  61  -5.430  -2.795   2.674
  484   HD13  ILE  61          2HD1      ILE  61  -3.850  -2.962   1.871
  485    H    SER  62           H        SER  62  -0.176  -3.921   4.258
  486    HA   SER  62           HA       SER  62   2.122  -2.110   5.006
  487    HB2  SER  62           1HB      SER  62   2.158  -4.172   6.064
  488    HB3  SER  62           2HB      SER  62   2.028  -5.023   4.508
  489    HG   SER  62           HG       SER  62   4.188  -4.847   5.243
  490    H    VAL  63           H        VAL  63   2.649  -0.823   3.316
  491    HA   VAL  63           HA       VAL  63   2.625  -1.988   0.542
  492    HB   VAL  63           HB       VAL  63   2.818   0.910   1.462
  493   HG11  VAL  63          1HG1      VAL  63   2.484   1.417  -0.934
  494   HG12  VAL  63          2HG1      VAL  63   3.964   0.463  -0.681
  495   HG13  VAL  63          3HG1      VAL  63   2.493  -0.321  -1.304
  496   HG21  VAL  63          3HG2      VAL  63   0.622  -0.000   1.932
  497   HG22  VAL  63          1HG2      VAL  63   0.554   1.151   0.577
  498   HG23  VAL  63          2HG2      VAL  63   0.494  -0.600   0.263
  499    H    ASP  64           H        ASP  64   4.361  -2.652  -0.344
  500    HA   ASP  64           HA       ASP  64   6.964  -1.690   0.803
  501    HB2  ASP  64           1HB      ASP  64   6.304  -4.235   1.075
  502    HB3  ASP  64           2HB      ASP  64   6.440  -4.166  -0.698
  503    H    LYS  65           H        LYS  65   8.313  -0.645  -0.418
  504    HA   LYS  65           HA       LYS  65   7.711  -0.513  -3.347
  505    HB2  LYS  65           1HB      LYS  65   8.831   1.578  -3.363
  506    HB3  LYS  65           2HB      LYS  65   7.635   1.585  -2.046
  507    HG2  LYS  65           1HG      LYS  65   9.354   1.311  -0.384
  508    HG3  LYS  65           2HG      LYS  65  10.591   1.044  -1.636
  509    HD2  LYS  65           1HD      LYS  65  10.284   3.339  -2.449
  510    HD3  LYS  65           2HD      LYS  65   9.017   3.610  -1.228
  511    HE2  LYS  65           1HE      LYS  65  10.992   4.579  -0.343
  512    HE3  LYS  65           2HE      LYS  65  10.754   3.047   0.528
  513    HZ1  LYS  65           3HZ      LYS  65  12.603   3.464  -1.733
  514    HZ2  LYS  65           1HZ      LYS  65  13.039   3.341  -0.147
  515    HZ3  LYS  65           2HZ      LYS  65  12.383   2.042  -0.925
  516    H    GLU  66           H        GLU  66   9.764   0.120  -4.642
  517    HA   GLU  66           HA       GLU  66  11.828  -1.933  -4.141
  518    HB2  GLU  66           1HB      GLU  66  11.486   0.178  -6.275
  519    HB3  GLU  66           2HB      GLU  66  12.839  -0.976  -6.203
  520    HG2  GLU  66           1HG      GLU  66   9.901  -1.849  -6.466
  521    HG3  GLU  66           2HG      GLU  66  11.051  -1.528  -7.783
  522    H    ASN  67           H        ASN  67  14.105  -1.420  -4.184
  523    HA   ASN  67           HA       ASN  67  14.748   0.390  -2.056
  524    HB2  ASN  67           1HB      ASN  67  16.745  -0.957  -4.028
  525    HB3  ASN  67           2HB      ASN  67  16.877   0.168  -2.655
  526   HD21  ASN  67          2HD2      ASN  67  17.833  -2.606  -3.070
  527   HD22  ASN  67          1HD2      ASN  67  17.217  -3.506  -1.723
  528    H    ASP  68           H        ASP  68  14.948   0.716  -5.578
  529    HA   ASP  68           HA       ASP  68  16.296   3.285  -5.487
  530    HB2  ASP  68           1HB      ASP  68  14.702   1.912  -7.735
  531    HB3  ASP  68           2HB      ASP  68  15.503   3.503  -7.731
  532    H    ALA  69           H        ALA  69  12.907   2.272  -5.636
  533    HA   ALA  69           HA       ALA  69  11.807   4.808  -6.273
  534    HB1  ALA  69           3HB      ALA  69  10.610   2.565  -4.611
  535    HB2  ALA  69           1HB      ALA  69   9.709   3.917  -5.334
  536    HB3  ALA  69           2HB      ALA  69  10.515   2.725  -6.379
  537    H    ASN  70           H        ASN  70  10.712   6.353  -4.996
  538    HA   ASN  70           HA       ASN  70  11.640   6.457  -2.142
  539    HB2  ASN  70           1HB      ASN  70  11.235   9.003  -3.878
  540    HB3  ASN  70           2HB      ASN  70  11.562   8.603  -2.174
  541   HD21  ASN  70          2HD2      ASN  70  12.851   8.996  -5.322
  542   HD22  ASN  70          1HD2      ASN  70  14.509   8.679  -4.938
  543    H    TRP  71           H        TRP  71  10.256   7.165  -0.587
  544    HA   TRP  71           HA       TRP  71   7.444   6.621  -1.076
  545    HB2  TRP  71           1HB      TRP  71   9.003   7.683   1.307
  546    HB3  TRP  71           2HB      TRP  71   7.233   7.513   1.320
  547    HD1  TRP  71           HD1      TRP  71   9.981   5.886   2.516
  548    HE1  TRP  71           HE1      TRP  71   9.629   3.222   2.807
  549    HE3  TRP  71           HE3      TRP  71   5.890   5.358  -0.453
  550    HZ2  TRP  71           HZ2      TRP  71   7.827   1.360   1.846
  551    HZ3  TRP  71           HZ3      TRP  71   4.883   3.181  -0.758
  552    HH2  TRP  71           HH2      TRP  71   5.784   1.181   0.346
  553    H    GLU  72           H        GLU  72   9.424   9.446  -1.262
  554    HA   GLU  72           HA       GLU  72   7.490  11.480  -0.816
  555    HB2  GLU  72           1HB      GLU  72   9.839  11.321  -2.706
  556    HB3  GLU  72           2HB      GLU  72   8.869  12.793  -2.451
  557    HG2  GLU  72           1HG      GLU  72   9.575  12.808  -0.021
  558    HG3  GLU  72           2HG      GLU  72  10.403  11.275  -0.381
  559    H    THR  73           H        THR  73   8.123   9.516  -3.694
  560    HA   THR  73           HA       THR  73   5.898  10.840  -5.131
  561    HB   THR  73           HB       THR  73   7.659   8.475  -5.901
  562    HG1  THR  73           HG1      THR  73   8.585  10.075  -7.314
  563   HG21  THR  73          3HG2      THR  73   5.664  10.098  -7.531
  564   HG22  THR  73          1HG2      THR  73   6.728   8.819  -8.163
  565   HG23  THR  73          2HG2      THR  73   5.445   8.415  -6.998
  566    H    VAL  74           H        VAL  74   6.622   7.658  -3.683
  567    HA   VAL  74           HA       VAL  74   4.257   6.447  -4.908
  568    HB   VAL  74           HB       VAL  74   6.153   5.480  -2.730
  569   HG11  VAL  74          1HG1      VAL  74   5.134   3.261  -3.114
  570   HG12  VAL  74          2HG1      VAL  74   3.926   4.427  -2.523
  571   HG13  VAL  74          3HG1      VAL  74   3.973   3.991  -4.248
  572   HG21  VAL  74          3HG2      VAL  74   7.226   5.746  -4.885
  573   HG22  VAL  74          1HG2      VAL  74   7.042   4.025  -4.479
  574   HG23  VAL  74          2HG2      VAL  74   5.948   4.782  -5.662
  575    H    LEU  75           H        LEU  75   5.010   7.594  -1.616
  576    HA   LEU  75           HA       LEU  75   2.851   6.072  -0.476
  577    HB2  LEU  75           1HB      LEU  75   4.787   6.714   0.648
  578    HB3  LEU  75           2HB      LEU  75   4.421   8.453   0.654
  579    HG   LEU  75           HG       LEU  75   2.346   7.941   1.973
  580   HD11  LEU  75          1HD1      LEU  75   2.239   5.712   3.121
  581   HD12  LEU  75          2HD1      LEU  75   2.157   5.533   1.354
  582   HD13  LEU  75          3HD1      LEU  75   3.677   5.192   2.213
  583   HD21  LEU  75          3HD2      LEU  75   4.341   8.779   3.064
  584   HD22  LEU  75          1HD2      LEU  75   3.520   7.607   4.120
  585   HD23  LEU  75          2HD2      LEU  75   4.983   7.128   3.227
  586    HA   PRO  76           HA       PRO  76   0.591  10.446  -0.444
  587    HB2  PRO  76           2HB      PRO  76   1.258  12.290  -1.817
  588    HB3  PRO  76           1HB      PRO  76   1.758  11.242  -3.152
  589    HG2  PRO  76           1HG      PRO  76   3.849  11.877  -2.216
  590    HG3  PRO  76           2HG      PRO  76   3.228  11.854  -0.559
  591    HD2  PRO  76           1HD      PRO  76   4.004   9.506  -2.335
  592    HD3  PRO  76           2HD      PRO  76   4.267   9.720  -0.600
  593    H    LYS  77           H        LYS  77   1.442   8.630  -3.377
  594    HA   LYS  77           HA       LYS  77  -1.184   8.928  -4.558
  595    HB2  LYS  77           1HB      LYS  77   1.060   6.960  -5.015
  596    HB3  LYS  77           2HB      LYS  77  -0.435   7.012  -5.978
  597    HG2  LYS  77           1HG      LYS  77   0.104   9.309  -6.687
  598    HG3  LYS  77           2HG      LYS  77   1.600   9.255  -5.726
  599    HD2  LYS  77           1HD      LYS  77   2.387   7.346  -7.092
  600    HD3  LYS  77           2HD      LYS  77   0.909   7.457  -8.076
  601    HE2  LYS  77           1HE      LYS  77   1.518   9.743  -8.738
  602    HE3  LYS  77           2HE      LYS  77   2.993   9.639  -7.753
  603    HZ1  LYS  77           3HZ      LYS  77   2.363   7.940 -10.080
  604    HZ2  LYS  77           1HZ      LYS  77   3.437   9.192 -10.069
  605    HZ3  LYS  77           2HZ      LYS  77   3.733   7.843  -9.166
  606    H    VAL  78           H        VAL  78   0.355   6.326  -2.671
  607    HA   VAL  78           HA       VAL  78  -1.928   4.578  -2.573
  608    HB   VAL  78           HB       VAL  78   0.286   5.073  -0.541
  609   HG11  VAL  78          1HG1      VAL  78  -0.398   2.899   0.418
  610   HG12  VAL  78          2HG1      VAL  78  -1.719   4.088   0.516
  611   HG13  VAL  78          3HG1      VAL  78  -1.753   2.819  -0.730
  612   HG21  VAL  78          3HG2      VAL  78   1.113   4.265  -2.670
  613   HG22  VAL  78          1HG2      VAL  78   1.240   3.003  -1.422
  614   HG23  VAL  78          2HG2      VAL  78  -0.058   2.927  -2.638
  615    H    GLU  79           H        GLU  79  -0.955   7.181  -0.339
  616    HA   GLU  79           HA       GLU  79  -3.222   7.040   1.357
  617    HB2  GLU  79           1HB      GLU  79  -1.254   8.421   1.791
  618    HB3  GLU  79           2HB      GLU  79  -1.682   9.466   0.415
  619    HG2  GLU  79           1HG      GLU  79  -3.812  10.131   1.648
  620    HG3  GLU  79           2HG      GLU  79  -3.256   9.017   2.917
  621    H    ALA  80           H        ALA  80  -2.844   8.581  -1.806
  622    HA   ALA  80           HA       ALA  80  -5.207  10.142  -1.733
  623    HB1  ALA  80           3HB      ALA  80  -3.858   8.831  -4.118
  624    HB2  ALA  80           1HB      ALA  80  -5.052  10.146  -4.193
  625    HB3  ALA  80           2HB      ALA  80  -3.465  10.427  -3.437
  626    H    VAL  81           H        VAL  81  -4.711   6.789  -2.830
  627    HA   VAL  81           HA       VAL  81  -7.465   6.543  -3.822
  628    HB   VAL  81           HB       VAL  81  -6.794   4.044  -3.837
  629   HG11  VAL  81          1HG1      VAL  81  -5.414   4.339  -5.867
  630   HG12  VAL  81          2HG1      VAL  81  -6.784   5.477  -5.851
  631   HG13  VAL  81          3HG1      VAL  81  -5.149   6.046  -5.438
  632   HG21  VAL  81          3HG2      VAL  81  -5.019   4.169  -2.193
  633   HG22  VAL  81          1HG2      VAL  81  -4.395   3.584  -3.753
  634   HG23  VAL  81          2HG2      VAL  81  -4.093   5.264  -3.247
  635    H    PHE  82           H        PHE  82  -5.778   5.675  -0.851
  636    HA   PHE  82           HA       PHE  82  -8.023   4.253   0.298
  637    HB2  PHE  82           1HB      PHE  82  -5.662   5.684   1.591
  638    HB3  PHE  82           2HB      PHE  82  -6.821   4.649   2.454
  639    HD1  PHE  82           HD1      PHE  82  -6.516   3.197  -0.649
  640    HD2  PHE  82           HD2      PHE  82  -4.304   3.819   2.951
  641    HE1  PHE  82           HE1      PHE  82  -5.130   1.215  -1.160
  642    HE2  PHE  82           HE2      PHE  82  -2.913   1.839   2.442
  643    HZ   PHE  82           HZ       PHE  82  -3.329   0.536   0.385
  644    H    GLU  83           H        GLU  83  -7.240   7.623  -0.079
  645    HA   GLU  83           HA       GLU  83  -9.461   8.377   1.767
  646    HB2  GLU  83           1HB      GLU  83  -7.387  10.025   0.312
  647    HB3  GLU  83           2HB      GLU  83  -8.663  10.676   1.369
  648    HG2  GLU  83           1HG      GLU  83  -6.342   8.866   2.275
  649    HG3  GLU  83           2HG      GLU  83  -6.581  10.615   2.491
  650    H    LEU  84           H        LEU  84  -9.698   7.106  -0.996
  651    HA   LEU  84           HA       LEU  84 -11.443   9.132  -2.261
  652    HB2  LEU  84           1HB      LEU  84 -10.885   6.274  -2.697
  653    HB3  LEU  84           2HB      LEU  84 -12.009   7.119  -3.786
  654    HG   LEU  84           HG       LEU  84  -9.040   7.684  -3.430
  655   HD11  LEU  84          1HD1      LEU  84  -8.898   6.961  -5.829
  656   HD12  LEU  84          2HD1      LEU  84  -9.542   5.661  -4.799
  657   HD13  LEU  84          3HD1      LEU  84 -10.643   6.622  -5.813
  658   HD21  LEU  84          3HD2      LEU  84 -10.268   9.745  -3.778
  659   HD22  LEU  84          1HD2      LEU  84  -9.326   9.346  -5.234
  660   HD23  LEU  84          2HD2      LEU  84 -11.083   9.054  -5.201
  661    H    GLU  85           H        GLU  85 -11.640   6.885   0.267
  662    HA   GLU  85           HA       GLU  85 -13.429   5.962   1.431
  663    HB2  GLU  85           1HB      GLU  85 -14.823   8.389   0.290
  664    HB3  GLU  85           2HB      GLU  85 -15.424   7.369   1.619
  665    HG2  GLU  85           1HG      GLU  85 -13.386   8.075   2.994
  666    HG3  GLU  85           2HG      GLU  85 -12.943   9.035   1.564
  667    H    HIS  86           H        HIS  86 -12.997   4.708  -0.937
  668    HA   HIS  86           HA       HIS  86 -15.334   4.548  -2.614
  669    HB2  HIS  86           1HB      HIS  86 -12.907   3.716  -3.098
  670    HB3  HIS  86           2HB      HIS  86 -13.389   2.259  -2.197
  671    HD2  HIS  86           HD2      HIS  86 -13.433   3.469  -5.839
  672    HE1  HIS  86           HE1      HIS  86 -16.475   0.532  -5.427
  673    HE2  HIS  86           HE2      HIS  86 -15.012   1.971  -7.071
  674    H    HIS  87           H        HIS  87 -17.029   3.166  -2.697
  675    HA   HIS  87           HA       HIS  87 -17.930   2.433   0.005
  676    HB2  HIS  87           1HB      HIS  87 -19.322   2.428  -2.709
  677    HB3  HIS  87           2HB      HIS  87 -20.108   1.973  -1.179
  678    HD2  HIS  87           HD2      HIS  87 -19.584   5.163  -3.300
  679    HE1  HIS  87           HE1      HIS  87 -20.532   6.350   0.667
  680    HE2  HIS  87           HE2      HIS  87 -20.253   7.083  -1.841
  681    H    HIS  88           H        HIS  88 -16.584   0.828  -2.722
  682    HA   HIS  88           HA       HIS  88 -17.314  -1.807  -1.502
  683    HB2  HIS  88           1HB      HIS  88 -17.314  -1.138  -4.481
  684    HB3  HIS  88           2HB      HIS  88 -17.607  -2.741  -3.769
  685    HD2  HIS  88           HD2      HIS  88 -19.650   0.435  -4.780
  686    HE1  HIS  88           HE1      HIS  88 -22.104  -2.090  -2.405
  687    HE2  HIS  88           HE2      HIS  88 -21.982   0.003  -3.987
  688    H    HIS  89           H        HIS  89 -15.943  -3.596  -2.242
  689    HA   HIS  89           HA       HIS  89 -13.363  -2.864  -3.459
  690    HB2  HIS  89           1HB      HIS  89 -11.995  -3.757  -1.632
  691    HB3  HIS  89           2HB      HIS  89 -13.002  -2.428  -1.009
  692    HD1  HIS  89           HD1      HIS  89 -15.110  -3.133   0.439
  693    HD2  HIS  89           HD2      HIS  89 -12.394  -6.266  -0.323
  694    HE1  HIS  89           HE1      HIS  89 -15.585  -4.858   2.103
  695    H    HIS  90           H        HIS  90 -11.898  -4.908  -3.444
  696    HA   HIS  90           HA       HIS  90 -13.672  -7.159  -4.332
  697    HB2  HIS  90           1HB      HIS  90 -11.045  -6.173  -5.533
  698    HB3  HIS  90           2HB      HIS  90 -11.898  -7.656  -6.026
  699    HD1  HIS  90           HD1      HIS  90 -11.275  -5.260  -7.934
  700    HD2  HIS  90           HD2      HIS  90 -14.993  -5.924  -6.064
  701    HE1  HIS  90           HE1      HIS  90 -12.924  -4.033  -9.257
  702    H    HIS  91           H        HIS  91 -12.876  -9.279  -4.178
  703    HA   HIS  91           HA       HIS  91 -10.831  -9.604  -2.018
  704    HB2  HIS  91           1HB      HIS  91 -13.081 -11.399  -3.011
  705    HB3  HIS  91           2HB      HIS  91 -11.779 -11.984  -1.948
  706    HD2  HIS  91           HD2      HIS  91 -15.182 -10.021  -1.662
  707    HE1  HIS  91           HE1      HIS  91 -13.238 -10.066   2.114
  708    HE2  HIS  91           HE2      HIS  91 -15.436  -9.526   0.776
  Start of MODEL   19
    1    H1   MET   1           1H       MET   1 -11.303  -1.229   3.102
    2    H2   MET   1           2H       MET   1 -12.426  -0.901   2.163
    3    H3   MET   1           3H       MET   1 -11.194  -0.046   2.188
    4    HA   MET   1           HA       MET   1 -13.537   0.448   3.712
    5    HB2  MET   1           1HB      MET   1 -11.089  -0.156   5.371
    6    HB3  MET   1           2HB      MET   1 -12.621   0.527   5.966
    7    HG2  MET   1           1HG      MET   1 -12.280  -2.218   4.722
    8    HG3  MET   1           2HG      MET   1 -12.388  -1.888   6.467
    9    HE1  MET   1           3HE      MET   1 -14.376  -3.743   6.505
   10    HE2  MET   1           1HE      MET   1 -15.846  -3.614   5.509
   11    HE3  MET   1           2HE      MET   1 -14.273  -3.928   4.736
   12    H    LYS   2           H        LYS   2 -11.543   1.849   5.737
   13    HA   LYS   2           HA       LYS   2 -10.810   4.108   3.918
   14    HB2  LYS   2           1HB      LYS   2 -12.985   4.566   4.993
   15    HB3  LYS   2           2HB      LYS   2 -12.215   4.356   6.582
   16    HG2  LYS   2           1HG      LYS   2 -10.804   6.289   6.219
   17    HG3  LYS   2           2HG      LYS   2 -11.392   6.450   4.547
   18    HD2  LYS   2           1HD      LYS   2 -13.618   6.992   5.317
   19    HD3  LYS   2           2HD      LYS   2 -13.163   6.655   7.004
   20    HE2  LYS   2           1HE      LYS   2 -11.579   8.515   6.972
   21    HE3  LYS   2           2HE      LYS   2 -11.965   8.835   5.267
   22    HZ1  LYS   2           3HZ      LYS   2 -13.857   9.045   7.521
   23    HZ2  LYS   2           1HZ      LYS   2 -13.151  10.315   6.739
   24    HZ3  LYS   2           2HZ      LYS   2 -14.215   9.343   5.938
   25    H    ILE   3           H        ILE   3  -8.869   4.881   4.181
   26    HA   ILE   3           HA       ILE   3  -7.182   3.769   6.349
   27    HB   ILE   3           HB       ILE   3  -6.667   5.435   3.864
   28   HG12  ILE   3          1HG1      ILE   3  -5.059   3.626   3.414
   29   HG13  ILE   3          2HG1      ILE   3  -5.643   2.796   4.875
   30   HG21  ILE   3          1HG2      ILE   3  -4.297   5.586   4.548
   31   HG22  ILE   3          2HG2      ILE   3  -5.349   6.447   5.696
   32   HG23  ILE   3          3HG2      ILE   3  -4.700   4.843   6.113
   33   HD11  ILE   3          3HD1      ILE   3  -7.317   3.491   2.437
   34   HD12  ILE   3          1HD1      ILE   3  -6.697   1.876   2.848
   35   HD13  ILE   3          2HD1      ILE   3  -7.901   2.663   3.898
   36    H    ILE   4           H        ILE   4  -6.280   4.751   7.997
   37    HA   ILE   4           HA       ILE   4  -7.421   7.432   8.681
   38    HB   ILE   4           HB       ILE   4  -5.970   5.343  10.373
   39   HG12  ILE   4          1HG1      ILE   4  -8.841   6.239  10.419
   40   HG13  ILE   4          2HG1      ILE   4  -8.235   4.746   9.666
   41   HG21  ILE   4          1HG2      ILE   4  -6.556   6.800  12.284
   42   HG22  ILE   4          2HG2      ILE   4  -5.498   7.649  11.133
   43   HG23  ILE   4          3HG2      ILE   4  -7.241   7.998  11.161
   44   HD11  ILE   4          3HD1      ILE   4  -8.054   5.449  12.615
   45   HD12  ILE   4          1HD1      ILE   4  -9.194   4.294  11.890
   46   HD13  ILE   4          2HD1      ILE   4  -7.446   3.957  11.863
   47    H    SER   5           H        SER   5  -4.272   5.759   8.812
   48    HA   SER   5           HA       SER   5  -2.901   8.264   7.932
   49    HB2  SER   5           1HB      SER   5  -1.580   8.578   9.760
   50    HB3  SER   5           2HB      SER   5  -3.288   8.670  10.245
   51    HG   SER   5           HG       SER   5  -2.012   7.461  11.713
   52    H    ILE   6           H        ILE   6  -0.563   7.900   7.744
   53    HA   ILE   6           HA       ILE   6   0.138   4.996   7.375
   54    HB   ILE   6           HB       ILE   6   1.119   7.411   5.783
   55   HG12  ILE   6          1HG1      ILE   6  -0.654   5.125   4.962
   56   HG13  ILE   6          2HG1      ILE   6  -1.165   6.804   5.257
   57   HG21  ILE   6          1HG2      ILE   6   2.285   5.723   4.407
   58   HG22  ILE   6          2HG2      ILE   6   2.847   5.672   6.093
   59   HG23  ILE   6          3HG2      ILE   6   1.713   4.437   5.496
   60   HD11  ILE   6          3HD1      ILE   6   0.767   5.884   3.098
   61   HD12  ILE   6          1HD1      ILE   6  -0.929   6.355   2.846
   62   HD13  ILE   6          2HD1      ILE   6   0.259   7.563   3.393
   63    H    SER   7           H        SER   7   1.489   4.252   8.735
   64    HA   SER   7           HA       SER   7   3.359   6.158  10.156
   65    HB2  SER   7           1HB      SER   7   3.446   4.646  11.889
   66    HB3  SER   7           2HB      SER   7   1.764   5.093  11.526
   67    HG   SER   7           HG       SER   7   3.071   2.699  10.742
   68    H    GLU   8           H        GLU   8   5.465   5.306  10.707
   69    HA   GLU   8           HA       GLU   8   6.678   3.827   8.451
   70    HB2  GLU   8           1HB      GLU   8   7.859   5.111  10.919
   71    HB3  GLU   8           2HB      GLU   8   8.791   4.334   9.615
   72    HG2  GLU   8           1HG      GLU   8   7.935   6.097   8.002
   73    HG3  GLU   8           2HG      GLU   8   6.990   6.709   9.379
   74    H    THR   9           H        THR   9   8.404   2.220   8.967
   75    HA   THR   9           HA       THR   9   7.605   0.459  11.249
   76    HB   THR   9           HB       THR   9   7.583  -1.503   9.879
   77    HG1  THR   9           HG1      THR   9   7.958  -0.166   7.458
   78   HG21  THR   9          3HG2      THR   9   6.085   0.696   8.402
   79   HG22  THR   9          1HG2      THR   9   5.758  -1.048   8.281
   80   HG23  THR   9          2HG2      THR   9   5.487  -0.197   9.820
   81    HA   PRO  10           HA       PRO  10  11.841  -0.260  12.068
   82    HB2  PRO  10           2HB      PRO  10  12.013  -2.397  13.103
   83    HB3  PRO  10           1HB      PRO  10  11.292  -3.230  11.719
   84    HG2  PRO  10           1HG      PRO  10   9.498  -3.277  13.265
   85    HG3  PRO  10           2HG      PRO  10   9.914  -1.700  13.952
   86    HD2  PRO  10           1HD      PRO  10   8.491  -2.317  11.331
   87    HD3  PRO  10           2HD      PRO  10   8.159  -1.032  12.497
   88    H    ASN  11           H        ASN  11  10.405  -2.009   9.354
   89    HA   ASN  11           HA       ASN  11  13.033  -1.793   7.941
   90    HB2  ASN  11           1HB      ASN  11  11.617  -4.097   7.809
   91    HB3  ASN  11           2HB      ASN  11  10.552  -2.883   7.061
   92   HD21  ASN  11          2HD2      ASN  11  11.692  -5.322   5.950
   93   HD22  ASN  11          1HD2      ASN  11  12.594  -4.839   4.553
   94    H    HIS  12           H        HIS  12  13.415  -0.012   6.894
   95    HA   HIS  12           HA       HIS  12  11.301   1.932   6.509
   96    HB2  HIS  12           1HB      HIS  12  13.030   3.399   5.729
   97    HB3  HIS  12           2HB      HIS  12  13.788   2.411   7.000
   98    HD2  HIS  12           HD2      HIS  12  14.218   3.134   3.133
   99    HE1  HIS  12           HE1      HIS  12  17.034   0.210   4.389
  100    HE2  HIS  12           HE2      HIS  12  16.244   1.825   2.470
  101    H    ASN  13           H        ASN  13  12.216  -0.736   4.703
  102    HA   ASN  13           HA       ASN  13  11.712   0.443   2.056
  103    HB2  ASN  13           1HB      ASN  13  12.083  -2.573   2.719
  104    HB3  ASN  13           2HB      ASN  13  11.755  -1.594   1.269
  105   HD21  ASN  13          2HD2      ASN  13  13.315   0.407   1.211
  106   HD22  ASN  13          1HD2      ASN  13  14.994  -0.004   1.348
  107    H    THR  14           H        THR  14   9.766  -0.495   4.609
  108    HA   THR  14           HA       THR  14   7.422  -0.546   2.760
  109    HB   THR  14           HB       THR  14   7.922  -2.908   3.454
  110    HG1  THR  14           HG1      THR  14   5.725  -3.170   4.425
  111   HG21  THR  14          3HG2      THR  14   7.324  -1.818   6.233
  112   HG22  THR  14          1HG2      THR  14   7.530  -3.535   5.811
  113   HG23  THR  14          2HG2      THR  14   8.903  -2.411   5.668
  114    H    MET  15           H        MET  15   5.532   0.295   3.536
  115    HA   MET  15           HA       MET  15   5.758   1.703   6.180
  116    HB2  MET  15           1HB      MET  15   4.210   2.477   3.708
  117    HB3  MET  15           2HB      MET  15   4.176   3.329   5.269
  118    HG2  MET  15           1HG      MET  15   6.669   2.962   3.585
  119    HG3  MET  15           2HG      MET  15   5.619   4.397   3.503
  120    HE1  MET  15           3HE      MET  15   4.751   5.022   6.394
  121    HE2  MET  15           1HE      MET  15   6.075   6.064   6.972
  122    HE3  MET  15           2HE      MET  15   5.465   6.240   5.308
  123    H    LYS  16           H        LYS  16   3.939   1.867   7.480
  124    HA   LYS  16           HA       LYS  16   1.998  -0.370   7.007
  125    HB2  LYS  16           1HB      LYS  16   3.474  -0.670   8.932
  126    HB3  LYS  16           2HB      LYS  16   2.943   0.897   9.582
  127    HG2  LYS  16           1HG      LYS  16   0.633   0.015   9.760
  128    HG3  LYS  16           2HG      LYS  16   1.212  -1.563   9.178
  129    HD2  LYS  16           1HD      LYS  16   2.703  -1.750  11.114
  130    HD3  LYS  16           2HD      LYS  16   2.177  -0.151  11.686
  131    HE2  LYS  16           1HE      LYS  16  -0.136  -1.003  11.877
  132    HE3  LYS  16           2HE      LYS  16   0.429  -2.609  11.362
  133    HZ1  LYS  16           3HZ      LYS  16   1.302  -1.180  13.791
  134    HZ2  LYS  16           1HZ      LYS  16   0.251  -2.452  13.752
  135    HZ3  LYS  16           2HZ      LYS  16   1.827  -2.670  13.316
  136    H    ILE  17           H        ILE  17   0.008   0.119   6.571
  137    HA   ILE  17           HA       ILE  17  -0.917   2.914   7.190
  138    HB   ILE  17           HB       ILE  17  -1.736   1.012   4.947
  139   HG12  ILE  17          1HG1      ILE  17  -0.903   3.214   3.704
  140   HG13  ILE  17          2HG1      ILE  17   0.144   3.275   5.141
  141   HG21  ILE  17          1HG2      ILE  17  -3.120   2.902   4.154
  142   HG22  ILE  17          2HG2      ILE  17  -3.629   2.370   5.773
  143   HG23  ILE  17          3HG2      ILE  17  -2.652   3.845   5.588
  144   HD11  ILE  17          3HD1      ILE  17  -0.094   0.939   3.211
  145   HD12  ILE  17          1HD1      ILE  17   1.253   2.096   3.282
  146   HD13  ILE  17          2HD1      ILE  17   0.951   0.998   4.650
  147    H    THR  18           H        THR  18  -2.496   3.256   8.480
  148    HA   THR  18           HA       THR  18  -3.770   0.884   9.709
  149    HB   THR  18           HB       THR  18  -3.944   3.845  10.411
  150    HG1  THR  18           HG1      THR  18  -2.571   3.151  12.156
  151   HG21  THR  18          3HG2      THR  18  -4.883   1.372  11.918
  152   HG22  THR  18          1HG2      THR  18  -4.936   3.042  12.527
  153   HG23  THR  18          2HG2      THR  18  -5.936   2.571  11.131
  154    H    LEU  19           H        LEU  19  -5.791   0.253   9.547
  155    HA   LEU  19           HA       LEU  19  -7.531   1.777   7.660
  156    HB2  LEU  19           1HB      LEU  19  -7.700  -0.932   8.807
  157    HB3  LEU  19           2HB      LEU  19  -8.838  -0.386   7.554
  158    HG   LEU  19           HG       LEU  19  -5.849  -0.863   7.240
  159   HD11  LEU  19          1HD1      LEU  19  -6.589  -2.630   5.619
  160   HD12  LEU  19          2HD1      LEU  19  -7.235  -2.934   7.249
  161   HD13  LEU  19          3HD1      LEU  19  -8.284  -2.238   5.990
  162   HD21  LEU  19          3HD2      LEU  19  -6.532   1.073   5.951
  163   HD22  LEU  19          1HD2      LEU  19  -6.184  -0.288   4.860
  164   HD23  LEU  19          2HD2      LEU  19  -7.870   0.153   5.222
  165    H    SER  20           H        SER  20  -9.820   1.899   8.082
  166    HA   SER  20           HA       SER  20 -10.256   3.199  10.668
  167    HB2  SER  20           1HB      SER  20 -12.341   3.735   9.912
  168    HB3  SER  20           2HB      SER  20 -11.149   4.010   8.620
  169    HG   SER  20           HG       SER  20 -13.122   2.013   8.831
  170    H    GLU  21           H        GLU  21 -10.724  -0.024   9.383
  171    HA   GLU  21           HA       GLU  21 -12.796  -0.633  11.449
  172    HB2  GLU  21           1HB      GLU  21 -11.889  -2.226   9.048
  173    HB3  GLU  21           2HB      GLU  21 -13.230  -2.630  10.147
  174    HG2  GLU  21           1HG      GLU  21 -13.140  -0.355   8.088
  175    HG3  GLU  21           2HG      GLU  21 -14.181  -1.787   8.232
  176    H    SER  22           H        SER  22 -12.725  -2.666  12.560
  177    HA   SER  22           HA       SER  22 -10.092  -3.122  13.811
  178    HB2  SER  22           1HB      SER  22 -11.149  -4.494  15.271
  179    HB3  SER  22           2HB      SER  22 -12.151  -3.044  15.033
  180    HG   SER  22           HG       SER  22 -13.435  -4.314  13.597
  181    H    ARG  23           H        ARG  23  -9.369  -5.398  14.154
  182    HA   ARG  23           HA       ARG  23  -8.838  -6.659  11.599
  183    HB2  ARG  23           1HB      ARG  23  -7.565  -8.223  12.723
  184    HB3  ARG  23           2HB      ARG  23  -7.248  -6.619  13.423
  185    HG2  ARG  23           1HG      ARG  23  -8.773  -7.205  15.311
  186    HG3  ARG  23           2HG      ARG  23  -8.917  -8.844  14.633
  187    HD2  ARG  23           1HD      ARG  23  -6.540  -9.173  14.929
  188    HD3  ARG  23           2HD      ARG  23  -6.399  -7.536  15.611
  189    HE   ARG  23           HE       ARG  23  -7.344  -9.883  17.138
  190   HH11  ARG  23          1HH1      ARG  23  -7.458  -6.403  16.938
  191   HH12  ARG  23          2HH1      ARG  23  -7.890  -6.314  18.634
  192   HH21  ARG  23          2HH2      ARG  23  -8.102  -8.248  19.859
  193   HH22  ARG  23          1HH2      ARG  23  -7.831  -9.797  19.083
  194    H    GLU  24           H        GLU  24 -11.402  -6.915  13.849
  195    HA   GLU  24           HA       GLU  24 -12.144  -9.662  13.327
  196    HB2  GLU  24           1HB      GLU  24 -12.901  -8.308  15.263
  197    HB3  GLU  24           2HB      GLU  24 -13.877  -7.324  14.145
  198    HG2  GLU  24           1HG      GLU  24 -15.223  -9.406  13.563
  199    HG3  GLU  24           2HG      GLU  24 -14.128 -10.256  14.677
  200    H    GLY  25           H        GLY  25 -12.829 -10.545  11.563
  201    HA2  GLY  25           1HA      GLY  25 -14.362 -10.793   9.766
  202    HA3  GLY  25           2HA      GLY  25 -14.708  -9.049   9.829
  203    H    MET  26           H        MET  26 -11.465  -9.189  10.079
  204    HA   MET  26           HA       MET  26 -11.135  -8.555   7.197
  205    HB2  MET  26           1HB      MET  26  -9.290  -8.265   9.568
  206    HB3  MET  26           2HB      MET  26  -8.925  -7.748   7.903
  207    HG2  MET  26           1HG      MET  26 -11.257  -6.690   9.521
  208    HG3  MET  26           2HG      MET  26  -9.656  -5.915   9.487
  209    HE1  MET  26           3HE      MET  26 -13.042  -5.524   8.268
  210    HE2  MET  26           1HE      MET  26 -13.011  -5.458   6.489
  211    HE3  MET  26           2HE      MET  26 -12.774  -7.012   7.327
  212    H    THR  27           H        THR  27  -9.395  -9.338   5.950
  213    HA   THR  27           HA       THR  27  -8.550 -12.100   6.768
  214    HB   THR  27           HB       THR  27 -10.247 -12.025   4.878
  215    HG1  THR  27           HG1      THR  27  -8.923 -13.444   3.568
  216   HG21  THR  27          3HG2      THR  27  -7.910 -10.729   3.417
  217   HG22  THR  27          1HG2      THR  27  -9.420 -11.299   2.666
  218   HG23  THR  27          2HG2      THR  27  -9.455  -9.940   3.813
  219    H    SER  28           H        SER  28  -6.838 -12.650   4.716
  220    HA   SER  28           HA       SER  28  -4.809 -10.402   4.656
  221    HB2  SER  28           1HB      SER  28  -3.052 -11.812   5.083
  222    HB3  SER  28           2HB      SER  28  -4.211 -11.842   6.432
  223    HG   SER  28           HG       SER  28  -3.449 -13.927   5.867
  224    H    ASP  29           H        ASP  29  -3.462 -10.434   2.845
  225    HA   ASP  29           HA       ASP  29  -3.681 -12.444   0.759
  226    HB2  ASP  29           1HB      ASP  29  -5.911 -10.888   0.660
  227    HB3  ASP  29           2HB      ASP  29  -4.654  -9.799   0.020
  228    H    THR  30           H        THR  30  -2.380 -12.030  -1.065
  229    HA   THR  30           HA       THR  30  -0.376  -9.842  -0.598
  230    HB   THR  30           HB       THR  30   0.095 -12.595  -1.818
  231    HG1  THR  30           HG1      THR  30   1.393 -12.848   0.096
  232   HG21  THR  30          3HG2      THR  30   2.005 -10.303  -1.216
  233   HG22  THR  30          1HG2      THR  30   2.465 -11.908  -1.829
  234   HG23  THR  30          2HG2      THR  30   1.481 -10.821  -2.836
  235    H    TYR  31           H        TYR  31   0.031  -8.464  -2.154
  236    HA   TYR  31           HA       TYR  31  -1.317  -8.968  -4.790
  237    HB2  TYR  31           1HB      TYR  31  -1.094  -6.360  -3.275
  238    HB3  TYR  31           2HB      TYR  31  -1.842  -6.598  -4.872
  239    HD1  TYR  31           HD1      TYR  31  -2.440  -6.463  -1.365
  240    HD2  TYR  31           HD2      TYR  31  -3.824  -8.301  -4.955
  241    HE1  TYR  31           HE1      TYR  31  -4.607  -6.953  -0.269
  242    HE2  TYR  31           HE2      TYR  31  -5.993  -8.797  -3.878
  243    HH   TYR  31           HH       TYR  31  -7.177  -8.780  -1.912
  244    H    THR  32           H        THR  32   0.279  -9.441  -6.117
  245    HA   THR  32           HA       THR  32   2.554  -7.486  -6.245
  246    HB   THR  32           HB       THR  32   3.908  -9.282  -7.228
  247    HG1  THR  32           HG1      THR  32   3.014 -11.428  -7.246
  248   HG21  THR  32          3HG2      THR  32   2.558 -10.155  -4.643
  249   HG22  THR  32          1HG2      THR  32   4.132 -10.731  -5.240
  250   HG23  THR  32          2HG2      THR  32   3.926  -9.026  -4.770
  251    H    LYS  33           H        LYS  33   0.085  -9.245  -8.003
  252    HA   LYS  33           HA       LYS  33   0.775  -7.586 -10.410
  253    HB2  LYS  33           1HB      LYS  33  -0.574 -10.283 -10.230
  254    HB3  LYS  33           2HB      LYS  33  -0.409  -9.314 -11.713
  255    HG2  LYS  33           1HG      LYS  33   2.041  -9.484 -11.556
  256    HG3  LYS  33           2HG      LYS  33   1.880 -10.449 -10.069
  257    HD2  LYS  33           1HD      LYS  33   0.669 -12.185 -11.314
  258    HD3  LYS  33           2HD      LYS  33   0.806 -11.219 -12.803
  259    HE2  LYS  33           1HE      LYS  33   3.255 -11.364 -12.675
  260    HE3  LYS  33           2HE      LYS  33   3.120 -12.327 -11.187
  261    HZ1  LYS  33           3HZ      LYS  33   2.102 -13.120 -13.838
  262    HZ2  LYS  33           1HZ      LYS  33   3.459 -13.715 -13.117
  263    HZ3  LYS  33           2HZ      LYS  33   1.976 -14.014 -12.458
  264    H    VAL  34           H        VAL  34  -1.076  -7.087 -11.816
  265    HA   VAL  34           HA       VAL  34  -3.316  -6.051 -10.141
  266    HB   VAL  34           HB       VAL  34  -2.635  -5.648 -13.084
  267   HG11  VAL  34          1HG1      VAL  34  -4.331  -3.851 -12.979
  268   HG12  VAL  34          2HG1      VAL  34  -5.053  -5.435 -12.614
  269   HG13  VAL  34          3HG1      VAL  34  -4.696  -4.295 -11.295
  270   HG21  VAL  34          3HG2      VAL  34  -0.976  -4.643 -11.633
  271   HG22  VAL  34          1HG2      VAL  34  -1.973  -3.394 -12.412
  272   HG23  VAL  34          2HG2      VAL  34  -2.254  -3.821 -10.708
  273    H    ASP  35           H        ASP  35  -5.129  -6.984  -9.857
  274    HA   ASP  35           HA       ASP  35  -6.293  -8.596 -12.067
  275    HB2  ASP  35           1HB      ASP  35  -4.953 -10.079 -10.233
  276    HB3  ASP  35           2HB      ASP  35  -6.397  -9.574  -9.319
  277    H    ASP  36           H        ASP  36  -8.548  -9.133 -11.730
  278    HA   ASP  36           HA       ASP  36  -9.918  -6.699 -10.882
  279    HB2  ASP  36           1HB      ASP  36 -10.988  -9.360 -12.001
  280    HB3  ASP  36           2HB      ASP  36 -11.892  -7.928 -11.447
  281    H    SER  37           H        SER  37  -9.416  -9.895  -9.537
  282    HA   SER  37           HA       SER  37 -11.470  -9.860  -7.493
  283    HB2  SER  37           1HB      SER  37 -10.329 -11.565  -6.477
  284    HB3  SER  37           2HB      SER  37 -10.372 -11.824  -8.236
  285    HG   SER  37           HG       SER  37  -8.178 -10.816  -6.743
  286    H    GLN  38           H        GLN  38  -8.556  -8.042  -7.919
  287    HA   GLN  38           HA       GLN  38  -8.141  -7.660  -5.006
  288    HB2  GLN  38           1HB      GLN  38  -6.686  -6.384  -7.325
  289    HB3  GLN  38           2HB      GLN  38  -6.169  -6.463  -5.625
  290    HG2  GLN  38           1HG      GLN  38  -5.729  -9.050  -5.952
  291    HG3  GLN  38           2HG      GLN  38  -6.658  -8.671  -7.422
  292   HE21  GLN  38          2HE2      GLN  38  -3.961  -9.912  -6.988
  293   HE22  GLN  38          1HE2      GLN  38  -2.871  -8.961  -7.942
  294    HA   PRO  39           HA       PRO  39 -10.282  -3.870  -4.489
  295    HB2  PRO  39           2HB      PRO  39  -9.313  -2.844  -2.570
  296    HB3  PRO  39           1HB      PRO  39  -7.685  -2.865  -3.261
  297    HG2  PRO  39           1HG      PRO  39  -7.527  -4.627  -1.688
  298    HG3  PRO  39           2HG      PRO  39  -9.213  -5.116  -1.912
  299    HD2  PRO  39           1HD      PRO  39  -6.812  -5.688  -3.693
  300    HD3  PRO  39           2HD      PRO  39  -8.171  -6.745  -3.286
  301    H    ALA  40           H        ALA  40 -10.699  -2.286  -5.773
  302    HA   ALA  40           HA       ALA  40  -9.183  -1.470  -7.964
  303    HB1  ALA  40           3HB      ALA  40 -10.997   0.248  -6.234
  304    HB2  ALA  40           1HB      ALA  40 -10.466   0.633  -7.888
  305    HB3  ALA  40           2HB      ALA  40 -11.508  -0.779  -7.594
  306    H    PHE  41           H        PHE  41  -9.074  -0.139  -4.658
  307    HA   PHE  41           HA       PHE  41  -7.105   1.853  -5.096
  308    HB2  PHE  41           1HB      PHE  41  -7.680   0.104  -2.669
  309    HB3  PHE  41           2HB      PHE  41  -6.532   1.462  -2.657
  310    HD1  PHE  41           HD1      PHE  41  -8.804   2.645  -4.837
  311    HD2  PHE  41           HD2      PHE  41  -8.536   1.562  -0.714
  312    HE1  PHE  41           HE1      PHE  41 -10.651   4.202  -4.310
  313    HE2  PHE  41           HE2      PHE  41 -10.384   3.114  -0.183
  314    HZ   PHE  41           HZ       PHE  41 -11.441   4.437  -1.982
  315    H    ILE  42           H        ILE  42  -6.675  -1.597  -4.307
  316    HA   ILE  42           HA       ILE  42  -3.799  -1.508  -4.217
  317    HB   ILE  42           HB       ILE  42  -5.756  -3.761  -4.847
  318   HG12  ILE  42          1HG1      ILE  42  -5.881  -2.893  -2.607
  319   HG13  ILE  42          2HG1      ILE  42  -5.240  -4.551  -2.650
  320   HG21  ILE  42          1HG2      ILE  42  -3.837  -5.289  -4.553
  321   HG22  ILE  42          2HG2      ILE  42  -3.580  -4.199  -5.935
  322   HG23  ILE  42          3HG2      ILE  42  -2.747  -3.892  -4.393
  323   HD11  ILE  42          3HD1      ILE  42  -3.599  -2.019  -2.298
  324   HD12  ILE  42          1HD1      ILE  42  -4.024  -3.170  -1.012
  325   HD13  ILE  42          2HD1      ILE  42  -2.957  -3.678  -2.343
  326    H    ASN  43           H        ASN  43  -6.047  -1.910  -6.899
  327    HA   ASN  43           HA       ASN  43  -4.048  -2.740  -8.803
  328    HB2  ASN  43           1HB      ASN  43  -6.815  -1.454  -9.424
  329    HB3  ASN  43           2HB      ASN  43  -5.432  -2.029 -10.388
  330   HD21  ASN  43          2HD2      ASN  43  -8.224  -2.951 -10.227
  331   HD22  ASN  43          1HD2      ASN  43  -8.135  -4.638  -9.844
  332    H    ASP  44           H        ASP  44  -5.516   0.458  -8.173
  333    HA   ASP  44           HA       ASP  44  -3.843   1.925  -9.961
  334    HB2  ASP  44           1HB      ASP  44  -5.190   2.808  -7.337
  335    HB3  ASP  44           2HB      ASP  44  -4.218   3.766  -8.483
  336    H    ILE  45           H        ILE  45  -3.386   1.119  -6.518
  337    HA   ILE  45           HA       ILE  45  -0.924   2.581  -6.223
  338    HB   ILE  45           HB       ILE  45  -2.051   0.167  -4.740
  339   HG12  ILE  45          1HG1      ILE  45  -1.787   3.016  -3.831
  340   HG13  ILE  45          2HG1      ILE  45  -3.234   2.367  -4.640
  341   HG21  ILE  45          1HG2      ILE  45  -0.332   0.631  -3.025
  342   HG22  ILE  45          2HG2      ILE  45   0.415   0.196  -4.580
  343   HG23  ILE  45          3HG2      ILE  45   0.363   1.898  -4.063
  344   HD11  ILE  45          3HD1      ILE  45  -2.060   1.367  -2.020
  345   HD12  ILE  45          1HD1      ILE  45  -3.514   2.379  -2.192
  346   HD13  ILE  45          2HD1      ILE  45  -3.505   0.717  -2.830
  347    H    LEU  46           H        LEU  46  -1.542  -0.784  -7.148
  348    HA   LEU  46           HA       LEU  46   1.160  -1.592  -7.434
  349    HB2  LEU  46           1HB      LEU  46  -1.351  -2.158  -8.836
  350    HB3  LEU  46           2HB      LEU  46   0.092  -3.046  -9.384
  351    HG   LEU  46           HG       LEU  46  -1.022  -3.113  -6.555
  352   HD11  LEU  46          1HD1      LEU  46  -1.773  -5.437  -7.131
  353   HD12  LEU  46          2HD1      LEU  46  -2.564  -4.226  -8.168
  354   HD13  LEU  46          3HD1      LEU  46  -1.206  -5.189  -8.799
  355   HD21  LEU  46          3HD2      LEU  46   1.368  -3.500  -6.664
  356   HD22  LEU  46          1HD2      LEU  46   0.526  -5.014  -6.257
  357   HD23  LEU  46          2HD2      LEU  46   1.138  -4.753  -7.908
  358    H    LYS  47           H        LYS  47  -0.885   0.314  -9.600
  359    HA   LYS  47           HA       LYS  47   1.097   0.250 -11.757
  360    HB2  LYS  47           1HB      LYS  47  -1.424   1.849 -11.306
  361    HB3  LYS  47           2HB      LYS  47  -0.405   1.973 -12.760
  362    HG2  LYS  47           1HG      LYS  47  -0.819  -0.407 -13.247
  363    HG3  LYS  47           2HG      LYS  47  -1.849  -0.520 -11.800
  364    HD2  LYS  47           1HD      LYS  47  -3.364   1.177 -12.754
  365    HD3  LYS  47           2HD      LYS  47  -2.338   1.271 -14.205
  366    HE2  LYS  47           1HE      LYS  47  -2.769  -1.108 -14.660
  367    HE3  LYS  47           2HE      LYS  47  -3.806  -1.192 -13.218
  368    HZ1  LYS  47           3HZ      LYS  47  -4.296   0.499 -15.584
  369    HZ2  LYS  47           1HZ      LYS  47  -5.094  -0.898 -15.223
  370    HZ3  LYS  47           2HZ      LYS  47  -5.258   0.420 -14.247
  371    H    VAL  48           H        VAL  48   0.535   2.175  -8.950
  372    HA   VAL  48           HA       VAL  48   1.889   4.593  -9.743
  373    HB   VAL  48           HB       VAL  48   1.692   3.199  -7.040
  374   HG11  VAL  48          1HG1      VAL  48   2.399   5.370  -6.096
  375   HG12  VAL  48          2HG1      VAL  48   3.664   4.685  -7.144
  376   HG13  VAL  48          3HG1      VAL  48   2.635   6.009  -7.739
  377   HG21  VAL  48          3HG2      VAL  48  -0.454   3.890  -7.926
  378   HG22  VAL  48          1HG2      VAL  48   0.020   4.910  -6.548
  379   HG23  VAL  48          2HG2      VAL  48   0.169   5.532  -8.210
  380    H    GLU  49           H        GLU  49   3.819   5.041 -10.306
  381    HA   GLU  49           HA       GLU  49   5.836   3.007 -10.524
  382    HB2  GLU  49           1HB      GLU  49   5.661   5.012 -11.959
  383    HB3  GLU  49           2HB      GLU  49   6.135   6.014 -10.565
  384    HG2  GLU  49           1HG      GLU  49   8.379   4.822 -10.523
  385    HG3  GLU  49           2HG      GLU  49   7.736   3.850 -11.866
  386    H    GLY  50           H        GLY  50   7.285   2.242  -9.210
  387    HA2  GLY  50           1HA      GLY  50   9.074   2.678  -7.604
  388    HA3  GLY  50           2HA      GLY  50   8.022   3.879  -6.820
  389    H    VAL  51           H        VAL  51   5.661   2.064  -7.128
  390    HA   VAL  51           HA       VAL  51   5.967   0.576  -4.615
  391    HB   VAL  51           HB       VAL  51   3.729   0.605  -6.685
  392   HG11  VAL  51          1HG1      VAL  51   2.376  -0.420  -4.889
  393   HG12  VAL  51          2HG1      VAL  51   3.748  -1.462  -5.331
  394   HG13  VAL  51          3HG1      VAL  51   3.813  -0.488  -3.843
  395   HG21  VAL  51          3HG2      VAL  51   4.059   2.780  -5.669
  396   HG22  VAL  51          1HG2      VAL  51   2.555   2.031  -5.085
  397   HG23  VAL  51          2HG2      VAL  51   3.999   2.052  -4.045
  398    H    LYS  52           H        LYS  52   6.520  -1.383  -4.228
  399    HA   LYS  52           HA       LYS  52   7.242  -3.081  -6.566
  400    HB2  LYS  52           1HB      LYS  52   8.922  -2.661  -4.834
  401    HB3  LYS  52           2HB      LYS  52   7.833  -3.364  -3.614
  402    HG2  LYS  52           1HG      LYS  52   7.955  -5.540  -4.727
  403    HG3  LYS  52           2HG      LYS  52   8.996  -4.847  -5.995
  404    HD2  LYS  52           1HD      LYS  52  10.697  -4.305  -4.287
  405    HD3  LYS  52           2HD      LYS  52   9.663  -5.036  -3.037
  406    HE2  LYS  52           1HE      LYS  52   9.801  -7.201  -4.147
  407    HE3  LYS  52           2HE      LYS  52  10.761  -6.487  -5.464
  408    HZ1  LYS  52           3HZ      LYS  52  11.588  -6.658  -2.637
  409    HZ2  LYS  52           1HZ      LYS  52  12.149  -7.613  -3.859
  410    HZ3  LYS  52           2HZ      LYS  52  12.480  -5.997  -3.858
  411    H    SER  53           H        SER  53   5.626  -3.515  -3.401
  412    HA   SER  53           HA       SER  53   3.478  -5.145  -4.668
  413    HB2  SER  53           1HB      SER  53   3.847  -7.121  -3.607
  414    HB3  SER  53           2HB      SER  53   5.285  -6.699  -4.564
  415    HG   SER  53           HG       SER  53   6.075  -5.825  -2.459
  416    H    ILE  54           H        ILE  54   1.785  -5.604  -3.208
  417    HA   ILE  54           HA       ILE  54   1.943  -4.190  -0.558
  418    HB   ILE  54           HB       ILE  54  -0.470  -4.378  -2.418
  419   HG12  ILE  54          1HG1      ILE  54  -0.030  -1.748  -2.096
  420   HG13  ILE  54          2HG1      ILE  54   1.638  -2.363  -2.086
  421   HG21  ILE  54          1HG2      ILE  54  -1.526  -2.864  -0.774
  422   HG22  ILE  54          2HG2      ILE  54  -1.043  -4.398  -0.013
  423   HG23  ILE  54          3HG2      ILE  54  -0.061  -2.934   0.232
  424   HD11  ILE  54          3HD1      ILE  54  -0.426  -2.855  -4.261
  425   HD12  ILE  54          1HD1      ILE  54   0.938  -1.721  -4.360
  426   HD13  ILE  54          2HD1      ILE  54   1.242  -3.471  -4.251
  427    H    PHE  55           H        PHE  55   1.562  -5.295   1.150
  428    HA   PHE  55           HA       PHE  55  -0.040  -7.820   0.850
  429    HB2  PHE  55           1HB      PHE  55   2.250  -8.324   1.558
  430    HB3  PHE  55           2HB      PHE  55   2.140  -7.123   2.864
  431    HD1  PHE  55           HD1      PHE  55   0.551 -10.255   1.623
  432    HD2  PHE  55           HD2      PHE  55   1.486  -7.760   4.962
  433    HE1  PHE  55           HE1      PHE  55  -0.280 -12.004   3.160
  434    HE2  PHE  55           HE2      PHE  55   0.659  -9.507   6.504
  435    HZ   PHE  55           HZ       PHE  55  -0.226 -11.630   5.601
  436    H    HIS  56           H        HIS  56  -1.889  -7.987   1.837
  437    HA   HIS  56           HA       HIS  56  -2.548  -5.936   3.922
  438    HB2  HIS  56           1HB      HIS  56  -4.061  -5.696   2.057
  439    HB3  HIS  56           2HB      HIS  56  -4.322  -7.454   1.964
  440    HD2  HIS  56           HD2      HIS  56  -5.695  -4.334   4.014
  441    HE1  HIS  56           HE1      HIS  56  -7.748  -7.875   5.150
  442    HE2  HIS  56           HE2      HIS  56  -7.618  -5.255   5.321
  443    H    VAL  57           H        VAL  57  -3.066  -6.498   5.903
  444    HA   VAL  57           HA       VAL  57  -4.234  -9.162   6.453
  445    HB   VAL  57           HB       VAL  57  -1.809  -9.643   6.648
  446   HG11  VAL  57          1HG1      VAL  57  -0.478  -8.488   8.382
  447   HG12  VAL  57          2HG1      VAL  57  -1.033  -7.347   7.135
  448   HG13  VAL  57          3HG1      VAL  57  -1.851  -7.406   8.715
  449   HG21  VAL  57          3HG2      VAL  57  -3.368 -10.783   8.110
  450   HG22  VAL  57          1HG2      VAL  57  -1.828 -10.475   8.946
  451   HG23  VAL  57          2HG2      VAL  57  -3.250  -9.463   9.298
  452    H    MET  58           H        MET  58  -5.826  -8.989   7.757
  453    HA   MET  58           HA       MET  58  -7.196  -8.182   9.455
  454    HB2  MET  58           1HB      MET  58  -4.474  -7.410  10.492
  455    HB3  MET  58           2HB      MET  58  -5.979  -7.160  11.411
  456    HG2  MET  58           1HG      MET  58  -6.407  -9.562  11.407
  457    HG3  MET  58           2HG      MET  58  -4.951  -9.839  10.423
  458    HE1  MET  58           3HE      MET  58  -4.042 -11.640  12.145
  459    HE2  MET  58           1HE      MET  58  -3.901 -11.351  13.895
  460    HE3  MET  58           2HE      MET  58  -5.508 -11.419  13.132
  461    H    ASP  59           H        ASP  59  -5.424  -5.605  10.658
  462    HA   ASP  59           HA       ASP  59  -7.451  -3.810   9.364
  463    HB2  ASP  59           1HB      ASP  59  -7.636  -2.645  11.548
  464    HB3  ASP  59           2HB      ASP  59  -7.892  -4.406  11.594
  465    H    PHE  60           H        PHE  60  -4.534  -4.415   8.723
  466    HA   PHE  60           HA       PHE  60  -3.934  -1.578   8.161
  467    HB2  PHE  60           1HB      PHE  60  -1.673  -1.652   9.047
  468    HB3  PHE  60           2HB      PHE  60  -2.792  -2.074  10.363
  469    HD1  PHE  60           HD1      PHE  60  -0.132  -3.238   8.167
  470    HD2  PHE  60           HD2      PHE  60  -2.926  -4.340  11.206
  471    HE1  PHE  60           HE1      PHE  60   1.146  -5.312   8.590
  472    HE2  PHE  60           HE2      PHE  60  -1.649  -6.412  11.632
  473    HZ   PHE  60           HZ       PHE  60   0.387  -6.900  10.322
  474    H    ILE  61           H        ILE  61  -2.262  -1.279   6.590
  475    HA   ILE  61           HA       ILE  61  -1.819  -3.723   4.891
  476    HB   ILE  61           HB       ILE  61  -2.332  -0.850   3.991
  477   HG12  ILE  61          1HG1      ILE  61  -3.973  -3.313   3.478
  478   HG13  ILE  61          2HG1      ILE  61  -4.298  -2.142   4.777
  479   HG21  ILE  61          1HG2      ILE  61  -2.189  -1.784   1.708
  480   HG22  ILE  61          2HG2      ILE  61  -0.660  -2.009   2.587
  481   HG23  ILE  61          3HG2      ILE  61  -1.778  -3.377   2.385
  482   HD11  ILE  61          3HD1      ILE  61  -4.269  -1.534   1.800
  483   HD12  ILE  61          1HD1      ILE  61  -5.720  -1.709   2.813
  484   HD13  ILE  61          2HD1      ILE  61  -4.593  -0.362   3.099
  485    H    SER  62           H        SER  62   0.109  -4.206   4.248
  486    HA   SER  62           HA       SER  62   2.377  -2.365   5.021
  487    HB2  SER  62           1HB      SER  62   2.450  -4.450   6.038
  488    HB3  SER  62           2HB      SER  62   2.339  -5.269   4.462
  489    HG   SER  62           HG       SER  62   4.489  -5.096   5.134
  490    H    VAL  63           H        VAL  63   2.858  -1.033   3.351
  491    HA   VAL  63           HA       VAL  63   2.983  -2.207   0.577
  492    HB   VAL  63           HB       VAL  63   2.785   0.705   1.450
  493   HG11  VAL  63          1HG1      VAL  63   2.468   1.132  -0.963
  494   HG12  VAL  63          2HG1      VAL  63   4.045   0.371  -0.649
  495   HG13  VAL  63          3HG1      VAL  63   2.703  -0.599  -1.301
  496   HG21  VAL  63          3HG2      VAL  63   0.705  -0.463   1.871
  497   HG22  VAL  63          1HG2      VAL  63   0.538   0.650   0.491
  498   HG23  VAL  63          2HG2      VAL  63   0.704  -1.099   0.209
  499    H    ASP  64           H        ASP  64   4.798  -2.557  -0.339
  500    HA   ASP  64           HA       ASP  64   7.226  -1.231   0.827
  501    HB2  ASP  64           1HB      ASP  64   8.474  -3.348   0.346
  502    HB3  ASP  64           2HB      ASP  64   7.058  -3.473   1.419
  503    H    LYS  65           H        LYS  65   8.872  -0.612  -0.509
  504    HA   LYS  65           HA       LYS  65   7.959  -0.220  -3.341
  505    HB2  LYS  65           1HB      LYS  65   9.141   1.837  -3.351
  506    HB3  LYS  65           2HB      LYS  65   8.065   1.808  -1.933
  507    HG2  LYS  65           1HG      LYS  65   9.949   1.321  -0.468
  508    HG3  LYS  65           2HG      LYS  65  11.046   1.232  -1.867
  509    HD2  LYS  65           1HD      LYS  65  10.701   3.580  -2.355
  510    HD3  LYS  65           2HD      LYS  65   9.459   3.699  -1.086
  511    HE2  LYS  65           1HE      LYS  65  11.456   4.624  -0.175
  512    HE3  LYS  65           2HE      LYS  65  11.232   3.028   0.575
  513    HZ1  LYS  65           3HZ      LYS  65  13.045   3.625  -1.674
  514    HZ2  LYS  65           1HZ      LYS  65  13.507   3.378  -0.109
  515    HZ3  LYS  65           2HZ      LYS  65  12.839   2.143  -0.977
  516    H    GLU  66           H        GLU  66   9.902   0.408  -4.786
  517    HA   GLU  66           HA       GLU  66  11.930  -1.730  -4.567
  518    HB2  GLU  66           1HB      GLU  66  11.506   0.483  -6.581
  519    HB3  GLU  66           2HB      GLU  66  12.754  -0.782  -6.689
  520    HG2  GLU  66           1HG      GLU  66  10.836  -2.512  -6.766
  521    HG3  GLU  66           2HG      GLU  66   9.782  -1.080  -6.760
  522    H    ASN  67           H        ASN  67  14.217  -1.251  -4.879
  523    HA   ASN  67           HA       ASN  67  15.096   0.376  -2.678
  524    HB2  ASN  67           1HB      ASN  67  16.874  -0.910  -4.887
  525    HB3  ASN  67           2HB      ASN  67  17.161   0.118  -3.462
  526   HD21  ASN  67          2HD2      ASN  67  17.961  -2.659  -4.130
  527   HD22  ASN  67          1HD2      ASN  67  17.417  -3.620  -2.795
  528    H    ASP  68           H        ASP  68  15.039   0.927  -6.179
  529    HA   ASP  68           HA       ASP  68  16.487   3.432  -6.051
  530    HB2  ASP  68           1HB      ASP  68  14.612   2.290  -8.209
  531    HB3  ASP  68           2HB      ASP  68  15.483   3.843  -8.182
  532    H    ALA  69           H        ALA  69  13.060   2.566  -5.892
  533    HA   ALA  69           HA       ALA  69  12.080   5.238  -6.221
  534    HB1  ALA  69           3HB      ALA  69  10.812   2.857  -4.827
  535    HB2  ALA  69           1HB      ALA  69   9.969   4.342  -5.320
  536    HB3  ALA  69           2HB      ALA  69  10.663   3.263  -6.552
  537    H    ASN  70           H        ASN  70  11.047   6.600  -4.663
  538    HA   ASN  70           HA       ASN  70  11.986   6.182  -1.846
  539    HB2  ASN  70           1HB      ASN  70  11.885   9.010  -3.134
  540    HB3  ASN  70           2HB      ASN  70  12.117   8.303  -1.516
  541   HD21  ASN  70          2HD2      ASN  70  13.513   8.950  -4.605
  542   HD22  ASN  70          1HD2      ASN  70  15.130   8.451  -4.227
  543    H    TRP  71           H        TRP  71  10.657   6.877  -0.199
  544    HA   TRP  71           HA       TRP  71   7.838   6.502  -0.769
  545    HB2  TRP  71           1HB      TRP  71   9.418   7.225   1.723
  546    HB3  TRP  71           2HB      TRP  71   7.639   7.162   1.715
  547    HD1  TRP  71           HD1      TRP  71  10.245   5.257   2.771
  548    HE1  TRP  71           HE1      TRP  71   9.740   2.602   2.761
  549    HE3  TRP  71           HE3      TRP  71   6.223   5.288  -0.336
  550    HZ2  TRP  71           HZ2      TRP  71   7.871   0.960   1.559
  551    HZ3  TRP  71           HZ3      TRP  71   5.109   3.218  -0.900
  552    HH2  TRP  71           HH2      TRP  71   5.867   1.061   0.000
  553    H    GLU  72           H        GLU  72   9.911   9.288  -0.437
  554    HA   GLU  72           HA       GLU  72   7.940  11.283   0.053
  555    HB2  GLU  72           1HB      GLU  72  10.510  11.333  -1.531
  556    HB3  GLU  72           2HB      GLU  72   9.518  12.775  -1.205
  557    HG2  GLU  72           1HG      GLU  72   9.910  12.461   1.271
  558    HG3  GLU  72           2HG      GLU  72  10.767  10.968   0.821
  559    H    THR  73           H        THR  73   8.900   9.672  -2.946
  560    HA   THR  73           HA       THR  73   6.979  11.259  -4.523
  561    HB   THR  73           HB       THR  73   8.577   8.764  -5.240
  562    HG1  THR  73           HG1      THR  73   9.843  10.345  -6.398
  563   HG21  THR  73          3HG2      THR  73   7.010  10.712  -6.977
  564   HG22  THR  73          1HG2      THR  73   8.008   9.362  -7.567
  565   HG23  THR  73          2HG2      THR  73   6.541   9.035  -6.614
  566    H    VAL  74           H        VAL  74   7.183   7.950  -3.209
  567    HA   VAL  74           HA       VAL  74   4.915   7.027  -4.793
  568    HB   VAL  74           HB       VAL  74   6.343   5.838  -2.380
  569   HG11  VAL  74          1HG1      VAL  74   5.153   3.749  -2.953
  570   HG12  VAL  74          2HG1      VAL  74   4.007   5.039  -2.515
  571   HG13  VAL  74          3HG1      VAL  74   4.254   4.611  -4.225
  572   HG21  VAL  74          3HG2      VAL  74   7.739   5.993  -4.355
  573   HG22  VAL  74          1HG2      VAL  74   7.308   4.301  -4.017
  574   HG23  VAL  74          2HG2      VAL  74   6.487   5.182  -5.327
  575    H    LEU  75           H        LEU  75   5.255   8.046  -1.394
  576    HA   LEU  75           HA       LEU  75   2.814   6.771  -0.609
  577    HB2  LEU  75           1HB      LEU  75   4.546   8.886   0.438
  578    HB3  LEU  75           2HB      LEU  75   3.097   8.506   1.396
  579    HG   LEU  75           HG       LEU  75   5.398   6.630   0.726
  580   HD11  LEU  75          1HD1      LEU  75   5.731   6.612   3.213
  581   HD12  LEU  75          2HD1      LEU  75   5.881   8.258   2.552
  582   HD13  LEU  75          3HD1      LEU  75   4.387   7.764   3.386
  583   HD21  LEU  75          3HD2      LEU  75   3.290   5.433   0.666
  584   HD22  LEU  75          1HD2      LEU  75   4.214   4.964   2.113
  585   HD23  LEU  75          2HD2      LEU  75   2.840   6.087   2.259
  586    HA   PRO  76           HA       PRO  76   0.975  11.354  -1.001
  587    HB2  PRO  76           2HB      PRO  76   1.952  13.016  -2.438
  588    HB3  PRO  76           1HB      PRO  76   2.573  11.812  -3.575
  589    HG2  PRO  76           1HG      PRO  76   4.533  12.414  -2.365
  590    HG3  PRO  76           2HG      PRO  76   3.657  12.584  -0.838
  591    HD2  PRO  76           1HD      PRO  76   4.562  10.045  -2.239
  592    HD3  PRO  76           2HD      PRO  76   4.495  10.395  -0.508
  593    H    LYS  77           H        LYS  77   2.018   9.384  -3.785
  594    HA   LYS  77           HA       LYS  77  -0.566   9.641  -5.103
  595    HB2  LYS  77           1HB      LYS  77   1.757   7.745  -5.460
  596    HB3  LYS  77           2HB      LYS  77   0.296   7.739  -6.477
  597    HG2  LYS  77           1HG      LYS  77   0.781  10.047  -7.189
  598    HG3  LYS  77           2HG      LYS  77   2.244  10.051  -6.174
  599    HD2  LYS  77           1HD      LYS  77   3.180   8.208  -7.495
  600    HD3  LYS  77           2HD      LYS  77   1.709   8.165  -8.495
  601    HE2  LYS  77           1HE      LYS  77   2.148  10.484  -9.217
  602    HE3  LYS  77           2HE      LYS  77   3.635  10.496  -8.243
  603    HZ1  LYS  77           3HZ      LYS  77   3.092   8.700 -10.519
  604    HZ2  LYS  77           1HZ      LYS  77   4.087  10.017 -10.551
  605    HZ3  LYS  77           2HZ      LYS  77   4.472   8.713  -9.616
  606    H    VAL  78           H        VAL  78   0.970   7.138  -3.097
  607    HA   VAL  78           HA       VAL  78  -1.094   5.159  -3.401
  608    HB   VAL  78           HB       VAL  78   0.842   5.697  -1.113
  609   HG11  VAL  78          1HG1      VAL  78   0.292   3.405  -0.370
  610   HG12  VAL  78          2HG1      VAL  78  -1.144   4.455  -0.325
  611   HG13  VAL  78          3HG1      VAL  78  -0.938   3.285  -1.651
  612   HG21  VAL  78          3HG2      VAL  78   1.939   5.132  -3.198
  613   HG22  VAL  78          1HG2      VAL  78   2.073   3.796  -2.030
  614   HG23  VAL  78          2HG2      VAL  78   0.907   3.691  -3.371
  615    H    GLU  79           H        GLU  79  -0.627   7.498  -0.743
  616    HA   GLU  79           HA       GLU  79  -3.067   6.856   0.587
  617    HB2  GLU  79           1HB      GLU  79  -1.090   8.247   1.395
  618    HB3  GLU  79           2HB      GLU  79  -1.812   9.593   0.478
  619    HG2  GLU  79           1HG      GLU  79  -3.942   9.270   1.916
  620    HG3  GLU  79           2HG      GLU  79  -2.957   8.063   2.771
  621    H    ALA  80           H        ALA  80  -2.380   9.160  -2.018
  622    HA   ALA  80           HA       ALA  80  -4.919  10.395  -2.137
  623    HB1  ALA  80           3HB      ALA  80  -3.049   9.675  -4.421
  624    HB2  ALA  80           1HB      ALA  80  -4.385  10.846  -4.500
  625    HB3  ALA  80           2HB      ALA  80  -2.989  11.162  -3.444
  626    H    VAL  81           H        VAL  81  -3.808   7.338  -3.571
  627    HA   VAL  81           HA       VAL  81  -6.260   6.679  -4.938
  628    HB   VAL  81           HB       VAL  81  -4.102   4.919  -3.706
  629   HG11  VAL  81          1HG1      VAL  81  -5.085   3.099  -5.061
  630   HG12  VAL  81          2HG1      VAL  81  -6.251   3.705  -3.861
  631   HG13  VAL  81          3HG1      VAL  81  -6.399   4.187  -5.568
  632   HG21  VAL  81          3HG2      VAL  81  -3.306   6.311  -5.521
  633   HG22  VAL  81          1HG2      VAL  81  -3.383   4.605  -6.020
  634   HG23  VAL  81          2HG2      VAL  81  -4.635   5.748  -6.562
  635    H    PHE  82           H        PHE  82  -5.173   5.929  -1.634
  636    HA   PHE  82           HA       PHE  82  -7.502   4.474  -0.867
  637    HB2  PHE  82           1HB      PHE  82  -5.576   6.197   0.747
  638    HB3  PHE  82           2HB      PHE  82  -6.856   5.199   1.471
  639    HD1  PHE  82           HD1      PHE  82  -6.713   2.778  -0.190
  640    HD2  PHE  82           HD2      PHE  82  -3.622   5.229   1.450
  641    HE1  PHE  82           HE1      PHE  82  -5.188   0.833  -0.165
  642    HE2  PHE  82           HE2      PHE  82  -2.093   3.286   1.475
  643    HZ   PHE  82           HZ       PHE  82  -2.875   1.088   0.668
  644    H    GLU  83           H        GLU  83  -6.986   7.893  -1.313
  645    HA   GLU  83           HA       GLU  83  -9.385   8.572   0.297
  646    HB2  GLU  83           1HB      GLU  83  -7.350  10.236  -1.193
  647    HB3  GLU  83           2HB      GLU  83  -8.757  10.901  -0.326
  648    HG2  GLU  83           1HG      GLU  83  -7.820   9.974   1.839
  649    HG3  GLU  83           2HG      GLU  83  -6.526   9.283   0.833
  650    H    LEU  84           H        LEU  84  -8.905   7.428  -2.725
  651    HA   LEU  84           HA       LEU  84 -10.602   9.161  -4.288
  652    HB2  LEU  84           1HB      LEU  84  -9.850   6.320  -4.397
  653    HB3  LEU  84           2HB      LEU  84 -10.816   6.994  -5.730
  654    HG   LEU  84           HG       LEU  84  -8.006   7.834  -4.917
  655   HD11  LEU  84          1HD1      LEU  84  -7.373   6.921  -7.168
  656   HD12  LEU  84          2HD1      LEU  84  -8.099   5.663  -6.140
  657   HD13  LEU  84          3HD1      LEU  84  -9.063   6.428  -7.425
  658   HD21  LEU  84          3HD2      LEU  84  -9.298   9.737  -5.684
  659   HD22  LEU  84          1HD2      LEU  84  -8.078   9.300  -6.904
  660   HD23  LEU  84          2HD2      LEU  84  -9.785   8.854  -7.150
  661    H    GLU  85           H        GLU  85 -11.244   6.690  -1.930
  662    HA   GLU  85           HA       GLU  85 -13.227   5.715  -1.200
  663    HB2  GLU  85           1HB      GLU  85 -14.385   8.289  -2.281
  664    HB3  GLU  85           2HB      GLU  85 -15.201   7.150  -1.182
  665    HG2  GLU  85           1HG      GLU  85 -13.394   7.660   0.564
  666    HG3  GLU  85           2HG      GLU  85 -12.746   8.772  -0.662
  667    H    HIS  86           H        HIS  86 -12.317   5.117  -3.886
  668    HA   HIS  86           HA       HIS  86 -14.820   4.706  -5.398
  669    HB2  HIS  86           1HB      HIS  86 -12.582   5.177  -6.522
  670    HB3  HIS  86           2HB      HIS  86 -12.058   3.564  -5.984
  671    HD1  HIS  86           HD1      HIS  86 -13.326   1.502  -7.021
  672    HD2  HIS  86           HD2      HIS  86 -14.255   5.182  -8.852
  673    HE1  HIS  86           HE1      HIS  86 -14.317   0.947  -9.185
  674    H    HIS  87           H        HIS  87 -15.807   2.790  -5.845
  675    HA   HIS  87           HA       HIS  87 -15.988   0.868  -3.776
  676    HB2  HIS  87           1HB      HIS  87 -17.656   1.214  -5.663
  677    HB3  HIS  87           2HB      HIS  87 -16.532   0.335  -6.726
  678    HD2  HIS  87           HD2      HIS  87 -19.409  -0.460  -4.204
  679    HE1  HIS  87           HE1      HIS  87 -17.342  -4.055  -5.127
  680    HE2  HIS  87           HE2      HIS  87 -19.455  -2.955  -4.015
  681    H    HIS  88           H        HIS  88 -14.990  -0.917  -3.204
  682    HA   HIS  88           HA       HIS  88 -13.158  -2.303  -5.024
  683    HB2  HIS  88           1HB      HIS  88 -11.150  -2.014  -3.632
  684    HB3  HIS  88           2HB      HIS  88 -11.721  -0.426  -4.198
  685    HD1  HIS  88           HD1      HIS  88 -13.032   1.042  -2.402
  686    HD2  HIS  88           HD2      HIS  88 -10.984  -2.273  -0.798
  687    HE1  HIS  88           HE1      HIS  88 -12.780   1.496  -0.014
  688    H    HIS  89           H        HIS  89 -12.155  -4.194  -4.030
  689    HA   HIS  89           HA       HIS  89 -13.200  -5.125  -1.466
  690    HB2  HIS  89           1HB      HIS  89 -14.489  -7.011  -2.305
  691    HB3  HIS  89           2HB      HIS  89 -15.150  -5.528  -3.035
  692    HD1  HIS  89           HD1      HIS  89 -13.194  -8.635  -3.848
  693    HD2  HIS  89           HD2      HIS  89 -14.995  -5.427  -5.904
  694    HE1  HIS  89           HE1      HIS  89 -13.077  -9.205  -6.222
  695    H    HIS  90           H        HIS  90 -12.503  -7.342  -0.964
  696    HA   HIS  90           HA       HIS  90  -9.809  -7.809  -2.158
  697    HB2  HIS  90           1HB      HIS  90 -11.073  -8.862   0.414
  698    HB3  HIS  90           2HB      HIS  90  -9.422  -9.221  -0.148
  699    HD1  HIS  90           HD1      HIS  90  -7.737  -7.175  -0.215
  700    HD2  HIS  90           HD2      HIS  90 -11.341  -6.389   1.822
  701    HE1  HIS  90           HE1      HIS  90  -7.309  -5.217   1.181
  702    H    HIS  91           H        HIS  91  -9.126 -10.167  -2.141
  703    HA   HIS  91           HA       HIS  91 -10.661 -11.531  -4.118
  704    HB2  HIS  91           1HB      HIS  91  -8.177 -11.863  -3.595
  705    HB3  HIS  91           2HB      HIS  91  -8.692 -12.848  -2.205
  706    HD1  HIS  91           HD1      HIS  91 -10.266 -14.971  -2.877
  707    HD2  HIS  91           HD2      HIS  91  -7.987 -13.313  -6.011
  708    HE1  HIS  91           HE1      HIS  91 -10.103 -16.709  -4.586
  Start of MODEL   20
    1    H1   MET   1           1H       MET   1 -12.801   1.032   1.536
    2    H2   MET   1           2H       MET   1 -12.976   0.705   2.989
    3    H3   MET   1           3H       MET   1 -13.142   2.117   2.512
    4    HA   MET   1           HA       MET   1 -10.717   1.017   3.493
    5    HB2  MET   1           1HB      MET   1 -10.481   0.172   1.208
    6    HB3  MET   1           2HB      MET   1 -10.624   1.835   0.587
    7    HG2  MET   1           1HG      MET   1  -8.292   1.163   0.599
    8    HG3  MET   1           2HG      MET   1  -8.564   2.447   1.802
    9    HE1  MET   1           3HE      MET   1  -7.692  -1.299   1.153
   10    HE2  MET   1           1HE      MET   1  -7.846  -2.026   2.771
   11    HE3  MET   1           2HE      MET   1  -9.296  -1.457   1.908
   12    H    LYS   2           H        LYS   2 -10.043   2.505   4.794
   13    HA   LYS   2           HA       LYS   2  -9.575   5.236   3.799
   14    HB2  LYS   2           1HB      LYS   2 -11.978   5.151   4.559
   15    HB3  LYS   2           2HB      LYS   2 -11.361   4.806   6.193
   16    HG2  LYS   2           1HG      LYS   2 -10.160   6.950   6.200
   17    HG3  LYS   2           2HG      LYS   2 -10.757   7.295   4.559
   18    HD2  LYS   2           1HD      LYS   2 -13.101   7.105   5.476
   19    HD3  LYS   2           2HD      LYS   2 -12.385   7.022   7.103
   20    HE2  LYS   2           1HE      LYS   2 -13.087   9.303   6.604
   21    HE3  LYS   2           2HE      LYS   2 -11.316   9.208   6.745
   22    HZ1  LYS   2           3HZ      LYS   2 -12.833   9.259   4.215
   23    HZ2  LYS   2           1HZ      LYS   2 -11.987  10.524   4.853
   24    HZ3  LYS   2           2HZ      LYS   2 -11.190   9.170   4.346
   25    H    ILE   3           H        ILE   3  -8.038   6.330   4.877
   26    HA   ILE   3           HA       ILE   3  -6.480   4.637   6.794
   27    HB   ILE   3           HB       ILE   3  -5.693   7.055   5.103
   28   HG12  ILE   3          1HG1      ILE   3  -4.878   4.167   4.910
   29   HG13  ILE   3          2HG1      ILE   3  -6.049   4.996   3.856
   30   HG21  ILE   3          1HG2      ILE   3  -3.400   6.610   5.911
   31   HG22  ILE   3          2HG2      ILE   3  -4.488   7.009   7.260
   32   HG23  ILE   3          3HG2      ILE   3  -4.022   5.318   6.964
   33   HD11  ILE   3          3HD1      ILE   3  -3.103   5.689   4.132
   34   HD12  ILE   3          1HD1      ILE   3  -3.844   4.819   2.769
   35   HD13  ILE   3          2HD1      ILE   3  -4.274   6.518   3.081
   36    H    ILE   4           H        ILE   4  -6.030   5.132   8.789
   37    HA   ILE   4           HA       ILE   4  -6.991   7.754   9.849
   38    HB   ILE   4           HB       ILE   4  -5.834   5.285  11.222
   39   HG12  ILE   4          1HG1      ILE   4  -8.608   6.438  11.323
   40   HG13  ILE   4          2HG1      ILE   4  -8.104   5.078  10.293
   41   HG21  ILE   4          1HG2      ILE   4  -6.411   6.439  13.330
   42   HG22  ILE   4          2HG2      ILE   4  -5.208   7.364  12.403
   43   HG23  ILE   4          3HG2      ILE   4  -6.912   7.874  12.408
   44   HD11  ILE   4          3HD1      ILE   4  -8.014   5.136  13.330
   45   HD12  ILE   4          1HD1      ILE   4  -9.216   4.277  12.340
   46   HD13  ILE   4          2HD1      ILE   4  -7.509   3.777  12.300
   47    H    SER   5           H        SER   5  -3.982   5.838   9.850
   48    HA   SER   5           HA       SER   5  -2.414   8.343   9.409
   49    HB2  SER   5           1HB      SER   5  -1.112   8.246  11.275
   50    HB3  SER   5           2HB      SER   5  -2.819   8.381  11.757
   51    HG   SER   5           HG       SER   5  -1.661   6.851  13.006
   52    H    ILE   6           H        ILE   6  -0.251   7.908   8.838
   53    HA   ILE   6           HA       ILE   6   0.399   5.015   8.321
   54    HB   ILE   6           HB       ILE   6   1.187   7.456   6.661
   55   HG12  ILE   6          1HG1      ILE   6  -0.674   5.187   5.997
   56   HG13  ILE   6          2HG1      ILE   6  -1.157   6.846   6.425
   57   HG21  ILE   6          1HG2      ILE   6   2.163   5.783   5.125
   58   HG22  ILE   6          2HG2      ILE   6   2.925   5.699   6.730
   59   HG23  ILE   6          3HG2      ILE   6   1.717   4.483   6.256
   60   HD11  ILE   6          3HD1      ILE   6   0.496   6.043   4.006
   61   HD12  ILE   6          1HD1      ILE   6  -1.221   6.502   3.987
   62   HD13  ILE   6          2HD1      ILE   6   0.015   7.702   4.434
   63    H    SER   7           H        SER   7   2.044   4.214   9.272
   64    HA   SER   7           HA       SER   7   4.052   6.109  10.533
   65    HB2  SER   7           1HB      SER   7   4.303   4.662  12.281
   66    HB3  SER   7           2HB      SER   7   2.586   5.085  12.098
   67    HG   SER   7           HG       SER   7   3.830   2.679  11.253
   68    H    GLU   8           H        GLU   8   6.163   5.082  10.923
   69    HA   GLU   8           HA       GLU   8   7.060   3.583   8.531
   70    HB2  GLU   8           1HB      GLU   8   8.549   4.755  10.886
   71    HB3  GLU   8           2HB      GLU   8   9.302   3.934   9.496
   72    HG2  GLU   8           1HG      GLU   8   8.376   5.770   7.983
   73    HG3  GLU   8           2HG      GLU   8   7.673   6.440   9.473
   74    H    THR   9           H        THR   9   8.735   1.868   8.874
   75    HA   THR   9           HA       THR   9   7.982   0.106  11.176
   76    HB   THR   9           HB       THR   9   7.979  -1.842   9.721
   77    HG1  THR   9           HG1      THR   9   8.091  -0.289   7.386
   78   HG21  THR   9          3HG2      THR   9   6.258   0.375   8.544
   79   HG22  THR   9          1HG2      THR   9   5.983  -1.371   8.344
   80   HG23  THR   9          2HG2      THR   9   5.841  -0.625   9.953
   81    HA   PRO  10           HA       PRO  10  12.227  -0.639  11.906
   82    HB2  PRO  10           2HB      PRO  10  12.350  -2.703  13.085
   83    HB3  PRO  10           1HB      PRO  10  11.562  -3.603  11.782
   84    HG2  PRO  10           1HG      PRO  10   9.811  -3.480  13.368
   85    HG3  PRO  10           2HG      PRO  10  10.306  -1.883  13.945
   86    HD2  PRO  10           1HD      PRO  10   8.781  -2.600  11.408
   87    HD3  PRO  10           2HD      PRO  10   8.537  -1.230  12.499
   88    H    ASN  11           H        ASN  11  10.636  -2.544   9.386
   89    HA   ASN  11           HA       ASN  11  13.218  -2.700   7.913
   90    HB2  ASN  11           1HB      ASN  11  11.439  -4.752   7.913
   91    HB3  ASN  11           2HB      ASN  11  10.592  -3.423   7.083
   92   HD21  ASN  11          2HD2      ASN  11  11.451  -6.128   6.206
   93   HD22  ASN  11          1HD2      ASN  11  12.376  -5.864   4.766
   94    H    HIS  12           H        HIS  12  13.860  -1.072   6.767
   95    HA   HIS  12           HA       HIS  12  12.072   1.095   6.047
   96    HB2  HIS  12           1HB      HIS  12  14.560   1.330   6.566
   97    HB3  HIS  12           2HB      HIS  12  14.879   0.598   4.975
   98    HD2  HIS  12           HD2      HIS  12  13.680   4.090   6.480
   99    HE1  HIS  12           HE1      HIS  12  14.127   4.355   2.263
  100    HE2  HIS  12           HE2      HIS  12  13.705   5.641   4.517
  101    H    ASN  13           H        ASN  13  11.671   1.929   3.952
  102    HA   ASN  13           HA       ASN  13  11.127   1.738   1.680
  103    HB2  ASN  13           1HB      ASN  13  12.432  -1.079   1.578
  104    HB3  ASN  13           2HB      ASN  13  11.664   0.064   0.452
  105   HD21  ASN  13          2HD2      ASN  13  14.528  -0.939   1.892
  106   HD22  ASN  13          1HD2      ASN  13  15.546   0.371   1.395
  107    H    THR  14           H        THR  14   9.830   0.260   4.226
  108    HA   THR  14           HA       THR  14   7.363  -0.028   2.608
  109    HB   THR  14           HB       THR  14   8.088  -2.360   2.839
  110    HG1  THR  14           HG1      THR  14   6.224  -3.081   4.035
  111   HG21  THR  14          3HG2      THR  14   8.131  -1.776   5.827
  112   HG22  THR  14          1HG2      THR  14   8.360  -3.371   5.076
  113   HG23  THR  14          2HG2      THR  14   9.556  -2.082   4.807
  114    H    MET  15           H        MET  15   5.528   0.595   3.591
  115    HA   MET  15           HA       MET  15   5.928   1.861   6.285
  116    HB2  MET  15           1HB      MET  15   4.194   2.735   3.974
  117    HB3  MET  15           2HB      MET  15   4.278   3.514   5.573
  118    HG2  MET  15           1HG      MET  15   6.642   3.240   3.697
  119    HG3  MET  15           2HG      MET  15   5.576   4.664   3.738
  120    HE1  MET  15           3HE      MET  15   4.907   5.212   6.685
  121    HE2  MET  15           1HE      MET  15   6.266   6.238   7.205
  122    HE3  MET  15           2HE      MET  15   5.553   6.459   5.589
  123    H    LYS  16           H        LYS  16   4.201   1.950   7.716
  124    HA   LYS  16           HA       LYS  16   2.218  -0.251   7.278
  125    HB2  LYS  16           1HB      LYS  16   3.729  -0.487   9.200
  126    HB3  LYS  16           2HB      LYS  16   3.158   1.078   9.825
  127    HG2  LYS  16           1HG      LYS  16   0.875   0.142  10.028
  128    HG3  LYS  16           2HG      LYS  16   1.484  -1.428   9.456
  129    HD2  LYS  16           1HD      LYS  16   3.012  -1.538  11.386
  130    HD3  LYS  16           2HD      LYS  16   2.399   0.030  11.959
  131    HE2  LYS  16           1HE      LYS  16   0.143  -0.931  12.170
  132    HE3  LYS  16           2HE      LYS  16   0.764  -2.501  11.609
  133    HZ1  LYS  16           3HZ      LYS  16   1.611  -1.101  14.065
  134    HZ2  LYS  16           1HZ      LYS  16   0.609  -2.409  14.004
  135    HZ3  LYS  16           2HZ      LYS  16   2.186  -2.556  13.546
  136    H    ILE  17           H        ILE  17   0.226   0.225   6.846
  137    HA   ILE  17           HA       ILE  17  -0.716   3.019   7.435
  138    HB   ILE  17           HB       ILE  17  -1.645   1.052   5.291
  139   HG12  ILE  17          1HG1      ILE  17  -0.114   3.620   4.974
  140   HG13  ILE  17          2HG1      ILE  17   0.603   1.992   4.938
  141   HG21  ILE  17          1HG2      ILE  17  -2.970   2.967   4.463
  142   HG22  ILE  17          2HG2      ILE  17  -3.443   2.533   6.121
  143   HG23  ILE  17          3HG2      ILE  17  -2.408   3.951   5.834
  144   HD11  ILE  17          3HD1      ILE  17  -1.497   3.053   3.015
  145   HD12  ILE  17          1HD1      ILE  17   0.234   2.852   2.659
  146   HD13  ILE  17          2HD1      ILE  17  -0.779   1.425   2.979
  147    H    THR  18           H        THR  18  -2.009   3.261   9.017
  148    HA   THR  18           HA       THR  18  -3.619   0.979   9.985
  149    HB   THR  18           HB       THR  18  -3.416   3.856  10.970
  150    HG1  THR  18           HG1      THR  18  -2.185   2.824  12.652
  151   HG21  THR  18          3HG2      THR  18  -4.710   1.400  12.219
  152   HG22  THR  18          1HG2      THR  18  -4.554   2.999  12.987
  153   HG23  THR  18          2HG2      THR  18  -5.575   2.800  11.543
  154    H    LEU  19           H        LEU  19  -5.654   0.579   9.612
  155    HA   LEU  19           HA       LEU  19  -7.078   2.488   7.810
  156    HB2  LEU  19           1HB      LEU  19  -7.552  -0.337   8.505
  157    HB3  LEU  19           2HB      LEU  19  -8.488   0.474   7.228
  158    HG   LEU  19           HG       LEU  19  -5.528  -0.231   7.189
  159   HD11  LEU  19          1HD1      LEU  19  -6.191  -1.628   5.213
  160   HD12  LEU  19          2HD1      LEU  19  -7.076  -2.117   6.676
  161   HD13  LEU  19          3HD1      LEU  19  -7.880  -1.120   5.440
  162   HD21  LEU  19          3HD2      LEU  19  -5.863   1.947   6.183
  163   HD22  LEU  19          1HD2      LEU  19  -5.486   0.748   4.923
  164   HD23  LEU  19          2HD2      LEU  19  -7.163   1.304   5.151
  165    H    SER  20           H        SER  20  -9.306   2.884   8.051
  166    HA   SER  20           HA       SER  20 -10.127   3.402  10.830
  167    HB2  SER  20           1HB      SER  20 -11.529   3.793   8.256
  168    HB3  SER  20           2HB      SER  20 -12.096   4.281   9.869
  169    HG   SER  20           HG       SER  20 -11.004   5.964   8.765
  170    H    GLU  21           H        GLU  21 -10.711   0.944   8.362
  171    HA   GLU  21           HA       GLU  21 -13.118  -0.143   9.573
  172    HB2  GLU  21           1HB      GLU  21 -11.099  -1.300   7.647
  173    HB3  GLU  21           2HB      GLU  21 -12.610  -2.105   8.136
  174    HG2  GLU  21           1HG      GLU  21 -12.457   0.564   6.608
  175    HG3  GLU  21           2HG      GLU  21 -12.774  -1.070   5.985
  176    H    SER  22           H        SER  22 -13.427  -2.004  10.739
  177    HA   SER  22           HA       SER  22 -11.438  -2.572  12.816
  178    HB2  SER  22           1HB      SER  22 -12.953  -4.025  13.702
  179    HB3  SER  22           2HB      SER  22 -13.786  -2.531  13.210
  180    HG   SER  22           HG       SER  22 -13.737  -4.945  11.722
  181    H    ARG  23           H        ARG  23 -10.736  -4.778  13.298
  182    HA   ARG  23           HA       ARG  23  -9.355  -5.983  11.071
  183    HB2  ARG  23           1HB      ARG  23  -8.559  -7.594  12.532
  184    HB3  ARG  23           2HB      ARG  23  -8.509  -6.004  13.329
  185    HG2  ARG  23           1HG      ARG  23 -10.616  -6.622  14.536
  186    HG3  ARG  23           2HG      ARG  23 -10.475  -8.255  13.839
  187    HD2  ARG  23           1HD      ARG  23  -8.379  -8.573  14.977
  188    HD3  ARG  23           2HD      ARG  23  -8.477  -6.927  15.644
  189    HE   ARG  23           HE       ARG  23  -9.934  -9.255  16.756
  190   HH11  ARG  23          1HH1      ARG  23  -9.851  -5.776  16.551
  191   HH12  ARG  23          2HH1      ARG  23 -10.828  -5.660  18.001
  192   HH21  ARG  23          2HH2      ARG  23 -11.508  -7.578  19.071
  193   HH22  ARG  23          1HH2      ARG  23 -11.045  -9.140  18.423
  194    H    GLU  24           H        GLU  24 -12.510  -6.449  12.428
  195    HA   GLU  24           HA       GLU  24 -12.845  -9.083  11.117
  196    HB2  GLU  24           1HB      GLU  24 -14.741  -7.300  12.652
  197    HB3  GLU  24           2HB      GLU  24 -15.153  -8.898  11.985
  198    HG2  GLU  24           1HG      GLU  24 -13.377  -9.921  13.517
  199    HG3  GLU  24           2HG      GLU  24 -13.108  -8.251  14.067
  200    H    GLY  25           H        GLY  25 -13.677  -9.474   9.221
  201    HA2  GLY  25           1HA      GLY  25 -15.260  -9.123   7.469
  202    HA3  GLY  25           2HA      GLY  25 -15.405  -7.419   7.954
  203    H    MET  26           H        MET  26 -12.232  -7.795   8.136
  204    HA   MET  26           HA       MET  26 -11.805  -6.836   5.344
  205    HB2  MET  26           1HB      MET  26 -10.005  -6.769   7.765
  206    HB3  MET  26           2HB      MET  26  -9.672  -6.034   6.178
  207    HG2  MET  26           1HG      MET  26 -11.961  -5.259   8.012
  208    HG3  MET  26           2HG      MET  26 -10.409  -4.394   7.905
  209    HE1  MET  26           3HE      MET  26  -9.605  -4.190   4.984
  210    HE2  MET  26           1HE      MET  26 -10.478  -2.744   4.425
  211    HE3  MET  26           2HE      MET  26  -9.741  -2.768   6.045
  212    H    THR  27           H        THR  27 -10.018  -7.519   4.107
  213    HA   THR  27           HA       THR  27  -9.782 -10.463   4.285
  214    HB   THR  27           HB       THR  27  -8.809 -10.315   2.038
  215    HG1  THR  27           HG1      THR  27  -7.870  -8.104   2.625
  216   HG21  THR  27          3HG2      THR  27 -11.243  -8.511   2.341
  217   HG22  THR  27          1HG2      THR  27 -10.728  -9.321   0.841
  218   HG23  THR  27          2HG2      THR  27 -11.273 -10.286   2.235
  219    H    SER  28           H        SER  28  -7.721 -11.521   3.792
  220    HA   SER  28           HA       SER  28  -5.273  -9.924   4.593
  221    HB2  SER  28           1HB      SER  28  -5.917 -11.041   6.517
  222    HB3  SER  28           2HB      SER  28  -6.016 -12.588   5.643
  223    HG   SER  28           HG       SER  28  -4.020 -12.309   6.733
  224    H    ASP  29           H        ASP  29  -3.875  -9.999   2.932
  225    HA   ASP  29           HA       ASP  29  -3.483 -12.377   1.285
  226    HB2  ASP  29           1HB      ASP  29  -5.782 -11.116   0.521
  227    HB3  ASP  29           2HB      ASP  29  -4.511 -10.044  -0.118
  228    H    THR  30           H        THR  30  -1.958 -12.064  -0.434
  229    HA   THR  30           HA       THR  30  -0.297  -9.590  -0.059
  230    HB   THR  30           HB       THR  30   0.593 -12.358  -0.976
  231    HG1  THR  30           HG1      THR  30   1.736 -12.292   1.049
  232   HG21  THR  30          3HG2      THR  30   2.167  -9.807  -0.437
  233   HG22  THR  30          1HG2      THR  30   2.861 -11.388  -0.863
  234   HG23  THR  30          2HG2      THR  30   1.852 -10.516  -2.039
  235    H    TYR  31           H        TYR  31   0.052  -8.300  -1.693
  236    HA   TYR  31           HA       TYR  31  -0.891  -9.221  -4.392
  237    HB2  TYR  31           1HB      TYR  31  -1.020  -6.444  -3.201
  238    HB3  TYR  31           2HB      TYR  31  -1.571  -6.936  -4.820
  239    HD1  TYR  31           HD1      TYR  31  -2.394  -6.816  -1.269
  240    HD2  TYR  31           HD2      TYR  31  -3.573  -8.403  -5.047
  241    HE1  TYR  31           HE1      TYR  31  -4.629  -7.344  -0.341
  242    HE2  TYR  31           HE2      TYR  31  -5.808  -8.937  -4.138
  243    HH   TYR  31           HH       TYR  31  -6.685  -8.218  -0.750
  244    H    THR  32           H        THR  32   0.595  -9.360  -5.855
  245    HA   THR  32           HA       THR  32   3.019  -7.610  -5.579
  246    HB   THR  32           HB       THR  32   4.328  -9.415  -6.615
  247    HG1  THR  32           HG1      THR  32   3.298 -11.472  -6.906
  248   HG21  THR  32          3HG2      THR  32   2.704 -10.393  -4.232
  249   HG22  THR  32          1HG2      THR  32   4.279 -11.035  -4.751
  250   HG23  THR  32          2HG2      THR  32   4.152  -9.364  -4.149
  251    H    LYS  33           H        LYS  33   0.602  -9.004  -7.696
  252    HA   LYS  33           HA       LYS  33   1.617  -7.203  -9.872
  253    HB2  LYS  33           1HB      LYS  33   0.421  -9.968 -10.107
  254    HB3  LYS  33           2HB      LYS  33   0.727  -8.866 -11.471
  255    HG2  LYS  33           1HG      LYS  33   3.136  -8.924 -10.981
  256    HG3  LYS  33           2HG      LYS  33   2.834 -10.017  -9.610
  257    HD2  LYS  33           1HD      LYS  33   1.907 -11.697 -11.152
  258    HD3  LYS  33           2HD      LYS  33   2.210 -10.605 -12.524
  259    HE2  LYS  33           1HE      LYS  33   4.621 -10.647 -12.013
  260    HE3  LYS  33           2HE      LYS  33   4.308 -11.765 -10.667
  261    HZ1  LYS  33           3HZ      LYS  33   3.760 -12.314 -13.513
  262    HZ2  LYS  33           1HZ      LYS  33   5.019 -12.929 -12.643
  263    HZ3  LYS  33           2HZ      LYS  33   3.470 -13.352 -12.265
  264    H    VAL  34           H        VAL  34   0.010  -6.557 -11.441
  265    HA   VAL  34           HA       VAL  34  -2.523  -5.800 -10.097
  266    HB   VAL  34           HB       VAL  34  -1.459  -5.229 -12.894
  267   HG11  VAL  34          1HG1      VAL  34  -3.272  -3.553 -12.987
  268   HG12  VAL  34          2HG1      VAL  34  -3.927  -5.195 -12.788
  269   HG13  VAL  34          3HG1      VAL  34  -3.853  -4.091 -11.393
  270   HG21  VAL  34          3HG2      VAL  34  -0.107  -4.185 -11.176
  271   HG22  VAL  34          1HG2      VAL  34  -1.065  -2.969 -12.055
  272   HG23  VAL  34          2HG2      VAL  34  -1.564  -3.488 -10.428
  273    H    ASP  35           H        ASP  35  -4.469  -6.530 -10.380
  274    HA   ASP  35           HA       ASP  35  -5.135  -8.341 -12.585
  275    HB2  ASP  35           1HB      ASP  35  -3.855  -9.776 -10.735
  276    HB3  ASP  35           2HB      ASP  35  -5.327  -9.342  -9.833
  277    H    ASP  36           H        ASP  36  -7.273  -8.608 -12.904
  278    HA   ASP  36           HA       ASP  36  -8.920  -6.482 -11.904
  279    HB2  ASP  36           1HB      ASP  36  -9.668  -9.031 -13.455
  280    HB3  ASP  36           2HB      ASP  36 -10.724  -7.715 -12.885
  281    H    SER  37           H        SER  37  -8.393  -9.757 -10.808
  282    HA   SER  37           HA       SER  37 -10.816 -10.051  -9.211
  283    HB2  SER  37           1HB      SER  37  -9.844 -11.904  -8.295
  284    HB3  SER  37           2HB      SER  37  -9.553 -11.881 -10.050
  285    HG   SER  37           HG       SER  37  -7.446 -11.320  -9.676
  286    H    GLN  38           H        GLN  38  -7.895  -8.227  -8.841
  287    HA   GLN  38           HA       GLN  38  -8.017  -8.214  -5.888
  288    HB2  GLN  38           1HB      GLN  38  -6.326  -6.602  -7.810
  289    HB3  GLN  38           2HB      GLN  38  -6.120  -6.704  -6.046
  290    HG2  GLN  38           1HG      GLN  38  -5.401  -9.247  -6.372
  291    HG3  GLN  38           2HG      GLN  38  -6.007  -8.837  -7.994
  292   HE21  GLN  38          2HE2      GLN  38  -3.429  -9.955  -7.297
  293   HE22  GLN  38          1HE2      GLN  38  -2.228  -8.816  -7.811
  294    HA   PRO  39           HA       PRO  39 -10.466  -4.644  -5.213
  295    HB2  PRO  39           2HB      PRO  39  -9.850  -3.832  -3.065
  296    HB3  PRO  39           1HB      PRO  39  -8.159  -3.600  -3.533
  297    HG2  PRO  39           1HG      PRO  39  -7.990  -5.539  -2.187
  298    HG3  PRO  39           2HG      PRO  39  -9.574  -6.149  -2.685
  299    HD2  PRO  39           1HD      PRO  39  -6.938  -6.229  -4.211
  300    HD3  PRO  39           2HD      PRO  39  -8.192  -7.471  -4.096
  301    H    ALA  40           H        ALA  40 -10.797  -2.678  -5.988
  302    HA   ALA  40           HA       ALA  40  -9.237  -1.733  -8.132
  303    HB1  ALA  40           3HB      ALA  40 -11.069  -0.154  -6.294
  304    HB2  ALA  40           1HB      ALA  40 -10.498   0.371  -7.895
  305    HB3  ALA  40           2HB      ALA  40 -11.562  -1.047  -7.753
  306    H    PHE  41           H        PHE  41  -9.223  -0.639  -4.732
  307    HA   PHE  41           HA       PHE  41  -7.256   1.435  -5.243
  308    HB2  PHE  41           1HB      PHE  41  -7.111   1.210  -2.595
  309    HB3  PHE  41           2HB      PHE  41  -8.543   1.929  -3.367
  310    HD1  PHE  41           HD1      PHE  41  -7.191  -1.103  -1.763
  311    HD2  PHE  41           HD2      PHE  41 -10.658   0.926  -3.214
  312    HE1  PHE  41           HE1      PHE  41  -8.633  -2.754  -0.619
  313    HE2  PHE  41           HE2      PHE  41 -12.104  -0.720  -2.070
  314    HZ   PHE  41           HZ       PHE  41 -11.090  -2.562  -0.772
  315    H    ILE  42           H        ILE  42  -7.016  -1.934  -4.915
  316    HA   ILE  42           HA       ILE  42  -4.145  -1.829  -4.156
  317    HB   ILE  42           HB       ILE  42  -5.986  -4.104  -5.021
  318   HG12  ILE  42          1HG1      ILE  42  -6.444  -3.262  -2.823
  319   HG13  ILE  42          2HG1      ILE  42  -5.743  -4.897  -2.772
  320   HG21  ILE  42          1HG2      ILE  42  -4.098  -5.598  -4.470
  321   HG22  ILE  42          2HG2      ILE  42  -3.674  -4.499  -5.803
  322   HG23  ILE  42          3HG2      ILE  42  -3.066  -4.181  -4.160
  323   HD11  ILE  42          3HD1      ILE  42  -4.258  -2.307  -2.205
  324   HD12  ILE  42          1HD1      ILE  42  -4.816  -3.475  -0.987
  325   HD13  ILE  42          2HD1      ILE  42  -3.557  -3.942  -2.155
  326    H    ASN  43           H        ASN  43  -6.107  -2.424  -7.046
  327    HA   ASN  43           HA       ASN  43  -3.847  -3.004  -8.742
  328    HB2  ASN  43           1HB      ASN  43  -6.701  -2.100  -9.591
  329    HB3  ASN  43           2HB      ASN  43  -5.172  -2.389 -10.456
  330   HD21  ASN  43          2HD2      ASN  43  -7.906  -3.735 -10.294
  331   HD22  ASN  43          1HD2      ASN  43  -7.526  -5.412 -10.087
  332    H    ASP  44           H        ASP  44  -5.607  -0.004  -8.018
  333    HA   ASP  44           HA       ASP  44  -4.375   1.635  -9.978
  334    HB2  ASP  44           1HB      ASP  44  -5.438   2.373  -7.185
  335    HB3  ASP  44           2HB      ASP  44  -4.750   3.434  -8.438
  336    H    ILE  45           H        ILE  45  -3.320   0.917  -6.652
  337    HA   ILE  45           HA       ILE  45  -0.977   2.651  -6.850
  338    HB   ILE  45           HB       ILE  45  -1.721   0.420  -4.905
  339   HG12  ILE  45          1HG1      ILE  45  -1.677   3.390  -4.472
  340   HG13  ILE  45          2HG1      ILE  45  -3.121   2.481  -4.968
  341   HG21  ILE  45          1HG2      ILE  45   0.113   1.297  -3.499
  342   HG22  ILE  45          2HG2      ILE  45   0.730   0.694  -5.054
  343   HG23  ILE  45          3HG2      ILE  45   0.552   2.444  -4.786
  344   HD11  ILE  45          3HD1      ILE  45  -1.542   2.048  -2.410
  345   HD12  ILE  45          1HD1      ILE  45  -3.112   2.873  -2.537
  346   HD13  ILE  45          2HD1      ILE  45  -2.986   1.138  -2.907
  347    H    LEU  46           H        LEU  46  -1.507  -0.835  -7.205
  348    HA   LEU  46           HA       LEU  46   1.216  -1.600  -7.264
  349    HB2  LEU  46           1HB      LEU  46  -1.250  -2.559  -8.516
  350    HB3  LEU  46           2HB      LEU  46   0.223  -3.500  -8.843
  351    HG   LEU  46           HG       LEU  46  -0.959  -2.962  -6.091
  352   HD11  LEU  46          1HD1      LEU  46  -1.540  -5.402  -6.116
  353   HD12  LEU  46          2HD1      LEU  46  -2.362  -4.527  -7.429
  354   HD13  LEU  46          3HD1      LEU  46  -0.924  -5.516  -7.781
  355   HD21  LEU  46          3HD2      LEU  46   1.454  -3.197  -6.046
  356   HD22  LEU  46          1HD2      LEU  46   0.691  -4.627  -5.312
  357   HD23  LEU  46          2HD2      LEU  46   1.352  -4.718  -6.963
  358    H    LYS  47           H        LYS  47  -0.841  -0.378  -9.883
  359    HA   LYS  47           HA       LYS  47   1.143  -1.022 -11.928
  360    HB2  LYS  47           1HB      LYS  47  -0.355  -0.062 -13.459
  361    HB3  LYS  47           2HB      LYS  47  -1.333  -0.957 -12.273
  362    HG2  LYS  47           1HG      LYS  47  -1.932   1.123 -11.147
  363    HG3  LYS  47           2HG      LYS  47  -0.888   2.046 -12.255
  364    HD2  LYS  47           1HD      LYS  47  -2.285   1.288 -14.161
  365    HD3  LYS  47           2HD      LYS  47  -3.352   0.444 -13.016
  366    HE2  LYS  47           1HE      LYS  47  -3.897   2.559 -11.926
  367    HE3  LYS  47           2HE      LYS  47  -2.783   3.423 -13.010
  368    HZ1  LYS  47           3HZ      LYS  47  -5.210   1.970 -13.849
  369    HZ2  LYS  47           1HZ      LYS  47  -5.062   3.610 -13.744
  370    HZ3  LYS  47           2HZ      LYS  47  -4.176   2.772 -14.855
  371    H    VAL  48           H        VAL  48   0.776   1.509  -9.689
  372    HA   VAL  48           HA       VAL  48   2.173   3.579 -11.219
  373    HB   VAL  48           HB       VAL  48   1.833   3.173  -8.219
  374   HG11  VAL  48          1HG1      VAL  48   2.498   5.549  -8.056
  375   HG12  VAL  48          2HG1      VAL  48   3.800   4.566  -8.769
  376   HG13  VAL  48          3HG1      VAL  48   2.783   5.589  -9.813
  377   HG21  VAL  48          3HG2      VAL  48  -0.287   3.484  -9.348
  378   HG22  VAL  48          1HG2      VAL  48   0.136   4.923  -8.391
  379   HG23  VAL  48          2HG2      VAL  48   0.337   4.939 -10.161
  380    H    GLU  49           H        GLU  49   4.149   3.741 -11.779
  381    HA   GLU  49           HA       GLU  49   6.106   1.745 -11.218
  382    HB2  GLU  49           1HB      GLU  49   6.148   3.309 -13.128
  383    HB3  GLU  49           2HB      GLU  49   6.523   4.635 -12.000
  384    HG2  GLU  49           1HG      GLU  49   8.706   3.468 -11.418
  385    HG3  GLU  49           2HG      GLU  49   8.161   2.191 -12.529
  386    H    GLY  50           H        GLY  50   7.370   1.314  -9.600
  387    HA2  GLY  50           1HA      GLY  50   9.054   2.194  -8.025
  388    HA3  GLY  50           2HA      GLY  50   7.911   3.498  -7.624
  389    H    VAL  51           H        VAL  51   5.738   1.291  -7.864
  390    HA   VAL  51           HA       VAL  51   5.877   0.419  -5.020
  391    HB   VAL  51           HB       VAL  51   3.733   0.035  -7.150
  392   HG11  VAL  51          1HG1      VAL  51   2.311  -0.643  -5.245
  393   HG12  VAL  51          2HG1      VAL  51   3.708  -1.728  -5.419
  394   HG13  VAL  51          3HG1      VAL  51   3.702  -0.482  -4.148
  395   HG21  VAL  51          3HG2      VAL  51   4.003   2.370  -6.566
  396   HG22  VAL  51          1HG2      VAL  51   2.481   1.727  -5.909
  397   HG23  VAL  51          2HG2      VAL  51   3.879   1.972  -4.835
  398    H    LYS  52           H        LYS  52   6.438  -1.432  -4.281
  399    HA   LYS  52           HA       LYS  52   7.252  -3.502  -6.264
  400    HB2  LYS  52           1HB      LYS  52   8.877  -2.734  -4.588
  401    HB3  LYS  52           2HB      LYS  52   7.775  -3.262  -3.296
  402    HG2  LYS  52           1HG      LYS  52   7.981  -5.588  -4.053
  403    HG3  LYS  52           2HG      LYS  52   9.056  -5.071  -5.374
  404    HD2  LYS  52           1HD      LYS  52  10.679  -4.230  -3.719
  405    HD3  LYS  52           2HD      LYS  52   9.605  -4.758  -2.403
  406    HE2  LYS  52           1HE      LYS  52   9.806  -7.079  -3.149
  407    HE3  LYS  52           2HE      LYS  52  10.845  -6.567  -4.498
  408    HZ1  LYS  52           3HZ      LYS  52  11.485  -6.274  -1.633
  409    HZ2  LYS  52           1HZ      LYS  52  12.133  -7.400  -2.649
  410    HZ3  LYS  52           2HZ      LYS  52  12.450  -5.798  -2.884
  411    H    SER  53           H        SER  53   5.557  -3.379  -3.112
  412    HA   SER  53           HA       SER  53   3.693  -5.549  -4.022
  413    HB2  SER  53           1HB      SER  53   4.182  -7.036  -2.364
  414    HB3  SER  53           2HB      SER  53   5.644  -6.717  -3.325
  415    HG   SER  53           HG       SER  53   6.054  -6.759  -1.072
  416    H    ILE  54           H        ILE  54   1.827  -5.641  -2.799
  417    HA   ILE  54           HA       ILE  54   1.682  -3.900  -0.352
  418    HB   ILE  54           HB       ILE  54  -0.514  -4.361  -2.425
  419   HG12  ILE  54          1HG1      ILE  54   0.908  -1.812  -1.706
  420   HG13  ILE  54          2HG1      ILE  54   1.292  -2.828  -3.116
  421   HG21  ILE  54          1HG2      ILE  54  -1.813  -2.779  -1.038
  422   HG22  ILE  54          2HG2      ILE  54  -1.364  -4.226  -0.107
  423   HG23  ILE  54          3HG2      ILE  54  -0.475  -2.704   0.131
  424   HD11  ILE  54          3HD1      ILE  54  -1.369  -1.462  -2.579
  425   HD12  ILE  54          1HD1      ILE  54  -0.143  -0.929  -3.752
  426   HD13  ILE  54          2HD1      ILE  54  -0.986  -2.478  -3.988
  427    H    PHE  55           H        PHE  55   1.270  -4.871   1.415
  428    HA   PHE  55           HA       PHE  55  -0.168  -7.505   1.269
  429    HB2  PHE  55           1HB      PHE  55   2.129  -7.814   2.063
  430    HB3  PHE  55           2HB      PHE  55   1.913  -6.529   3.273
  431    HD1  PHE  55           HD1      PHE  55   0.461  -9.803   2.230
  432    HD2  PHE  55           HD2      PHE  55   1.332  -7.081   5.406
  433    HE1  PHE  55           HE1      PHE  55  -0.303 -11.482   3.875
  434    HE2  PHE  55           HE2      PHE  55   0.572  -8.759   7.055
  435    HZ   PHE  55           HZ       PHE  55  -0.248 -10.960   6.288
  436    H    HIS  56           H        HIS  56  -2.053  -7.674   2.171
  437    HA   HIS  56           HA       HIS  56  -2.809  -5.640   4.244
  438    HB2  HIS  56           1HB      HIS  56  -4.172  -5.362   2.215
  439    HB3  HIS  56           2HB      HIS  56  -4.587  -7.092   2.234
  440    HD2  HIS  56           HD2      HIS  56  -4.909  -5.057   5.659
  441    HE1  HIS  56           HE1      HIS  56  -8.745  -5.942   4.062
  442    HE2  HIS  56           HE2      HIS  56  -7.373  -4.998   6.095
  443    H    VAL  57           H        VAL  57  -3.173  -6.323   6.207
  444    HA   VAL  57           HA       VAL  57  -4.660  -8.889   6.541
  445    HB   VAL  57           HB       VAL  57  -2.289  -9.491   6.977
  446   HG11  VAL  57          1HG1      VAL  57  -1.114  -8.451   8.888
  447   HG12  VAL  57          2HG1      VAL  57  -1.472  -7.250   7.626
  448   HG13  VAL  57          3HG1      VAL  57  -2.466  -7.314   9.101
  449   HG21  VAL  57          3HG2      VAL  57  -4.053 -10.597   8.215
  450   HG22  VAL  57          1HG2      VAL  57  -2.605 -10.386   9.227
  451   HG23  VAL  57          2HG2      VAL  57  -4.012  -9.320   9.452
  452    H    MET  58           H        MET  58  -6.328  -8.718   7.754
  453    HA   MET  58           HA       MET  58  -7.888  -7.762   9.195
  454    HB2  MET  58           1HB      MET  58  -5.293  -7.129  10.587
  455    HB3  MET  58           2HB      MET  58  -6.890  -6.755  11.282
  456    HG2  MET  58           1HG      MET  58  -7.473  -9.135  11.236
  457    HG3  MET  58           2HG      MET  58  -5.890  -9.516  10.520
  458    HE1  MET  58           3HE      MET  58  -3.770  -7.887  11.994
  459    HE2  MET  58           1HE      MET  58  -3.387  -8.914  13.398
  460    HE3  MET  58           2HE      MET  58  -3.671  -9.656  11.803
  461    H    ASP  59           H        ASP  59  -5.876  -5.250  10.390
  462    HA   ASP  59           HA       ASP  59  -7.716  -3.344   8.976
  463    HB2  ASP  59           1HB      ASP  59  -8.116  -2.202  11.136
  464    HB3  ASP  59           2HB      ASP  59  -8.455  -3.950  11.135
  465    H    PHE  60           H        PHE  60  -4.779  -4.135   8.698
  466    HA   PHE  60           HA       PHE  60  -3.998  -1.333   8.185
  467    HB2  PHE  60           1HB      PHE  60  -1.853  -1.485   9.300
  468    HB3  PHE  60           2HB      PHE  60  -3.105  -1.885  10.496
  469    HD1  PHE  60           HD1      PHE  60  -0.287  -3.112   8.541
  470    HD2  PHE  60           HD2      PHE  60  -3.376  -4.147  11.306
  471    HE1  PHE  60           HE1      PHE  60   0.884  -5.227   9.057
  472    HE2  PHE  60           HE2      PHE  60  -2.206  -6.261  11.826
  473    HZ   PHE  60           HZ       PHE  60  -0.076  -6.801  10.700
  474    H    ILE  61           H        ILE  61  -2.274  -1.095   6.716
  475    HA   ILE  61           HA       ILE  61  -1.746  -3.570   5.091
  476    HB   ILE  61           HB       ILE  61  -2.380  -0.749   4.108
  477   HG12  ILE  61          1HG1      ILE  61  -3.817  -3.340   3.603
  478   HG13  ILE  61          2HG1      ILE  61  -4.292  -2.129   4.815
  479   HG21  ILE  61          1HG2      ILE  61  -2.072  -1.693   1.845
  480   HG22  ILE  61          2HG2      ILE  61  -0.570  -1.798   2.791
  481   HG23  ILE  61          3HG2      ILE  61  -1.577  -3.246   2.561
  482   HD11  ILE  61          3HD1      ILE  61  -4.139  -1.677   1.815
  483   HD12  ILE  61          1HD1      ILE  61  -5.628  -1.902   2.759
  484   HD13  ILE  61          2HD1      ILE  61  -4.614  -0.465   3.027
  485    H    SER  62           H        SER  62   0.217  -4.033   4.579
  486    HA   SER  62           HA       SER  62   2.407  -2.072   5.247
  487    HB2  SER  62           1HB      SER  62   2.581  -4.126   6.306
  488    HB3  SER  62           2HB      SER  62   2.471  -4.988   4.754
  489    HG   SER  62           HG       SER  62   4.632  -4.681   5.465
  490    H    VAL  63           H        VAL  63   2.952  -0.792   3.575
  491    HA   VAL  63           HA       VAL  63   2.844  -1.929   0.784
  492    HB   VAL  63           HB       VAL  63   2.784   0.970   1.722
  493   HG11  VAL  63          1HG1      VAL  63   2.331   1.460  -0.658
  494   HG12  VAL  63          2HG1      VAL  63   3.905   0.656  -0.459
  495   HG13  VAL  63          3HG1      VAL  63   2.501  -0.267  -1.046
  496   HG21  VAL  63          3HG2      VAL  63   0.708  -0.159   2.245
  497   HG22  VAL  63          1HG2      VAL  63   0.482   0.988   0.907
  498   HG23  VAL  63          2HG2      VAL  63   0.588  -0.756   0.573
  499    H    ASP  64           H        ASP  64   4.589  -2.376  -0.220
  500    HA   ASP  64           HA       ASP  64   7.139  -1.201   0.845
  501    HB2  ASP  64           1HB      ASP  64   6.737  -3.784   1.172
  502    HB3  ASP  64           2HB      ASP  64   6.762  -3.734  -0.608
  503    H    LYS  65           H        LYS  65   8.445  -0.159  -0.448
  504    HA   LYS  65           HA       LYS  65   7.590   0.071  -3.303
  505    HB2  LYS  65           1HB      LYS  65   8.672   2.169  -3.337
  506    HB3  LYS  65           2HB      LYS  65   7.653   2.105  -1.880
  507    HG2  LYS  65           1HG      LYS  65   9.575   1.765  -0.468
  508    HG3  LYS  65           2HG      LYS  65  10.640   1.571  -1.881
  509    HD2  LYS  65           1HD      LYS  65  10.287   3.888  -2.520
  510    HD3  LYS  65           2HD      LYS  65   9.100   4.102  -1.211
  511    HE2  LYS  65           1HE      LYS  65  11.135   5.056  -0.434
  512    HE3  LYS  65           2HE      LYS  65  10.941   3.506   0.414
  513    HZ1  LYS  65           3HZ      LYS  65  12.654   3.968  -1.942
  514    HZ2  LYS  65           1HZ      LYS  65  13.183   3.805  -0.388
  515    HZ3  LYS  65           2HZ      LYS  65  12.474   2.528  -1.156
  516    H    GLU  66           H        GLU  66   9.529   0.791  -4.739
  517    HA   GLU  66           HA       GLU  66  11.558  -1.348  -4.586
  518    HB2  GLU  66           1HB      GLU  66  11.131   0.911  -6.546
  519    HB3  GLU  66           2HB      GLU  66  12.359  -0.368  -6.697
  520    HG2  GLU  66           1HG      GLU  66   9.333  -0.926  -6.669
  521    HG3  GLU  66           2HG      GLU  66  10.369  -0.650  -8.087
  522    H    ASN  67           H        ASN  67  13.839  -0.880  -4.890
  523    HA   ASN  67           HA       ASN  67  14.773   0.830  -2.766
  524    HB2  ASN  67           1HB      ASN  67  16.494  -0.560  -4.955
  525    HB3  ASN  67           2HB      ASN  67  16.816   0.529  -3.585
  526   HD21  ASN  67          2HD2      ASN  67  17.590  -2.280  -4.151
  527   HD22  ASN  67          1HD2      ASN  67  17.078  -3.179  -2.762
  528    H    ASP  68           H        ASP  68  14.655   1.214  -6.289
  529    HA   ASP  68           HA       ASP  68  16.038   3.766  -6.278
  530    HB2  ASP  68           1HB      ASP  68  14.212   2.463  -8.384
  531    HB3  ASP  68           2HB      ASP  68  15.032   4.043  -8.427
  532    H    ALA  69           H        ALA  69  12.639   2.793  -6.104
  533    HA   ALA  69           HA       ALA  69  11.562   5.405  -6.531
  534    HB1  ALA  69           3HB      ALA  69  10.401   3.052  -4.998
  535    HB2  ALA  69           1HB      ALA  69   9.496   4.480  -5.553
  536    HB3  ALA  69           2HB      ALA  69  10.214   3.365  -6.739
  537    H    ASN  70           H        ASN  70  10.553   6.842  -5.056
  538    HA   ASN  70           HA       ASN  70  11.549   6.620  -2.234
  539    HB2  ASN  70           1HB      ASN  70  11.322   9.358  -3.687
  540    HB3  ASN  70           2HB      ASN  70  11.634   8.754  -2.041
  541   HD21  ASN  70          2HD2      ASN  70  12.905   9.300  -5.194
  542   HD22  ASN  70          1HD2      ASN  70  14.545   8.857  -4.857
  543    H    TRP  71           H        TRP  71  10.245   7.434  -0.604
  544    HA   TRP  71           HA       TRP  71   7.420   6.942  -1.062
  545    HB2  TRP  71           1HB      TRP  71   9.031   7.922   1.324
  546    HB3  TRP  71           2HB      TRP  71   7.258   7.772   1.362
  547    HD1  TRP  71           HD1      TRP  71  10.031   6.074   2.434
  548    HE1  TRP  71           HE1      TRP  71   9.641   3.411   2.673
  549    HE3  TRP  71           HE3      TRP  71   5.827   5.691  -0.397
  550    HZ2  TRP  71           HZ2      TRP  71   7.775   1.603   1.732
  551    HZ3  TRP  71           HZ3      TRP  71   4.770   3.539  -0.717
  552    HH2  TRP  71           HH2      TRP  71   5.676   1.495   0.303
  553    H    GLU  72           H        GLU  72   9.435   9.763  -1.144
  554    HA   GLU  72           HA       GLU  72   7.539  11.814  -0.712
  555    HB2  GLU  72           1HB      GLU  72   9.943  12.160  -1.072
  556    HB3  GLU  72           2HB      GLU  72   9.741  11.693  -2.779
  557    HG2  GLU  72           1HG      GLU  72   8.251  13.725  -3.115
  558    HG3  GLU  72           2HG      GLU  72   8.488  14.018  -1.378
  559    H    THR  73           H        THR  73   8.116   9.873  -3.627
  560    HA   THR  73           HA       THR  73   5.867  11.218  -5.007
  561    HB   THR  73           HB       THR  73   7.618   8.868  -5.848
  562    HG1  THR  73           HG1      THR  73   8.532  10.503  -7.234
  563   HG21  THR  73          3HG2      THR  73   5.616  10.541  -7.418
  564   HG22  THR  73          1HG2      THR  73   6.667   9.274  -8.091
  565   HG23  THR  73          2HG2      THR  73   5.393   8.847  -6.924
  566    H    VAL  74           H        VAL  74   6.616   8.005  -3.643
  567    HA   VAL  74           HA       VAL  74   4.236   6.812  -4.848
  568    HB   VAL  74           HB       VAL  74   6.141   5.818  -2.687
  569   HG11  VAL  74          1HG1      VAL  74   5.125   3.603  -3.107
  570   HG12  VAL  74          2HG1      VAL  74   3.916   4.759  -2.499
  571   HG13  VAL  74          3HG1      VAL  74   3.965   4.348  -4.230
  572   HG21  VAL  74          3HG2      VAL  74   7.217   6.118  -4.838
  573   HG22  VAL  74          1HG2      VAL  74   7.034   4.390  -4.458
  574   HG23  VAL  74          2HG2      VAL  74   5.940   5.164  -5.631
  575    H    LEU  75           H        LEU  75   5.011   7.955  -1.560
  576    HA   LEU  75           HA       LEU  75   2.887   6.387  -0.409
  577    HB2  LEU  75           1HB      LEU  75   4.877   7.089   0.654
  578    HB3  LEU  75           2HB      LEU  75   4.384   8.794   0.767
  579    HG   LEU  75           HG       LEU  75   2.401   8.059   2.120
  580   HD11  LEU  75          1HD1      LEU  75   2.490   5.769   3.142
  581   HD12  LEU  75          2HD1      LEU  75   2.359   5.682   1.370
  582   HD13  LEU  75          3HD1      LEU  75   3.928   5.403   2.159
  583   HD21  LEU  75          3HD2      LEU  75   4.372   8.977   3.196
  584   HD22  LEU  75          1HD2      LEU  75   3.672   7.692   4.207
  585   HD23  LEU  75          2HD2      LEU  75   5.133   7.370   3.241
  586    HA   PRO  76           HA       PRO  76   0.578  10.736  -0.295
  587    HB2  PRO  76           2HB      PRO  76   1.214  12.603  -1.649
  588    HB3  PRO  76           1HB      PRO  76   1.708  11.579  -3.004
  589    HG2  PRO  76           1HG      PRO  76   3.802  12.224  -2.083
  590    HG3  PRO  76           2HG      PRO  76   3.202  12.170  -0.420
  591    HD2  PRO  76           1HD      PRO  76   3.978   9.854  -2.238
  592    HD3  PRO  76           2HD      PRO  76   4.267  10.049  -0.505
  593    H    LYS  77           H        LYS  77   1.424   9.042  -3.310
  594    HA   LYS  77           HA       LYS  77  -1.259   9.201  -4.377
  595    HB2  LYS  77           1HB      LYS  77   1.065   7.364  -4.957
  596    HB3  LYS  77           2HB      LYS  77  -0.466   7.361  -5.864
  597    HG2  LYS  77           1HG      LYS  77  -0.068   9.694  -6.545
  598    HG3  LYS  77           2HG      LYS  77   1.464   9.697  -5.638
  599    HD2  LYS  77           1HD      LYS  77   2.297   7.859  -7.072
  600    HD3  LYS  77           2HD      LYS  77   0.779   7.909  -7.997
  601    HE2  LYS  77           1HE      LYS  77   1.240  10.234  -8.639
  602    HE3  LYS  77           2HE      LYS  77   2.753  10.194  -7.708
  603    HZ1  LYS  77           3HZ      LYS  77   2.133   8.502 -10.043
  604    HZ2  LYS  77           1HZ      LYS  77   3.137   9.809 -10.047
  605    HZ3  LYS  77           2HZ      LYS  77   3.537   8.464  -9.180
  606    H    VAL  78           H        VAL  78   0.510   6.621  -2.665
  607    HA   VAL  78           HA       VAL  78  -1.579   4.695  -2.537
  608    HB   VAL  78           HB       VAL  78   0.546   5.427  -0.481
  609   HG11  VAL  78          1HG1      VAL  78   0.066   3.212   0.509
  610   HG12  VAL  78          2HG1      VAL  78  -1.364   4.270   0.582
  611   HG13  VAL  78          3HG1      VAL  78  -1.268   2.984  -0.645
  612   HG21  VAL  78          3HG2      VAL  78   1.461   4.670  -2.592
  613   HG22  VAL  78          1HG2      VAL  78   1.698   3.444  -1.325
  614   HG23  VAL  78          2HG2      VAL  78   0.421   3.225  -2.547
  615    H    GLU  79           H        GLU  79  -0.929   7.352  -0.249
  616    HA   GLU  79           HA       GLU  79  -3.121   6.823   1.470
  617    HB2  GLU  79           1HB      GLU  79  -1.306   8.396   1.953
  618    HB3  GLU  79           2HB      GLU  79  -1.920   9.483   0.683
  619    HG2  GLU  79           1HG      GLU  79  -4.064   9.764   2.037
  620    HG3  GLU  79           2HG      GLU  79  -3.312   8.639   3.191
  621    H    ALA  80           H        ALA  80  -2.991   8.897  -1.426
  622    HA   ALA  80           HA       ALA  80  -5.673   9.793  -1.316
  623    HB1  ALA  80           3HB      ALA  80  -3.951   9.230  -3.754
  624    HB2  ALA  80           1HB      ALA  80  -5.436  10.209  -3.734
  625    HB3  ALA  80           2HB      ALA  80  -4.000  10.752  -2.834
  626    H    VAL  81           H        VAL  81  -4.299   6.824  -2.691
  627    HA   VAL  81           HA       VAL  81  -6.771   6.003  -4.006
  628    HB   VAL  81           HB       VAL  81  -4.259   4.475  -3.216
  629   HG11  VAL  81          1HG1      VAL  81  -5.121   2.679  -4.683
  630   HG12  VAL  81          2HG1      VAL  81  -6.215   2.966  -3.308
  631   HG13  VAL  81          3HG1      VAL  81  -6.627   3.598  -4.921
  632   HG21  VAL  81          3HG2      VAL  81  -3.887   6.161  -4.915
  633   HG22  VAL  81          1HG2      VAL  81  -3.775   4.526  -5.611
  634   HG23  VAL  81          2HG2      VAL  81  -5.232   5.511  -5.882
  635    H    PHE  82           H        PHE  82  -5.322   5.314  -0.857
  636    HA   PHE  82           HA       PHE  82  -7.485   3.419  -0.207
  637    HB2  PHE  82           1HB      PHE  82  -5.122   4.532   1.356
  638    HB3  PHE  82           2HB      PHE  82  -6.335   3.443   2.065
  639    HD1  PHE  82           HD1      PHE  82  -6.549   2.003  -0.805
  640    HD2  PHE  82           HD2      PHE  82  -3.436   2.868   1.990
  641    HE1  PHE  82           HE1      PHE  82  -5.274   0.049  -1.621
  642    HE2  PHE  82           HE2      PHE  82  -2.159   0.916   1.175
  643    HZ   PHE  82           HZ       PHE  82  -3.079  -0.495  -0.630
  644    H    GLU  83           H        GLU  83  -7.583   6.601  -0.592
  645    HA   GLU  83           HA       GLU  83  -9.526   6.942   1.666
  646    HB2  GLU  83           1HB      GLU  83  -8.133   8.900  -0.157
  647    HB3  GLU  83           2HB      GLU  83  -9.512   9.340   0.878
  648    HG2  GLU  83           1HG      GLU  83  -6.818   8.278   1.927
  649    HG3  GLU  83           2HG      GLU  83  -7.384   9.960   1.811
  650    H    LEU  84           H        LEU  84  -9.764   5.432  -0.993
  651    HA   LEU  84           HA       LEU  84 -11.877   6.805  -2.423
  652    HB2  LEU  84           1HB      LEU  84 -10.903   4.056  -2.151
  653    HB3  LEU  84           2HB      LEU  84 -12.328   4.303  -3.188
  654    HG   LEU  84           HG       LEU  84  -9.556   5.492  -3.587
  655   HD11  LEU  84          1HD1      LEU  84  -9.554   4.092  -5.669
  656   HD12  LEU  84          2HD1      LEU  84  -9.731   3.086  -4.213
  657   HD13  LEU  84          3HD1      LEU  84 -11.152   3.451  -5.221
  658   HD21  LEU  84          3HD2      LEU  84 -11.277   7.068  -4.250
  659   HD22  LEU  84          1HD2      LEU  84 -10.462   6.417  -5.691
  660   HD23  LEU  84          2HD2      LEU  84 -12.077   5.821  -5.237
  661    H    GLU  85           H        GLU  85 -11.764   4.864   0.469
  662    HA   GLU  85           HA       GLU  85 -13.436   3.994   1.829
  663    HB2  GLU  85           1HB      GLU  85 -15.094   6.156   0.520
  664    HB3  GLU  85           2HB      GLU  85 -15.512   5.253   1.997
  665    HG2  GLU  85           1HG      GLU  85 -13.461   6.295   3.126
  666    HG3  GLU  85           2HG      GLU  85 -13.220   7.124   1.571
  667    H    HIS  86           H        HIS  86 -13.001   2.798  -0.733
  668    HA   HIS  86           HA       HIS  86 -15.749   1.879  -1.451
  669    HB2  HIS  86           1HB      HIS  86 -13.041   1.571  -2.814
  670    HB3  HIS  86           2HB      HIS  86 -14.499   0.694  -3.333
  671    HD2  HIS  86           HD2      HIS  86 -15.977   4.065  -2.590
  672    HE1  HIS  86           HE1      HIS  86 -14.293   4.366  -6.478
  673    HE2  HIS  86           HE2      HIS  86 -15.902   5.424  -4.689
  674    H    HIS  87           H        HIS  87 -16.088  -0.414  -1.840
  675    HA   HIS  87           HA       HIS  87 -14.618  -2.046   0.203
  676    HB2  HIS  87           1HB      HIS  87 -17.561  -2.222  -0.589
  677    HB3  HIS  87           2HB      HIS  87 -16.729  -3.261   0.592
  678    HD2  HIS  87           HD2      HIS  87 -18.701   0.100   0.540
  679    HE1  HIS  87           HE1      HIS  87 -16.641  -0.223   4.241
  680    HE2  HIS  87           HE2      HIS  87 -18.462   1.054   2.840
  681    H    HIS  88           H        HIS  88 -13.151  -2.984  -1.111
  682    HA   HIS  88           HA       HIS  88 -14.319  -4.963  -3.030
  683    HB2  HIS  88           1HB      HIS  88 -11.779  -3.318  -3.434
  684    HB3  HIS  88           2HB      HIS  88 -12.336  -4.640  -4.489
  685    HD1  HIS  88           HD1      HIS  88 -14.738  -4.195  -5.668
  686    HD2  HIS  88           HD2      HIS  88 -12.807  -0.777  -4.135
  687    HE1  HIS  88           HE1      HIS  88 -15.727  -2.284  -6.828
  688    H    HIS  89           H        HIS  89 -13.016  -6.834  -3.430
  689    HA   HIS  89           HA       HIS  89 -11.059  -7.494  -1.304
  690    HB2  HIS  89           1HB      HIS  89 -12.305  -9.455  -0.538
  691    HB3  HIS  89           2HB      HIS  89 -13.323  -8.012  -0.326
  692    HD2  HIS  89           HD2      HIS  89 -13.374 -11.432  -2.335
  693    HE1  HIS  89           HE1      HIS  89 -16.871  -9.175  -3.188
  694    HE2  HIS  89           HE2      HIS  89 -15.621 -11.475  -3.435
  695    H    HIS  90           H        HIS  90 -10.594 -10.009  -1.550
  696    HA   HIS  90           HA       HIS  90 -10.467 -10.739  -4.424
  697    HB2  HIS  90           1HB      HIS  90  -8.406  -9.352  -3.941
  698    HB3  HIS  90           2HB      HIS  90  -7.947 -10.563  -2.719
  699    HD2  HIS  90           HD2      HIS  90  -9.311 -12.065  -6.126
  700    HE1  HIS  90           HE1      HIS  90  -5.074 -12.353  -5.989
  701    HE2  HIS  90           HE2      HIS  90  -7.287 -13.029  -7.237
  702    H    HIS  91           H        HIS  91 -10.885 -12.771  -4.717
  703    HA   HIS  91           HA       HIS  91 -10.925 -14.580  -2.376
  704    HB2  HIS  91           1HB      HIS  91 -11.812 -14.969  -5.270
  705    HB3  HIS  91           2HB      HIS  91 -11.995 -16.177  -3.976
  706    HD1  HIS  91           HD1      HIS  91 -13.554 -15.390  -1.912
  707    HD2  HIS  91           HD2      HIS  91 -13.950 -13.118  -5.439
  708    HE1  HIS  91           HE1      HIS  91 -15.713 -14.258  -1.745