*HEADER    PROTEIN BINDING                         18-JUL-00   1FCL              
*TITLE     DELTA1.5: A COMPUTATIONALLY DESIGNED CORE VARIANT OF THE B1           
*TITLE    2 DOMAIN OF STREPTOCOCCAL PROTEIN G                                    
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: IMMUNOGLOBULIN G BINDING PROTEIN G;                        
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: GB1_DELTA1.5;                                              
*COMPND   5 SYNONYM: IGG BINDING PROTEIN G;                                      
*COMPND   6 ENGINEERED: YES;                                                     
*COMPND   7 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: STREPTOCOCCUS SP.;                              
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA                                   
*KEYWDS    DESIGNED CORE MUTANT, STREPTOCOCCAL PROTEIN G                         
*EXPDTA    NMR, 40 STRUCTURES                                                    
*AUTHOR    S.A.ROSS, C.A.SARISKY, A.SU, S.L.MAYO                                 
*REVDAT   1   19-SEP-01 1FCL    0                                                


{  NOE Restraints }

{ Beginning NOE class MED}
classification MED

assign (resid   46   and name HB2       ) (resid   48   and name HB+    ) 3.00 1.20 0.8
assign (resid    6   and name HD1+      ) (resid   15   and name HB#    ) 3.00 1.20 0.8
assign (resid    5   and name HB2 ) (resid    5   and name HA ) 3.00 1.20 0.30
assign (resid    9   and name HA1       ) (resid   10   and name HN     ) 3.00 1.20 0.30
assign (resid   23   and name HA        ) (resid   26   and name HN     ) 3.00 1.20 0.30
assign (resid   53   and name HG2+      ) (resid    8   and name HD21   ) 3.00 1.20 0.8
assign (resid   31   and name HA ) (resid   43   and name HH2 ) 3.00 1.20 0.30
assign (resid    6   and name HG1# ) (resid    6   and name HA ) 3.00 1.20 0.30
assign (resid   54   and name HG1+ ) (resid    7   and name HG2+ ) 3.00 1.20 1.3
assign (resid   31   and name HB2 ) (resid   32   and name HN ) 3.00 1.20 0.30
assign (resid   31   and name HB2 ) (resid   31   and name HE# ) 3.00 1.20 0.30
assign (resid   30   and name HA ) (resid   33   and name HN ) 3.00 1.20 0.30
assign (resid   32   and name HA ) (resid   32   and name HN ) 3.00 1.20 0.30
assign (resid   32   and name HB# ) (resid   33   and name HN ) 3.00 1.20 0.30
assign (resid   32   and name HG# ) (resid   32   and name HE21 ) 3.00 1.20 0.30
assign (resid   30   and name HG ) (resid   30   and name HN ) 3.00 1.20 0.30
assign (resid   30   and name HD2+ ) (resid   27   and name HA ) 3.00 1.20 0.8
assign (resid   30   and name HG ) (resid   18   and name HB ) 3.00 1.20 0.30
assign (resid   29   and name HN ) (resid   30   and name HN ) 3.00 1.20 0.30
assign (resid   29   and name HG1+ ) (resid   30   and name HA ) 3.00 1.20 0.8
assign (resid   30   and name HG ) (resid   27   and name HA ) 3.00 1.20 0.30
assign (resid   30   and name HD2+ ) (resid   30   and name HN ) 3.00 1.20 0.8
assign (resid   30   and name HB# ) (resid   30   and name HN ) 3.00 1.20 0.30
assign (resid   30   and name HB# ) (resid   30   and name HA ) 3.00 1.20 0.30
assign (resid   30   and name HB# ) (resid   30   and name HN ) 3.00 1.20 0.30
assign (resid   30   and name HA ) (resid   30   and name HN ) 3.00 1.20 0.30
assign (resid   33   and name HB2 ) (resid   30   and name HA ) 3.00 1.20 0.30
assign (resid   34   and name HG1# ) (resid   43   and name HH2 ) 3.00 1.20 0.30
assign (resid   34   and name HD1+ ) (resid   43   and name HZ2 ) 3.00 1.20 0.8
assign (resid   34   and name HB ) (resid   43   and name HZ2 ) 3.00 1.20 0.30
assign (resid   34   and name HD1+ ) (resid   34   and name HB ) 3.00 1.20 0.8
assign (resid   34   and name HG1# ) (resid   34   and name HN ) 3.00 1.20 0.30
assign (resid   34   and name HG1# ) (resid   43   and name HZ2 ) 3.00 1.20 0.30
assign (resid   37   and name HB3 ) (resid   34   and name HA ) 3.00 1.20 0.30
assign (resid   36   and name HB3 ) (resid   33   and name HA ) 3.00 1.20 0.30
assign (resid   35   and name HB# ) (resid   35   and name HN ) 3.00 1.20 0.30
assign (resid   34   and name HG1# ) (resid   34   and name HA ) 3.00 1.20 0.30
assign (resid   33   and name HB2 ) (resid   33   and name HN ) 3.00 1.20 0.30
assign (resid   33   and name HA ) (resid   33   and name HN ) 3.00 1.20 0.30
assign (resid   33   and name HA ) (resid   33   and name HD# ) 3.00 1.20 0.30
assign (resid   33   and name HB2 ) (resid   33   and name HA ) 3.00 1.20 0.30
assign (resid   34   and name HB ) (resid   34   and name HN ) 3.00 1.20 0.30
assign (resid   34   and name HB ) (resid   34   and name HA ) 3.00 1.20 0.30
assign (resid   34   and name HG1# ) (resid   33   and name HD# ) 3.00 1.20 0.30
assign (resid   34   and name HD1+ ) (resid   33   and name HD# ) 3.00 1.20 0.8
assign (resid   33   and name HB3 ) (resid   33   and name HN ) 3.00 1.20 0.30
assign (resid   29   and name HB ) (resid   30   and name HN ) 3.00 1.20 0.30
assign (resid   21   and name HA ) (resid   21   and name HN ) 3.00 1.20 0.30
assign (resid   20   and name HA ) (resid   20   and name HN ) 3.00 1.20 0.30
assign (resid   19   and name HG# ) (resid   20   and name HN ) 3.00 1.20 0.30
assign (resid   19   and name HA ) (resid   19   and name HN ) 3.00 1.20 0.30
assign (resid   22   and name HN ) (resid   21   and name HN ) 3.00 1.20 0.30
assign (resid   23   and name HA ) (resid   23   and name HN ) 3.00 1.20 0.30
assign (resid   23   and name HB+ ) (resid    3   and name HD# ) 3.00 1.20 0.8
assign (resid   22   and name HB2 ) (resid   23   and name HN ) 4.00 2.20 1.00
assign (resid   22   and name HA ) (resid   22   and name HN ) 3.00 1.20 0.30
assign (resid   18   and name HG2+ ) (resid   19   and name HN ) 3.00 1.20 0.8
assign (resid   13   and name HG# ) (resid    9   and name HN ) 3.00 1.20 0.30
assign (resid   12   and name HG ) (resid   12   and name HN ) 3.00 1.20 0.30
assign (resid   12   and name HB# ) (resid   12   and name HN ) 3.00 1.20 0.30
assign (resid   15   and name HA ) (resid   15   and name HN ) 3.00 1.20 0.30
assign (resid   18   and name HG2+ ) (resid   18   and name HN ) 3.00 1.20 0.8
assign (resid   18   and name HA ) (resid   18   and name HN ) 3.00 1.20 0.30
assign (resid   18   and name HA ) (resid   18   and name HB ) 3.00 1.20 0.30
assign (resid   15   and name HB# ) (resid   15   and name HA ) 3.00 1.20 0.30
assign (resid   23   and name HB+ ) (resid   24   and name HN ) 3.00 1.20 0.8
assign (resid   28   and name HA ) (resid   28   and name HN ) 3.00 1.20 0.30
assign (resid   28   and name HG# ) (resid   28   and name HA ) 3.00 1.20 0.30
assign (resid   28   and name HD# ) (resid   25   and name HA ) 3.00 1.20 0.30
assign (resid   29   and name HB ) (resid   29   and name HA ) 3.00 1.20 0.30
assign (resid   29   and name HA ) (resid   29   and name HN ) 3.00 1.20 0.30
assign (resid   29   and name HB ) (resid   26   and name HA ) 3.00 1.20 0.30
assign (resid   28   and name HN ) (resid   29   and name HN ) 3.00 1.20 0.30
assign (resid   28   and name HB2 ) (resid   29   and name HN ) 4.00 2.20 1.00
assign (resid   28   and name HB3       ) (resid   29   and name HN     ) 4.00 2.20 1.00
assign (resid   28   and name HB3 ) (resid   25   and name HA ) 3.00 1.20 0.30
assign (resid   25   and name HA ) (resid   25   and name HB ) 3.00 1.20 0.30
assign (resid   25   and name HB ) (resid   22   and name HN ) 3.00 1.20 0.30
assign (resid   24   and name HN ) (resid   23   and name HN ) 3.00 1.20 0.30
assign (resid   23   and name HB+ ) (resid   45   and name HE# ) 4.00 3.20 1.5
assign (resid   25   and name HB ) (resid   26   and name HN ) 3.00 1.20 0.30
assign (resid   26   and name HB+ ) (resid   26   and name HN ) 3.00 1.20 0.8
assign (resid   26   and name HA ) (resid   26   and name HN ) 3.00 1.20 0.30
assign (resid   25   and name HG2+ ) (resid   26   and name HA ) 3.00 1.20 0.8
assign (resid   37   and name HB3 ) (resid   37   and name HD21 ) 3.00 1.20 0.30
assign (resid   50   and name HB2 ) (resid    3   and name HD# ) 3.00 1.20 0.30
assign (resid   50   and name HB2 ) (resid    3   and name HA ) 3.00 1.20 0.30
assign (resid   49   and name HG2+ ) (resid   49   and name HN ) 3.00 1.20 0.8
assign (resid   49   and name HB ) (resid   49   and name HN ) 3.00 1.20 0.30
assign (resid   50   and name HA ) (resid   50   and name HN ) 3.00 1.20 0.30
assign (resid   51   and name HB ) (resid   51   and name HA ) 3.00 1.20 0.30
assign (resid   51   and name HG2+ ) (resid    5   and name HA ) 3.00 1.20 0.8
assign (resid   51   and name HA ) (resid    4   and name HN ) 3.00 1.20 0.30
assign (resid   50   and name HB2 ) (resid   50   and name HA ) 3.00 1.20 0.30
assign (resid   49   and name HA ) (resid   49   and name HN ) 3.00 1.20 0.30
assign (resid   47   and name HA ) (resid   47   and name HN ) 3.00 1.20 0.30
assign (resid   46   and name HB3 ) (resid   51   and name HB ) 3.00 1.20 0.30
assign (resid   46   and name HB3 ) (resid   46   and name HN ) 3.00 1.20 0.30
assign (resid   46   and name HB2 ) (resid   46   and name HA ) 3.00 1.20 0.30
assign (resid   47   and name HB# ) (resid   47   and name HN ) 3.00 1.20 0.30
assign (resid   49   and name HN ) (resid   48   and name HN ) 3.00 1.20 0.30
assign (resid   48   and name HB+ ) (resid   49   and name HN ) 3.00 1.20 0.8
assign (resid   48   and name HA ) (resid   48   and name HN ) 3.00 1.20 0.30
assign (resid   48   and name HN ) (resid   47   and name HN ) 3.00 1.20 0.30
assign (resid   47   and name HB# ) (resid   47   and name HN ) 3.00 1.20 0.30
assign (resid   52   and name HB# ) (resid   52   and name HD1 ) 3.00 1.20 0.30
assign (resid   56   and name HB# ) (resid   10   and name HN ) 3.00 1.20 0.30
assign (resid   56   and name HB# ) (resid    9   and name HA2 ) 3.00 1.20 0.30
assign (resid   55   and name HG2+ ) (resid   56   and name HN ) 3.00 1.20 0.8
assign (resid   55   and name HB ) (resid   55   and name HN ) 3.00 1.20 0.30
assign (resid   56   and name HA ) (resid   56   and name HN ) 3.00 1.20 0.30
assign (resid   56   and name HB# ) (resid   56   and name HN ) 3.00 1.20 0.30
assign (resid   56   and name HB# ) (resid   56   and name HA ) 3.00 1.20 0.30
assign (resid   56   and name HB# ) (resid   56   and name HN ) 3.00 1.20 0.30
assign (resid   56   and name HB# ) (resid   56   and name HA ) 3.00 1.20 0.30
assign (resid   55   and name HG2+ ) (resid    8   and name HD21 ) 3.00 1.20 0.8
assign (resid   54   and name HG1+ ) (resid   34   and name HG1# ) 4.00 3.20 1.5
assign (resid   54   and name HG1+ ) (resid   34   and name HD1+ ) 4.00 3.20 2.0
assign (resid   52   and name HB# ) (resid   52   and name HD1 ) 3.00 1.20 0.30
assign (resid   52   and name HB# ) (resid   52   and name HN ) 3.00 1.20 0.30
assign (resid   54   and name HG2+ ) (resid   34   and name HD1+ ) 2.50 0.70 1.2
assign (resid   55   and name HG2+ ) (resid    8   and name HB2 ) 3.00 1.20 0.8
assign (resid   55   and name HG2+ ) (resid    8   and name HB3 ) 2.50 0.70 0.7
assign (resid   54   and name HA ) (resid   43   and name HD1 ) 3.00 1.20 0.30
assign (resid   54   and name HG2+ ) (resid   34   and name HG1# ) 3.00 1.20 0.8
assign (resid   46   and name HA ) (resid   46   and name HN ) 3.00 1.20 0.30
assign (resid   39   and name HD1+ ) (resid   56   and name HB# ) 3.00 1.20 0.8
assign (resid   39   and name HG1# ) (resid   39   and name HN ) 3.00 1.20 0.30
assign (resid   39   and name HD1+ ) (resid   39   and name HG1# ) 4.00 3.20 1.5
assign (resid   40   and name HA ) (resid   40   and name HN ) 3.00 1.20 0.30
assign (resid   42   and name HA ) (resid   42   and name HN ) 3.00 1.20 0.30
assign (resid   41   and name HA1 ) (resid   56   and name HA ) 3.00 1.20 0.30
assign (resid   41   and name HA1 ) (resid   41   and name HN ) 3.00 1.20 0.30
assign (resid   41   and name HA2 ) (resid   41   and name HN ) 3.00 1.20 0.30
assign (resid   39   and name HD1+ ) (resid   39   and name HA ) 3.00 1.20 0.8
assign (resid   38   and name HA# ) (resid   39   and name HN ) 3.00 1.20 0.30
assign (resid   37   and name HB2 ) (resid   37   and name HA ) 3.00 1.20 0.30
assign (resid   37   and name HB3 ) (resid   37   and name HN ) 3.00 1.20 0.30
assign (resid   39   and name HD1+ ) (resid   10   and name HN ) 3.00 1.20 0.8
assign (resid   39   and name HB ) (resid   39   and name HN ) 3.00 1.20 0.30
assign (resid   39   and name HB ) (resid   39   and name HA ) 3.00 1.20 0.30
assign (resid   39   and name HA ) (resid   39   and name HN ) 3.00 1.20 0.30
assign (resid   39   and name HG1# ) (resid   37   and name HB2 ) 3.00 1.20 0.30
assign (resid   42   and name HB2 ) (resid   42   and name HN ) 3.00 1.20 0.30
assign (resid   45   and name HB# ) (resid   45   and name HN ) 3.00 1.20 0.30
assign (resid   44   and name HB ) (resid   45   and name HN ) 3.00 1.20 0.30
assign (resid   45   and name HB# ) (resid   45   and name HD# ) 3.00 1.20 0.30
assign (resid   45   and name HA ) (resid   52   and name HE3 ) 3.00 1.20 0.30
assign (resid   45   and name HA ) (resid   52   and name HA ) 4.00 2.20 1.00
assign (resid   45   and name HB# ) (resid   45   and name HN ) 3.00 1.20 0.30
assign (resid   43   and name HA ) (resid   44   and name HN ) 3.00 1.20 0.30
assign (resid   43   and name HB3 ) (resid   43   and name HD1 ) 3.00 1.20 0.30
assign (resid   42   and name HB2 ) (resid   55   and name HB ) 3.00 1.20 0.30
assign (resid   42   and name HA ) (resid   43   and name HD1 ) 3.00 1.20 0.30
assign (resid   42   and name HB3 ) (resid   42   and name HN ) 3.00 1.20 0.30
assign (resid   43   and name HB3 ) (resid   43   and name HE3 ) 3.00 1.20 0.30
assign (resid   43   and name HZ2 ) (resid   43   and name HE1 ) 3.00 1.20 0.30
assign (resid   43   and name HD1 ) (resid   43   and name HN ) 3.00 1.20 0.30
assign (resid   43   and name HD1 ) (resid   43   and name HE1 ) 3.00 1.20 0.30
assign (resid   43   and name HB2 ) (resid   43   and name HA ) 3.00 1.20 0.30
assign (resid   43   and name HB3 ) (resid   43   and name HN ) 3.00 1.20 0.30
assign (resid   30   and name HB# ) (resid   30   and name HA ) 3.00 1.20 0.30
assign (resid    5   and name HB3 ) (resid    5   and name HA ) 2.50 0.70 0.20
assign (resid    5   and name HB2 ) (resid    5   and name HN ) 3.00 1.20 0.30
assign (resid    5   and name HB3 ) (resid    5   and name HN ) 3.00 1.20 0.30
assign (resid    7   and name HG1# ) (resid    7   and name HA ) 3.00 1.20 0.30
assign (resid    7   and name HD1+ ) (resid    7   and name HA ) 4.00 3.20 1.5
assign (resid    7   and name HB ) (resid    7   and name HN ) 3.00 1.20 0.30
assign (resid    7   and name HB ) (resid    7   and name HA ) 3.00 1.20 0.30
assign (resid    5   and name HA ) (resid    5   and name HN ) 3.00 1.20 0.30
assign (resid    4   and name HB2 ) (resid    4   and name HN ) 3.00 1.20 0.30
assign (resid    4   and name HB3       ) (resid    4   and name HN     ) 3.00 1.20 0.30
assign (resid    9   and name HA1 ) (resid   12   and name HN ) 3.00 1.20 0.30
assign (resid    7   and name HG2+ ) (resid    8   and name HN ) 3.00 1.20 0.8
assign (resid    7   and name HG1# ) (resid    7   and name HN ) 3.00 1.20 0.30
assign (resid    7   and name HG1# ) (resid    7   and name HA ) 3.00 1.20 0.30
assign (resid    7   and name HG1# ) (resid    7   and name HN ) 3.00 1.20 0.30
assign (resid    4   and name HG# ) (resid    4   and name HE1 ) 3.00 1.20 0.30
assign (resid    5   and name HD1+ ) (resid   52   and name HD1 ) 3.00 1.20 0.8
assign (resid    5   and name HD1+ ) (resid   52   and name HE3 ) 3.00 1.20 0.8
assign (resid    6   and name HG1# ) (resid    4   and name HE1 ) 3.00 1.20 0.30
assign (resid   10   and name HB# ) (resid   11   and name HN ) 3.00 1.20 0.30
assign (resid   10   and name HG# ) (resid   10   and name HN ) 3.00 1.20 0.30
assign (resid    6   and name HD1+      ) (resid    6   and name HB     ) 3.00 1.20 0.8
assign (resid    6   and name HB ) (resid    6   and name HA ) 3.00 1.20 0.30
assign (resid    5   and name HB3 ) (resid   52   and name HB# ) 3.00 1.20 0.30
assign (resid    7   and name HA ) (resid    7   and name HN ) 3.00 1.20 0.30
assign (resid    5   and name HD1+ ) (resid   43   and name HH2 ) 4.00 3.20 1.5
assign (resid    5   and name HD1+ ) (resid   43   and name HZ3 ) 4.00 3.20 1.5
assign (resid   10   and name HG# ) (resid   10   and name HN ) 3.00 1.20 0.30
assign (resid   11   and name HN ) (resid   10   and name HN ) 3.00 1.20 0.30
assign (resid    5   and name HD2+ ) (resid   43   and name HH2 ) 4.00 3.20 1.5
assign (resid    4   and name HB2 ) (resid   51   and name HA ) 3.00 1.20 0.30
assign (resid    3   and name HD# ) (resid    3   and name HN ) 3.00 1.20 0.30
assign (resid    3   and name HA ) (resid    3   and name HD# ) 3.00 1.20 0.30
assign (resid    3   and name HD#       ) (resid   20   and name HB+    ) 3.00 1.20 0.8
assign (resid    7   and name HB ) (resid   13   and name HA ) 3.00 1.20 0.30
assign (resid    7   and name HB ) (resid   14   and name HN ) 3.00 1.20 0.30
assign (resid    7   and name HD1+ ) (resid   33   and name HD# ) 4.00 3.20 1.5
assign (resid    3   and name HB2 ) (resid    3   and name HN ) 3.00 1.20 0.30
assign (resid    8   and name HB3 ) (resid    8   and name HN ) 3.00 1.20 0.30
assign (resid    7   and name HD1+ ) (resid   37   and name HB2 ) 4.00 3.20 1.5
assign (resid    3   and name HA ) (resid    3   and name HN ) 3.00 1.20 0.30
assign (resid    7   and name HG2+ ) (resid   13   and name HA ) 3.00 1.20 0.8
assign (resid    7   and name HG2+ ) (resid    9   and name HN ) 3.00 1.20 0.8
assign (resid   12   and name HA ) (resid   12   and name HN ) 3.00 1.20 0.30
assign (resid    5   and name HD2+ ) (resid   43   and name HZ3 ) 4.00 3.20 1.5
assign (resid    3   and name HB2 ) (resid    3   and name HA ) 3.00 1.20 0.30
assign (resid    8   and name HB2 ) (resid    8   and name HA ) 3.00 1.20 0.30

{ Beginning NOE class STRG}
classification STRG

assign (resid   14   and name HA#       ) (resid   14   and name HN     ) 2.50 0.70 0.20
assign (resid   14   and name HA#       ) (resid   15   and name HN     ) 2.50 0.70 0.20
assign (resid   35   and name HB# ) (resid   32   and name HA ) 2.50 0.70 0.20
assign (resid    7   and name HD1+ ) (resid   33   and name HE# ) 4.00 3.20 1.5
assign (resid   37   and name HD22 ) (resid   37   and name HD21 ) 2.50 0.70 0.20
assign (resid   34   and name HG1# ) (resid   34   and name HB ) 2.50 0.70 0.20
assign (resid    6   and name HA ) (resid   15   and name HA ) 2.50 0.70 0.20
assign (resid   35   and name HB# ) (resid   32   and name HA ) 2.50 0.70 0.20
assign (resid    6   and name HG1# ) (resid    6   and name HB ) 2.50 0.70 0.20
assign (resid   29   and name HG2+ ) (resid   29   and name HN ) 2.50 0.70 0.7
assign (resid   37   and name HB1 ) (resid   37   and name HB2 ) 2.50 0.70 0.20
assign (resid   30   and name HD1+ ) (resid   18   and name HB ) 2.50 0.70 0.7
assign (resid    6   and name HA ) (resid    7   and name HN ) 2.50 0.70 0.20
assign (resid   35   and name HB# ) (resid   35   and name HA ) 2.50 0.70 0.20
assign (resid   30   and name HD2+ ) (resid   29   and name HB ) 2.50 0.70 0.7
assign (resid   30   and name HD2+ ) (resid   18   and name HB ) 2.50 0.70 0.7
assign (resid   35   and name HB# ) (resid   35   and name HA ) 2.50 0.70 0.20
assign (resid   32   and name HB# ) (resid   32   and name HA ) 2.50 0.70 0.20
assign (resid   32   and name HB# ) (resid   29   and name HA ) 2.50 0.70 0.20
assign (resid   31   and name HA ) (resid   43   and name HZ2 ) 2.50 0.70 0.20
assign (resid   33   and name HB3 ) (resid   33   and name HA ) 2.50 0.70 0.20
assign (resid   31   and name HE1 ) (resid   32   and name HA ) 2.50 0.70 0.20
assign (resid   33   and name HB2 ) (resid   33   and name HD# ) 2.50 0.70 0.20
assign (resid    7   and name HG2+ ) (resid    7   and name HA ) 2.50 0.70 0.7
assign (resid   32   and name HB# ) (resid   32   and name HN ) 2.50 0.70 0.20
assign (resid   32   and name HE22 ) (resid   32   and name HE21 ) 2.50 0.70 0.20
assign (resid   32   and name HB# ) (resid   32   and name HA ) 2.50 0.70 0.20
assign (resid   32   and name HG# ) (resid   32   and name HA ) 2.50 0.70 0.20
assign (resid    7   and name HA ) (resid    8   and name HN ) 2.50 0.70 0.20
assign (resid   33   and name HB1 ) (resid   33   and name HD# ) 2.50 0.70 0.20
assign (resid   30   and name HD2+ ) (resid   30   and name HA ) 2.50 0.70 0.7
assign (resid   30   and name HD1+ ) (resid   30   and name HD2+ ) 2.50 0.70 1.2
assign (resid   30   and name HD1+ ) (resid   30   and name HA ) 2.50 0.70 0.7
assign (resid   34   and name HD1+ ) (resid   34   and name HA ) 2.50 0.70 0.7
assign (resid   34   and name HG1# ) (resid   34   and name HB ) 2.50 0.70 0.20
assign (resid   34   and name HG1# ) (resid   31   and name HA ) 2.50 0.70 0.20
assign (resid   31   and name HB3 ) (resid   31   and name HA ) 2.50 0.70 0.20
assign (resid   33   and name HB3 ) (resid   33   and name HD# ) 2.50 0.70 0.20
assign (resid   31   and name HB2 ) (resid   28   and name HA ) 2.50 0.70 0.20
assign (resid   31   and name HB3       ) (resid   28   and name HA     ) 4.00 2.20 1.00
assign (resid   33   and name HE# ) (resid   33   and name HD# ) 2.50 0.70 0.20
assign (resid    1   and name HA ) (resid    2   and name HN ) 2.50 0.70 0.20
assign (resid   49   and name HN ) (resid   50   and name HN ) 2.50 0.70 0.20
assign (resid    4   and name HB2 ) (resid    4   and name HB3 ) 2.50 0.70 0.20
assign (resid   50   and name HB3 ) (resid   50   and name HA ) 2.50 0.70 0.20
assign (resid   50   and name HB2 ) (resid   50   and name HB3 ) 2.50 0.70 0.20
assign (resid    3   and name HA ) (resid    4   and name HN ) 2.50 0.70 0.20
assign (resid   51   and name HG2+ ) (resid   51   and name HA ) 2.50 0.70 0.7
assign (resid   51   and name HA ) (resid   52   and name HN ) 2.50 0.70 0.20
assign (resid   47   and name HB2 ) (resid   47   and name HB3 ) 2.50 0.70 0.20
assign (resid    4   and name HG# ) (resid    4   and name HB2 ) 2.50 0.70 0.20
assign (resid    4   and name HD# ) (resid    4   and name HB2 ) 2.50 0.70 0.20
assign (resid   48   and name HB+ ) (resid   48   and name HA ) 2.50 0.70 0.7
assign (resid   48   and name HB+ ) (resid   48   and name HN ) 2.50 0.70 0.7
assign (resid    3   and name HB2 ) (resid    3   and name HD# ) 2.50 0.70 0.20
assign (resid    3   and name HB2 ) (resid    3   and name HB3 ) 2.50 0.70 0.20
assign (resid   54   and name HG2+ ) (resid   54   and name HB ) 2.50 0.70 0.7
assign (resid   54   and name HG1+ ) (resid   54   and name HG2+ ) 2.50 0.70 1.2
assign (resid   55   and name HA ) (resid   56   and name HN ) 2.50 0.70 0.20
assign (resid    2   and name HG2+ ) (resid    2   and name HB ) 2.50 0.70 0.7
assign (resid    2   and name HB ) (resid    2   and name HN ) 2.50 0.70 0.20
assign (resid   56   and name HB# ) (resid   56   and name HB# ) 2.50 0.70 0.20
assign (resid    3   and name HB3 ) (resid    3   and name HD# ) 2.50 0.70 0.20
assign (resid   53   and name HG2+ ) (resid    8   and name HB3 ) 2.50 0.70 0.7
assign (resid   53   and name HG2+ ) (resid   53   and name HB ) 2.50 0.70 0.7
assign (resid   53   and name HA ) (resid   54   and name HN ) 2.50 0.70 0.20
assign (resid   54   and name HG1+ ) (resid    5   and name HD2+ ) 2.50 0.70 1.2
assign (resid   54   and name HG1+ ) (resid    7   and name HA ) 2.50 0.70 0.7
assign (resid   46   and name HA ) (resid   47   and name HN ) 2.50 0.70 0.20
assign (resid   39   and name HD1+ ) (resid   56   and name HG# ) 2.50 0.70 0.7
assign (resid   40   and name HB1 ) (resid   40   and name HB2 ) 2.50 0.70 0.20
assign (resid   40   and name HA ) (resid   41   and name HN ) 2.50 0.70 0.20
assign (resid   41   and name HA1 ) (resid   41   and name HA2 ) 2.50 0.70 0.20
assign (resid   41   and name HA1 ) (resid   42   and name HN ) 2.50 0.70 0.20
assign (resid    5   and name HD2+ ) (resid   34   and name HD1+ ) 2.50 0.70 1.2
assign (resid   39   and name HA ) (resid   40   and name HN ) 2.50 0.70 0.20
assign (resid   38   and name HA# ) (resid   38   and name HN ) 2.50 0.70 0.20
assign (resid    6   and name HD1+ ) (resid    6   and name HA ) 2.50 0.70 0.7
assign (resid   39   and name HG2+ ) (resid   39   and name HG1# ) 4.00 3.20 1.5
assign (resid   39   and name HG11 ) (resid   39   and name HG12 ) 2.50 0.70 0.20
assign (resid    5   and name HD1+ ) (resid   52   and name HB# ) 2.50 0.70 0.7
assign (resid   39   and name HG1# ) (resid    9   and name HA1 ) 2.50 0.70 0.20
assign (resid   44   and name HA ) (resid   44   and name HB ) 2.50 0.70 0.20
assign (resid   44   and name HG2+ ) (resid   44   and name HB ) 2.50 0.70 0.7
assign (resid   44   and name HA ) (resid   45   and name HN ) 2.50 0.70 0.20
assign (resid   45   and name HA ) (resid   46   and name HN ) 2.50 0.70 0.20
assign (resid    4   and name HA ) (resid   17   and name HA ) 2.50 0.70 0.20
assign (resid   46   and name HB2 ) (resid   46   and name HB3 ) 2.50 0.70 0.20
assign (resid   43   and name HZ3 ) (resid   43   and name HH2 ) 2.50 0.70 0.20
assign (resid   42   and name HA ) (resid   43   and name HN ) 2.50 0.70 0.20
assign (resid   43   and name HB2 ) (resid   43   and name HE3 ) 3.00 1.20 0.30
assign (resid   43   and name HZ3 ) (resid   43   and name HE3 ) 2.50 0.70 0.20
assign (resid    5   and name HD#+ ) (resid    5   and name HG ) 2.50 0.70 0.7
assign (resid   43   and name HH2 ) (resid   43   and name HZ2 ) 2.50 0.70 0.20
assign (resid    5   and name HG ) (resid    5   and name HB2 ) 3.00 1.20 0.30
assign (resid   12   and name HB# ) (resid   12   and name HA ) 2.50 0.70 0.20
assign (resid   10   and name HB# ) (resid   10   and name HA ) 2.50 0.70 0.20
assign (resid   10   and name HA ) (resid   10   and name HN ) 2.50 0.70 0.20
assign (resid   21   and name HG#+ ) (resid   21   and name HB ) 2.50 0.70 0.7
assign (resid   21   and name HG#+ ) (resid   21   and name HA ) 2.50 0.70 0.7
assign (resid   26   and name HA ) (resid   27   and name HN ) 4.00 2.20 1.00
assign (resid   10   and name HB# ) (resid   10   and name HA ) 2.50 0.70 0.20
assign (resid   21   and name HG#+ ) (resid   21   and name HN ) 2.50 0.70 0.7
assign (resid   26   and name HB+ ) (resid   26   and name HA ) 2.50 0.70 0.7
assign (resid   17   and name HB ) (resid   17   and name HA ) 2.50 0.70 0.20
assign (resid   10   and name HB# ) (resid   10   and name HN ) 2.50 0.70 0.20
assign (resid   13   and name HA ) (resid   14   and name HN ) 2.50 0.70 0.20
assign (resid   28   and name HB2 ) (resid   28   and name HA ) 3.00 1.20 0.30
assign (resid   28   and name HB2 ) (resid   28   and name HN ) 3.00 1.20 0.30
assign (resid   28   and name HB3 ) (resid   28   and name HA ) 3.00 1.20 0.30
assign (resid   28   and name HB3 ) (resid   28   and name HN ) 3.00 1.20 0.30
assign (resid    9   and name HA2 ) (resid   10   and name HN ) 2.50 0.70 0.20
assign (resid   10   and name HG# ) (resid   56   and name HB# ) 2.50 0.70 0.20
assign (resid   17   and name HG2+ ) (resid   17   and name HA ) 2.50 0.70 0.7
assign (resid    9   and name HA2 ) (resid   56   and name HN ) 2.50 0.70 0.20
assign (resid   19   and name HA ) (resid   20   and name HN ) 2.50 0.70 0.20
assign (resid   21   and name HG#+ ) (resid   21   and name HA ) 2.50 0.70 0.7
assign (resid   10   and name HG2 ) (resid   10   and name HE# ) 2.50 0.70 0.20
assign (resid   23   and name HB+ ) (resid   23   and name HN ) 2.50 0.70 0.7
assign (resid   25   and name HG2+ ) (resid   25   and name HB ) 2.50 0.70 0.7
assign (resid   16   and name HG2+ ) (resid   16   and name HB ) 2.50 0.70 0.7
assign (resid   25   and name HG2+ ) (resid   25   and name HA ) 2.50 0.70 0.7
assign (resid   24   and name HB+ ) (resid   24   and name HN ) 2.50 0.70 0.7
assign (resid   24   and name HB+ ) (resid   25   and name HN ) 3.00 1.20 0.8
assign (resid   16   and name HG2+ ) (resid    5   and name HB2 ) 2.50 0.70 0.7
assign (resid   10   and name HG# ) (resid   10   and name HA ) 2.50 0.70 0.20
assign (resid   10   and name HG# ) (resid   10   and name HE# ) 2.50 0.70 0.20
assign (resid   15   and name HA ) (resid   16   and name HN ) 2.50 0.70 0.20
assign (resid   26   and name HB+ ) (resid    3   and name HD# ) 2.50 0.70 0.7
assign (resid   26   and name HB+ ) (resid   18   and name HB ) 2.50 0.70 0.7
assign (resid   21   and name HG#+ ) (resid   21   and name HN ) 2.50 0.70 0.7
assign (resid   21   and name HG#+ ) (resid   21   and name HB ) 2.50 0.70 0.7
assign (resid   26   and name HB+ ) (resid    3   and name HB3 ) 2.50 0.70 0.7
assign (resid   26   and name HB+       ) (resid    3   and name HB2    ) 3.00 1.20 0.8
assign (resid   22   and name HB3 ) (resid   23   and name HN ) 2.50 0.70 0.20
assign (resid   22   and name HA ) (resid   23   and name HN ) 2.50 0.70 0.20
assign (resid   10   and name HB# ) (resid   10   and name HN ) 2.50 0.70 0.20
assign (resid   21   and name HG#+ ) (resid   25   and name HB ) 2.50 0.70 0.7
assign (resid   21   and name HB ) (resid   21   and name HA ) 2.50 0.70 0.20
assign (resid   19   and name HB# ) (resid   19   and name HN ) 2.50 0.70 0.20
assign (resid   18   and name HG2+ ) (resid    3   and name HB3 ) 2.50 0.70 0.7
assign (resid   11   and name HG2+ ) (resid   11   and name HB ) 2.50 0.70 0.7
assign (resid   12   and name HG ) (resid   12   and name HA ) 2.50 0.70 0.20
assign (resid   18   and name HA ) (resid   19   and name HN ) 2.50 0.70 0.20
assign (resid    8   and name HA ) (resid    9   and name HN ) 2.50 0.70 0.20
assign (resid   12   and name HA ) (resid   13   and name HN ) 2.50 0.70 0.20
assign (resid   18   and name HG2+ ) (resid   18   and name HB ) 2.50 0.70 0.7
assign (resid   29   and name HG1+ ) (resid   29   and name HB ) 2.50 0.70 0.7
assign (resid   29   and name HG1+ ) (resid   29   and name HA ) 2.50 0.70 0.7
assign (resid   29   and name HG2+ ) (resid   29   and name HA ) 2.50 0.70 0.7
assign (resid    8   and name HD22 ) (resid    8   and name HD21 ) 2.50 0.70 0.20
assign (resid   29   and name HB ) (resid   29   and name HN ) 2.50 0.70 0.20
assign (resid   12   and name HN ) (resid   11   and name HN ) 2.50 0.70 0.20
assign (resid   18   and name HG2+ ) (resid    3   and name HD# ) 2.50 0.70 0.7
assign (resid   11   and name HG2+ ) (resid   11   and name HA ) 2.50 0.70 0.7
assign (resid   12   and name HD1+ ) (resid   12   and name HB# ) 2.50 0.70 0.7
assign (resid   18   and name HG2+ ) (resid   26   and name HA ) 2.50 0.70 0.7
assign (resid   17   and name HA ) (resid   18   and name HN ) 2.50 0.70 0.20
assign (resid   28   and name HG# ) (resid   28   and name HA ) 3.00 1.20 0.30
assign (resid    9   and name HA2 ) (resid    9   and name HA1 ) 2.50 0.70 0.20
assign (resid   17   and name HB ) (resid   18   and name HN ) 2.50 0.70 0.20
assign (resid    9   and name HA1 ) (resid    9   and name HN ) 2.50 0.70 0.20
{ Beginning NOE class WEAK}
classification WEAK

assign (resid   43   and name HB3       ) (resid   43   and name HZ2    ) 4.00 2.20 1.00
assign (resid   42   and name HG2       ) (resid   44   and name HG2+   ) 4.00 3.20 1.5
assign (resid   42   and name HG3       ) (resid   44   and name HG2+   ) 4.00 3.20 1.5
assign (resid   29   and name HG1+      ) (resid   18   and name HB     ) 4.00 3.20 1.5
assign (resid   21   and name HB        ) (resid   22   and name HB2    ) 4.00 2.20 1.00
assign (resid   21   and name HG#+      ) (resid   22   and name HB2    ) 4.00 3.20 1.5
assign (resid   13   and name HB#       ) (resid    9   and name HN     ) 4.00 2.20 1.00
assign (resid   38   and name HA1       ) (resid   12   and name HD1+   ) 4.00 3.20 1.5
assign (resid    5   and name HB3 ) (resid    6   and name HN ) 4.00 2.20 1.00
assign (resid    4   and name HB3 ) (resid   51   and name HA ) 4.00 2.20 1.00
assign (resid    3   and name HB3       ) (resid    4   and name HN     ) 4.00 2.20 1.00
assign (resid    7   and name HD1+      ) (resid   37   and name HD21   ) 4.00 3.20 1.5
assign (resid   51   and name HA        ) (resid   52   and name HD1    ) 4.00 2.20 1.00
assign (resid   51   and name HB        ) (resid   46   and name HN     ) 4.00 2.20 1.00
assign (resid   34   and name HA        ) (resid   37   and name HB2    ) 4.00 2.20 1.00
assign (resid    6   and name HB        ) (resid   54   and name HN     ) 4.00 2.20 1.00
assign (resid    4   and name HN        ) (resid   52   and name HN     ) 4.00 2.20 1.00
assign (resid   54   and name HA        ) (resid   43   and name HA     ) 4.00 2.20 1.00
assign (resid    3   and name HN        ) (resid   19   and name HA     ) 4.00 2.20 1.00
assign (resid   53   and name HG2+      ) (resid    8   and name HD22   ) 4.00 3.20 1.5
assign (resid    6   and name HG2+      ) (resid    8   and name HD21   ) 4.00 3.20 1.5
assign (resid    6   and name HG2+      ) (resid    8   and name HD22   ) 4.00 3.20 1.5
assign (resid   44   and name HG#+ ) (resid   43   and name HN ) 4.00 3.20 1.5
assign (resid    6   and name HG1# ) (resid    6   and name HN ) 4.00 2.20 1.00
assign (resid   17   and name HG2+ ) (resid    4   and name HE# ) 4.00 3.20 1.5
assign (resid   32   and name HA ) (resid   33   and name HN ) 4.00 2.20 1.00
assign (resid   48   and name HB+ ) (resid   50   and name HN ) 4.00 3.20 1.5
assign (resid   43   and name HA ) (resid   55   and name HN ) 4.00 2.20 1.00
assign (resid   50   and name HB3 ) (resid    3   and name HA ) 4.00 2.20 1.00
assign (resid    4   and name HA ) (resid    4   and name HN ) 4.00 2.20 1.00
assign (resid   16   and name HG2+ ) (resid   16   and name HN ) 4.00 3.20 1.5
assign (resid   16   and name HA ) (resid   17   and name HN ) 4.00 2.20 1.00
assign (resid   16   and name HA ) (resid   17   and name HA ) 4.00 2.20 1.00
assign (resid   16   and name HA ) (resid   16   and name HB ) 4.00 2.20 1.00
assign (resid   16   and name HA ) (resid   16   and name HN ) 4.00 2.20 1.00
assign (resid   18   and name HB ) (resid   19   and name HN ) 4.00 2.20 1.00
assign (resid   49   and name HB ) (resid   50   and name HN ) 4.00 2.20 1.00
assign (resid   16   and name HB ) (resid   16   and name HN ) 4.00 2.20 1.00
assign (resid   49   and name HG2+ ) (resid   50   and name HN ) 4.00 3.20 1.5
assign (resid   49   and name HG2+ ) (resid   50   and name HA ) 4.00 3.20 1.5
assign (resid    5   and name HD2+ ) (resid    5   and name HN ) 4.00 3.20 1.5
assign (resid    5   and name HD2+ ) (resid    6   and name HB ) 4.00 3.20 1.5
assign (resid    5   and name HA ) (resid    6   and name HN ) 4.00 2.20 1.00
assign (resid   49   and name HG2+ ) (resid   48   and name HN ) 4.00 3.20 1.5
assign (resid    4   and name HB2 ) (resid    4   and name HE# ) 4.00 2.20 1.00
assign (resid    4   and name HB3 ) (resid    4   and name HE# ) 4.00 2.20 1.00
assign (resid   50   and name HA ) (resid    3   and name HD# ) 4.00 2.20 1.00
assign (resid   50   and name HB3       ) (resid    3   and name HD#    ) 4.00 2.20 1.00
assign (resid   49   and name HA ) (resid   50   and name HN ) 4.00 2.20 1.00
assign (resid   47   and name HA ) (resid   48   and name HN ) 4.00 2.20 1.00
assign (resid   46   and name HB2 ) (resid   47   and name HN ) 4.00 2.20 1.00
assign (resid   46   and name HA ) (resid   48   and name HN ) 4.00 2.20 1.00
assign (resid   46   and name HB2 ) (resid   49   and name HN ) 4.00 2.20 1.00
assign (resid   46   and name HB3 ) (resid   49   and name HN ) 4.00 2.20 1.00
assign (resid   45   and name HB# ) (resid   45   and name HE# ) 4.00 2.20 1.00
assign (resid   17   and name HG2+ ) (resid   18   and name HN ) 4.00 3.20 1.5
assign (resid    4   and name HB3 ) (resid   17   and name HA ) 4.00 2.20 1.00
assign (resid    4   and name HG# ) (resid    5   and name HN ) 4.00 2.20 1.00
assign (resid    4   and name HE# ) (resid    6   and name HA ) 4.00 2.20 1.00
assign (resid    4   and name HG# ) (resid   16   and name HN ) 4.00 2.20 1.00
assign (resid   17   and name HG2+ ) (resid   17   and name HN ) 4.00 3.20 1.5
assign (resid   46   and name HB2 ) (resid   46   and name HN ) 4.00 2.20 1.00
assign (resid   46   and name HB3 ) (resid   46   and name HA ) 4.00 2.20 1.00
assign (resid    4   and name HB2 ) (resid    5   and name HN ) 4.00 2.20 1.00
assign (resid   45   and name HB# ) (resid   45   and name HE# ) 4.00 2.20 1.00
assign (resid   17   and name HG2+ ) (resid   16   and name HN ) 4.00 3.20 1.5
assign (resid   17   and name HG2+ ) (resid    4   and name HN ) 4.00 3.20 1.5
assign (resid   44   and name HA ) (resid   44   and name HN ) 4.00 2.20 1.00
assign (resid   47   and name HB# ) (resid   48   and name HN ) 4.00 2.20 1.00
assign (resid   11   and name HA ) (resid   12   and name HN ) 4.00 2.20 1.00
assign (resid   16   and name HG2+ ) (resid   17   and name HA ) 4.00 3.20 1.5
assign (resid    4   and name HG# ) (resid    4   and name HE# ) 4.00 2.20 1.00
assign (resid   18   and name HG2+ ) (resid    3   and name HN ) 4.00 3.20 1.5
assign (resid   18   and name HG2+      ) (resid   19   and name HA     ) 4.00 3.20 1.5
assign (resid   18   and name HB ) (resid   17   and name HA ) 4.00 2.20 1.00
assign (resid   44   and name HG#+ ) (resid   53   and name HB ) 4.00 3.20 1.5
assign (resid   47   and name HB# ) (resid   45   and name HE# ) 4.00 2.20 1.00
assign (resid   11   and name HG2+ ) (resid   11   and name HN ) 4.00 3.20 1.5
assign (resid   18   and name HB ) (resid   18   and name HN ) 4.00 2.20 1.00
assign (resid   17   and name HA ) (resid   17   and name HN ) 4.00 2.20 1.00
assign (resid   34   and name HA ) (resid   37   and name HN ) 4.00 2.20 1.00
assign (resid   54   and name HG1+ ) (resid   43   and name HD1 ) 4.00 3.20 1.5
assign (resid   54   and name HG2+ ) (resid   43   and name HD1 ) 4.00 3.20 1.5
assign (resid   54   and name HB ) (resid   43   and name HZ2 ) 4.00 2.20 1.00
assign (resid   13   and name HA ) (resid   13   and name HN ) 4.00 2.20 1.00
assign (resid   13   and name HB# ) (resid   13   and name HA ) 4.00 2.20 1.00
assign (resid   54   and name HG1+ ) (resid   43   and name HE1 ) 4.00 3.20 1.5
assign (resid   54   and name HG2+ ) (resid   43   and name HE1 ) 4.00 3.20 1.5
assign (resid   12   and name HA ) (resid   11   and name HN ) 4.00 2.20 1.00
assign (resid   54   and name HG2+ ) (resid   54   and name HN ) 4.00 3.20 1.5
assign (resid   54   and name HA ) (resid   54   and name HG#+ ) 4.00 3.20 1.5
assign (resid   54   and name HG2+ ) (resid   43   and name HZ2 ) 4.00 3.20 1.5
assign (resid   54   and name HG2+ ) (resid   42   and name HN ) 4.00 3.20 1.5
assign (resid   14   and name HN ) (resid    7   and name HN ) 4.00 2.20 1.00
assign (resid   54   and name HN ) (resid    8   and name HN ) 4.00 2.20 1.00
assign (resid   54   and name HG1+ ) (resid    8   and name HN ) 4.00 3.20 1.5
assign (resid   15   and name HA ) (resid    7   and name HN ) 4.00 2.20 1.00
assign (resid   54   and name HG1+ ) (resid   34   and name HG1# ) 4.00 3.20 1.5
assign (resid   54   and name HG2+ ) (resid   41   and name HN ) 4.00 3.20 1.5
assign (resid   54   and name HG2+ ) (resid   41   and name HA1 ) 4.00 3.20 1.5
assign (resid   13   and name HD# ) (resid   13   and name HA ) 4.00 2.20 1.00
assign (resid   54   and name HG2+ ) (resid   34   and name HB ) 4.00 3.20 1.5
assign (resid   13   and name HA ) (resid    9   and name HN ) 4.00 2.20 1.00
assign (resid    2   and name HG2+ ) (resid    2   and name HN ) 4.00 3.20 1.5
assign (resid    2   and name HG2+      ) (resid   19   and name HG#    ) 4.00 3.20 1.5
assign (resid    2   and name HA ) (resid    3   and name HD# ) 4.00 2.20 1.00
assign (resid   55   and name HG2+ ) (resid   55   and name HN ) 4.00 3.20 1.5
assign (resid   56   and name HB# ) (resid   10   and name HN ) 4.00 2.20 1.00
assign (resid   51   and name HN ) (resid   50   and name HN ) 4.00 2.20 1.00
assign (resid    2   and name HA ) (resid    1   and name HA ) 4.00 2.20 1.00
assign (resid    2   and name HA ) (resid    2   and name HN ) 4.00 2.20 1.00
assign (resid   12   and name HD1+ ) (resid   12   and name HN ) 4.00 3.20 1.5
assign (resid   56   and name HG1 ) (resid   40   and name HN ) 4.00 2.20 1.00
assign (resid    2   and name HG2+ ) (resid   18   and name HN ) 4.00 3.20 1.5
assign (resid   55   and name HA ) (resid    8   and name HD21 ) 4.00 2.20 1.00
assign (resid   54   and name HG1+ ) (resid   55   and name HN ) 4.00 3.20 1.5
assign (resid   54   and name HG2+ ) (resid   55   and name HN ) 4.00 3.20 1.5
assign (resid   54   and name HG#+ ) (resid   54   and name HN ) 4.00 3.20 1.5
assign (resid   55   and name HA ) (resid    8   and name HN ) 4.00 2.20 1.00
assign (resid   55   and name HA ) (resid   55   and name HN ) 4.00 2.20 1.00
assign (resid   55   and name HG2+ ) (resid    8   and name HD22 ) 4.00 3.20 1.5
assign (resid   12   and name HB# ) (resid   13   and name HN ) 4.00 2.20 1.00
assign (resid   13   and name HA ) (resid    7   and name HA ) 4.00 2.20 1.00
assign (resid   13   and name HA ) (resid    8   and name HN ) 4.00 2.20 1.00
assign (resid   54   and name HG1+ ) (resid    7   and name HG11 ) 4.00 3.20 1.5
assign (resid   54   and name HG1+ ) (resid    7   and name HG12 ) 4.00 3.20 1.5
assign (resid   51   and name HG2+ ) (resid    6   and name HN ) 4.00 3.20 1.5
assign (resid    3   and name HB2 ) (resid    4   and name HN ) 4.00 2.20 1.00
assign (resid   51   and name HG2+ ) (resid    4   and name HN ) 4.00 3.20 1.5
assign (resid    3   and name HD# ) (resid    4   and name HN ) 4.00 2.20 1.00
assign (resid   51   and name HN ) (resid   46   and name HN ) 4.00 2.20 1.00
assign (resid   51   and name HG2+ ) (resid   52   and name HN ) 4.00 3.20 1.5
assign (resid   15   and name HB# ) (resid   16   and name HN ) 4.00 2.20 1.00
assign (resid   51   and name HB ) (resid   51   and name HN ) 4.00 2.20 1.00
assign (resid   15   and name HB# ) (resid   16   and name HN ) 4.00 2.20 1.00
assign (resid   50   and name HA ) (resid   51   and name HN ) 4.00 2.20 1.00
assign (resid   50   and name HN ) (resid   48   and name HN ) 4.00 2.20 1.00
assign (resid   50   and name HB2 ) (resid   45   and name HE# ) 4.00 2.20 1.00
assign (resid   50   and name HE2 ) (resid    3   and name HD# ) 4.00 2.20 1.00
assign (resid   50   and name HA ) (resid   49   and name HN ) 4.00 2.20 1.00
assign (resid   50   and name HB2 ) (resid   50   and name HN ) 4.00 2.20 1.00
assign (resid    3   and name HB3 ) (resid   18   and name HN ) 4.00 2.20 1.00
assign (resid   50   and name HB3 ) (resid   50   and name HN ) 4.00 2.20 1.00
assign (resid   16   and name HG2+ ) (resid   15   and name HA ) 4.00 3.20 1.5
assign (resid    3   and name HD# ) (resid   18   and name HN ) 4.00 2.20 1.00
assign (resid   52   and name HB# ) (resid    5   and name HA ) 4.00 2.20 1.00
assign (resid   15   and name HB# ) (resid   15   and name HN ) 4.00 2.20 1.00
assign (resid   11   and name HB ) (resid   12   and name HN ) 4.00 2.20 1.00
assign (resid   53   and name HB ) (resid   53   and name HA ) 4.00 2.20 1.00
assign (resid   53   and name HG2+ ) (resid    8   and name HN ) 4.00 3.20 1.5
assign (resid   53   and name HG2+ ) (resid   54   and name HN ) 4.00 3.20 1.5
assign (resid   12   and name HN ) (resid   10   and name HN ) 4.00 2.20 1.00
assign (resid   54   and name HG1+ ) (resid    5   and name HG ) 4.00 3.20 1.5
assign (resid   11   and name HG2+ ) (resid   12   and name HN ) 4.00 3.20 1.5
assign (resid   53   and name HG2+ ) (resid   55   and name HN ) 4.00 3.20 1.5
assign (resid   15   and name HG# ) (resid   15   and name HA ) 4.00 2.20 1.00
assign (resid   52   and name HB# ) (resid   52   and name HA ) 4.00 2.20 1.00
assign (resid   52   and name HA ) (resid   52   and name HD1 ) 4.00 2.20 1.00
assign (resid   52   and name HA ) (resid   46   and name HN ) 4.00 2.20 1.00
assign (resid   52   and name HB# ) (resid    5   and name HA ) 4.00 2.20 1.00
assign (resid   15   and name HG# ) (resid   15   and name HN ) 4.00 2.20 1.00
assign (resid   53   and name HA ) (resid    6   and name HN ) 4.00 2.20 1.00
assign (resid   52   and name HD1 ) (resid   52   and name HN ) 4.00 2.20 1.00
assign (resid   15   and name HG# ) (resid   15   and name HN ) 4.00 2.20 1.00
assign (resid   52   and name HB# ) (resid   52   and name HA ) 4.00 2.20 1.00
assign (resid   15   and name HG# ) (resid   15   and name HA ) 4.00 2.20 1.00
assign (resid   19   and name HG2 ) (resid   19   and name HA ) 4.00 2.20 1.00
assign (resid    7   and name HD1+ ) (resid    7   and name HN ) 4.00 3.20 1.5
assign (resid   26   and name HN ) (resid   25   and name HN ) 4.00 2.20 1.00
assign (resid   33   and name HB2 ) (resid   33   and name HE# ) 4.00 2.20 1.00
assign (resid   26   and name HN ) (resid   24   and name HN ) 4.00 2.20 1.00
assign (resid   33   and name HD2 ) (resid   34   and name HN ) 4.00 2.20 1.00
assign (resid   33   and name HB2 ) (resid   34   and name HN ) 4.00 2.20 1.00
assign (resid   33   and name HB3 ) (resid   34   and name HN ) 4.00 2.20 1.00
assign (resid   26   and name HB+ ) (resid   19   and name HN ) 4.00 3.20 1.5
assign (resid   33   and name HB3 ) (resid   33   and name HE# ) 4.00 2.20 1.00
assign (resid   32   and name HB# ) (resid   35   and name HB# ) 4.00 2.20 1.00
assign (resid   32   and name HA ) (resid   35   and name HD21 ) 4.00 2.20 1.00
assign (resid   32   and name HA ) (resid   34   and name HN ) 4.00 2.20 1.00
assign (resid   32   and name HN ) (resid   33   and name HN ) 4.00 2.20 1.00
assign (resid   33   and name HB3 ) (resid   30   and name HA ) 4.00 2.20 1.00
assign (resid   33   and name HA ) (resid   33   and name HE# ) 4.00 2.20 1.00
assign (resid   26   and name HB+ ) (resid   28   and name HN ) 4.00 3.20 1.5
assign (resid   26   and name HA ) (resid   29   and name HN ) 4.00 2.20 1.00
assign (resid   26   and name HA ) (resid   30   and name HN ) 4.00 2.20 1.00
assign (resid   27   and name HA ) (resid   27   and name HN ) 4.00 2.20 1.00
assign (resid   33   and name HN ) (resid   34   and name HN ) 4.00 2.20 1.00
assign (resid   25   and name HA ) (resid   26   and name HN ) 4.00 2.20 1.00
assign (resid   34   and name HN ) (resid   35   and name HN ) 4.00 2.20 1.00
assign (resid   34   and name HB ) (resid   35   and name HN ) 4.00 2.20 1.00
assign (resid   34   and name HA ) (resid   35   and name HN ) 4.00 2.20 1.00
assign (resid   34   and name HB ) (resid   43   and name HH2 ) 4.00 2.20 1.00
assign (resid    6   and name HD1+ ) (resid   14   and name HN ) 4.00 3.20 1.5
assign (resid   34   and name HD1+ ) (resid   43   and name HH2 ) 4.00 3.20 1.5
assign (resid   34   and name HD1+ ) (resid   43   and name HE1 ) 4.00 3.20 1.5
assign (resid    6   and name HA ) (resid   16   and name HN ) 4.00 2.20 1.00
assign (resid    6   and name HG1# ) (resid   16   and name HN ) 4.00 2.20 1.00
assign (resid   25   and name HA ) (resid   29   and name HN ) 4.00 2.20 1.00
assign (resid    7   and name HB ) (resid    6   and name HA ) 4.00 2.20 1.00
assign (resid   34   and name HA ) (resid   34   and name HN ) 4.00 2.20 1.00
assign (resid   34   and name HB ) (resid   33   and name HD2 ) 4.00 2.20 1.00
assign (resid   25   and name HA ) (resid   28   and name HN ) 4.00 2.20 1.00
assign (resid   10   and name HD# ) (resid   10   and name HA ) 4.00 2.20 1.00
assign (resid    6   and name HG2+ ) (resid   54   and name HN ) 4.00 3.20 1.5
assign (resid   34   and name HG1# ) (resid   34   and name HN ) 4.00 2.20 1.00
assign (resid   34   and name HD1+ ) (resid   34   and name HN ) 4.00 3.20 1.5
assign (resid    7   and name HG2+ ) (resid    7   and name HN ) 4.00 3.20 1.5
assign (resid   29   and name HG1+ ) (resid   29   and name HG2+ ) 3.00 1.20 1.3
assign (resid   30   and name HD2+ ) (resid   18   and name HN ) 4.00 3.20 1.5
assign (resid    8   and name HA ) (resid    8   and name HN ) 4.00 2.20 1.00
assign (resid   28   and name HD# ) (resid   25   and name HB ) 4.00 2.20 1.00
assign (resid   28   and name HD# ) (resid   28   and name HN ) 4.00 2.20 1.00
assign (resid   28   and name HA ) (resid   31   and name HN ) 4.00 2.20 1.00
assign (resid   30   and name HD1+ ) (resid   30   and name HN ) 4.00 3.20 1.5
assign (resid   29   and name HG2+ ) (resid   28   and name HN ) 4.00 3.20 1.5
assign (resid    7   and name HB ) (resid   15   and name HA ) 4.00 2.20 1.00
assign (resid   29   and name HG1+ ) (resid   29   and name HN ) 4.00 3.20 1.5
assign (resid   29   and name HG1+ ) (resid   30   and name HN ) 4.00 3.20 1.5
assign (resid    8   and name HB2 ) (resid    8   and name HD21 ) 4.00 2.20 1.00
assign (resid    8   and name HB3 ) (resid    8   and name HD21 ) 4.00 2.20 1.00
assign (resid    8   and name HB2 ) (resid    8   and name HD22 ) 4.00 2.20 1.00
assign (resid    8   and name HB3 ) (resid    8   and name HD22   ) 4.00 2.20 1.00
assign (resid   29   and name HA ) (resid   30   and name HN ) 4.00 2.20 1.00
assign (resid    8   and name HB2 ) (resid    8   and name HN ) 4.00 2.20 1.00
assign (resid   29   and name HA ) (resid   33   and name HN ) 4.00 2.20 1.00
assign (resid   29   and name HG1+ ) (resid   32   and name HB# ) 4.00 3.20 1.5
assign (resid   29   and name HA ) (resid   32   and name HN ) 4.00 2.20 1.00
assign (resid   29   and name HA ) (resid   31   and name HN ) 4.00 2.20 1.00
assign (resid    7   and name HG2+ ) (resid   14   and name HN ) 4.00 3.20 1.5
assign (resid   32   and name HB# ) (resid   30   and name HA ) 4.00 2.20 1.00
assign (resid   28   and name HG# ) (resid   28   and name HN ) 4.00 2.20 1.00
assign (resid   31   and name HA ) (resid   34   and name HN ) 4.00 2.20 1.00
assign (resid   28   and name HG# ) (resid   28   and name HN ) 4.00 2.20 1.00
assign (resid   28   and name HD1 ) (resid   26   and name HN ) 4.00 2.20 1.00
assign (resid   27   and name HA ) (resid   28   and name HN ) 4.00 2.20 1.00
assign (resid   32   and name HB# ) (resid   33   and name HB3 ) 4.00 2.20 1.00
assign (resid    7   and name HG2+ ) (resid    9   and name HA2 ) 4.00 3.20 1.5
assign (resid    7   and name HG2+      ) (resid    9   and name HA1    ) 4.00 3.20 1.5
assign (resid   32   and name HG# ) (resid   32   and name HN ) 4.00 2.20 1.00
assign (resid   30   and name HD1+ ) (resid   33   and name HD# ) 4.00 3.20 1.5
assign (resid    7   and name HG1# ) (resid   14   and name HN ) 4.00 2.20 1.00
assign (resid   30   and name HN ) (resid   31   and name HN ) 4.00 2.20 1.00
assign (resid    7   and name HG1# ) (resid   14   and name HN ) 4.00 2.20 1.00
assign (resid   30   and name HD2+ ) (resid   33   and name HN ) 4.00 3.20 1.5
assign (resid    9   and name HN ) (resid    8   and name HN ) 4.00 2.20 1.00
assign (resid   31   and name HB3 ) (resid   31   and name HN ) 4.00 2.20 1.00
assign (resid   31   and name HA ) (resid   31   and name HN ) 4.00 2.20 1.00
assign (resid    8   and name HB2 ) (resid    9   and name HN ) 4.00 2.20 1.00
assign (resid    6   and name HA ) (resid   14   and name HN ) 4.00 2.20 1.00
assign (resid   41   and name HA1 ) (resid   55   and name HN ) 4.00 2.20 1.00
assign (resid   41   and name HN ) (resid   43   and name HE1 ) 4.00 2.20 1.00
assign (resid   19   and name HG# ) (resid   20   and name HN ) 4.00 2.20 1.00
assign (resid   11   and name HB ) (resid   11   and name HA ) 3.00 1.20 0.30
assign (resid    5   and name HD1+      ) (resid   30   and name HA     ) 4.00 3.20 1.5
assign (resid    5   and name HD1+ ) (resid   43   and name HZ2 ) 4.00 3.20 1.5
assign (resid   42   and name HG# ) (resid   42   and name HN ) 4.00 2.20 1.00
assign (resid   19   and name HG# ) (resid   19   and name HN ) 4.00 2.20 1.00
assign (resid   42   and name HB2 ) (resid   42   and name HG# ) 4.00 2.20 1.00
assign (resid   19   and name HG# ) (resid   19   and name HN ) 4.00 2.20 1.00
assign (resid   20   and name HB+ ) (resid   19   and name HA ) 4.00 3.20 1.5
assign (resid   21   and name HB ) (resid   21   and name HN ) 4.00 2.20 1.00
assign (resid   39   and name HB ) (resid   40   and name HN ) 4.00 2.20 1.00
assign (resid    5   and name HA ) (resid   52   and name HN ) 4.00 2.20 1.00
assign (resid   39   and name HG1# ) (resid   39   and name HA ) 4.00 2.20 1.00
assign (resid   40   and name HB# ) (resid   40   and name HN ) 4.00 2.20 1.00
assign (resid   21   and name HN ) (resid   20   and name HN ) 4.00 2.20 1.00
assign (resid   40   and name HB# ) (resid   41   and name HN ) 4.00 2.20 1.00
assign (resid   40   and name HB# ) (resid   40   and name HN ) 4.00 2.20 1.00
assign (resid   42   and name HG# ) (resid   42   and name HN ) 4.00 2.20 1.00
assign (resid   11   and name HB ) (resid   11   and name HN ) 3.00 1.20 0.30
assign (resid    5   and name HD1+ ) (resid    6   and name HN ) 4.00 3.20 1.5
assign (resid    5   and name HD2+      ) (resid    6   and name HN     ) 4.00 3.20 1.5
assign (resid    5   and name HG ) (resid    6   and name HN ) 4.00 2.20 1.00
assign (resid   43   and name HA ) (resid   43   and name HN ) 4.00 2.20 1.00
assign (resid   43   and name HB2 ) (resid   43   and name HD1 ) 4.00 2.20 1.00
assign (resid   43   and name HH2 ) (resid   43   and name HE3 ) 4.00 2.20 1.00
assign (resid   18   and name HG2+ ) (resid   30   and name HN ) 4.00 3.20 1.5
assign (resid   43   and name HB2 ) (resid   43   and name HN ) 4.00 2.20 1.00
assign (resid   19   and name HA ) (resid    3   and name HD2 ) 4.00 2.20 1.00
assign (resid   43   and name HA ) (resid   43   and name HE3 ) 4.00 2.20 1.00
assign (resid   42   and name HB2 ) (resid   55   and name HN ) 4.00 2.20 1.00
assign (resid   42   and name HB3 ) (resid   55   and name HB ) 4.00 2.20 1.00
assign (resid   42   and name HG# ) (resid   43   and name HN ) 4.00 2.20 1.00
assign (resid   19   and name HG# ) (resid   19   and name HN ) 4.00 2.20 1.00
assign (resid    5   and name HB2 ) (resid   16   and name HN ) 4.00 2.20 1.00
assign (resid   43   and name HA ) (resid   43   and name HD1 ) 4.00 2.20 1.00
assign (resid   43   and name HH2 ) (resid   31   and name HN ) 4.00 2.20 1.00
assign (resid   42   and name HN ) (resid   55   and name HN ) 4.00 2.20 1.00
assign (resid   42   and name HB3 ) (resid   55   and name HN ) 4.00 2.20 1.00
assign (resid   39   and name HD1+ ) (resid   39   and name HN ) 4.00 3.20 1.5
assign (resid   35   and name HA ) (resid   38   and name HN ) 4.00 2.20 1.00
assign (resid   35   and name HB# ) (resid   36   and name HN ) 4.00 2.20 1.00
assign (resid    6   and name HD1+ ) (resid    7   and name HN ) 4.00 3.20 1.5
assign (resid   35   and name HA ) (resid   39   and name HN ) 4.00 2.20 1.00
assign (resid   36   and name HA ) (resid   38   and name HN ) 4.00 2.20 1.00
assign (resid   36   and name HB3 ) (resid   37   and name HN ) 4.00 2.20 1.00
assign (resid   36   and name HA ) (resid   37   and name HN ) 4.00 2.20 1.00
assign (resid   36   and name HB3 ) (resid   36   and name HN ) 4.00 2.20 1.00
assign (resid   35   and name HB# ) (resid   35   and name HD22 ) 4.00 2.20 1.00
assign (resid   25   and name HA ) (resid   25   and name HN ) 4.00 2.20 1.00
assign (resid   34   and name HG1# ) (resid   43   and name HZ2 ) 4.00 2.20 1.00
assign (resid   34   and name HG1# ) (resid   43   and name HH2 ) 4.00 2.20 1.00
assign (resid   34   and name HG1# ) (resid   43   and name HZ3 ) 4.00 2.20 1.00
assign (resid   10   and name HD# ) (resid   10   and name HA ) 4.00 2.20 1.00
assign (resid   35   and name HB# ) (resid   35   and name HD21 ) 4.00 2.20 1.00
assign (resid    6   and name HG2+ ) (resid    8   and name HA ) 4.00 3.20 1.5
assign (resid   37   and name HA ) (resid   37   and name HN ) 3.00 1.20 0.30
assign (resid   39   and name HG1# ) (resid   37   and name HD21 ) 4.00 2.20 1.00
assign (resid    6   and name HA ) (resid    6   and name HN ) 4.00 2.20 1.00
assign (resid    6   and name HB ) (resid    6   and name HN ) 4.00 2.20 1.00
assign (resid   22   and name HB2 ) (resid   22   and name HN ) 4.00 2.20 1.00
assign (resid   22   and name HB3       ) (resid   22   and name HN     ) 4.00 2.20 1.00
assign (resid   10   and name HB# ) (resid   12   and name HN ) 4.00 2.20 1.00
assign (resid   21   and name HA ) (resid   22   and name HN ) 4.00 2.20 1.00
assign (resid    5   and name HB3 ) (resid   27   and name HA ) 4.00 2.20 1.00
assign (resid    5   and name HD1+ ) (resid   53   and name HA ) 4.00 3.20 1.5
assign (resid   38   and name HN ) (resid   39   and name HN ) 4.00 2.20 1.00
assign (resid   23   and name HA ) (resid   24   and name HN ) 4.00 2.20 1.00
assign (resid   37   and name HB3 ) (resid   37   and name HD22 ) 4.00 2.20 1.00
assign (resid   37   and name HB2 ) (resid   37   and name HN ) 4.00 2.20 1.00
assign (resid   22   and name HB2 ) (resid   24   and name HN ) 4.00 2.20 1.00
assign (resid   22   and name HB3 ) (resid   24   and name HN ) 4.00 2.20 1.00
assign (resid   38   and name HN ) (resid   37   and name HN ) 4.00 2.20 1.00
assign (resid   10   and name HA ) (resid   11   and name HN ) 4.00 2.20 1.00
assign (resid    3   and name HN        ) (resid   18   and name HN     ) 4.00 2.20 1.00
assign (resid   19   and name HA        ) (resid    2   and name HA     ) 4.00 2.20 1.00
assign (resid    3 and  name N    ) (resid   18 and  name O    ) 3.3 0.9 0.2
assign (resid    5 and  name N    ) (resid   16 and  name O    ) 3.3 0.9 0.2
assign (resid    7 and  name N    ) (resid   14 and  name O    ) 3.3 0.9 0.2
assign (resid    4 and  name N    ) (resid   50 and  name O    ) 3.3 0.9 0.2
assign (resid   52 and  name N    ) (resid    4 and  name O    ) 3.3 0.9 0.2
assign (resid    6 and  name N    ) (resid   52 and  name O    ) 3.3 0.9 0.2
assign (resid   55 and  name N    ) (resid   42 and  name O    ) 3.3 0.9 0.2
assign (resid   56 and  name N    ) (resid    8 and  name 0    ) 3.3 0.9 0.2
assign (resid   46 and  name N    ) (resid   51 and  name O    ) 3.3 0.9 0.2
assign (resid   50 and  name N    ) (resid   46 and  name O    ) 3.3 0.9 0.2
assign (resid   51 and  name N    ) (resid   46 and  name O    ) 3.3 0.9 0.2
assign (resid   22 and  name O    ) (resid   26 and  name N    ) 3.3 0.9 0.2
assign (resid   24 and  name O    ) (resid   28 and  name N    ) 3.3 0.9 0.2
assign (resid   25 and  name O    ) (resid   29 and  name N    ) 3.3 0.9 0.2
assign (resid   26 and  name O    ) (resid   30 and  name N    ) 3.3 0.9 0.2
assign (resid   27 and  name O    ) (resid   31 and  name N    ) 3.3 0.9 0.2
assign (resid   30 and  name O    ) (resid   34 and  name N    ) 3.3 0.9 0.2
assign (resid   34 and  name O    ) (resid   39 and  name N    ) 3.3 0.9 0.2
assign (resid    3 and  name HN   ) (resid   18 and  name O    ) 2.3 0.8 0.5
assign (resid    5 and  name HN   ) (resid   16 and  name O    ) 2.3 0.8 0.5
assign (resid    7 and  name HN   ) (resid   14 and  name O    ) 2.3 0.8 0.5
assign (resid    4 and  name HN   ) (resid   50 and  name O    ) 2.3 0.8 0.5
assign (resid   52 and  name HN   ) (resid    4 and  name O    ) 2.3 0.8 0.5
assign (resid    6 and  name HN   ) (resid   52 and  name O    ) 2.3 0.8 0.5
assign (resid   55 and  name HN   ) (resid   42 and  name O    ) 2.3 0.8 0.5
assign (resid   56 and  name HN   ) (resid    8 and  name O    ) 2.3 0.8 0.5
assign (resid   46 and  name HN   ) (resid   51 and  name O    ) 2.3 0.8 0.5
assign (resid   50 and  name HN   ) (resid   46 and  name O    ) 2.3 0.8 0.5
assign (resid   51 and  name HN   ) (resid   46 and  name O    ) 2.3 0.8 0.5
assign (resid   22 and  name O    ) (resid   26 and  name HN   ) 2.3 0.8 0.5
assign (resid   24 and  name O    ) (resid   28 and  name HN   ) 2.3 0.8 0.5
assign (resid   25 and  name O    ) (resid   29 and  name HN   ) 2.3 0.8 0.5
assign (resid   26 and  name O    ) (resid   30 and  name HN   ) 2.3 0.8 0.5
assign (resid   27 and  name O    ) (resid   31 and  name HN   ) 2.3 0.8 0.5
assign (resid   30 and  name O    ) (resid   34 and  name HN   ) 2.3 0.8 0.5
assign (resid   34 and  name O    ) (resid   39 and  name HN   ) 2.3 0.8 0.5
restraints
 dihedral
 
 reset

  !!2
assign (resid 2 and name n)    (resid 2 and name ca)
       (resid 2 and name cb)   (resid 2 and name og1) 1.0 -60.0 120.0 2
  !!3
assign (resid 3 and name n)    (resid 3 and name ca)
       (resid 3 and name cb)   (resid 3 and name cg) 1.0 -60.0 120.0 2
  !!5
assign (resid 5 and name n)    (resid 5 and name ca)
       (resid 5 and name cb)   (resid 5 and name cg) 1.0 180.0 120.0 2
  !!12
assign (resid 12 and name n)    (resid 12 and name ca)
       (resid 12 and name cb)   (resid 12 and name cg) 1.0 -60.0 120.0 2
  !!22
assign (resid 22 and name n)    (resid 22 and name ca)
       (resid 22 and name cb)   (resid 22 and name cg) 1.0 60.0 120.0 2
  !!25
assign (resid 25 and name n)    (resid 25 and name ca)
       (resid 25 and name cb)   (resid 25 and name og1) 1.0 -60.0 120.0 2
  !!33
assign (resid 33 and name n)    (resid 33 and name ca)
       (resid 33 and name cb)   (resid 33 and name cg) 1.0 180.0 120.0 2
  !!51
assign (resid 51 and name n)    (resid 51 and name ca)
       (resid 51 and name cb)   (resid 51 and name og1) 1.0 -60.0 120.0 2
  !!53
assign (resid 53 and name n)    (resid 53 and name ca)
       (resid 53 and name cb)   (resid 53 and name og1) 1.0 -60.0 120.0 2
  !!55
assign (resid 55 and name n)    (resid 55 and name ca)
       (resid 55 and name cb)   (resid 55 and name og1) 1.0 -60.0 120.0 2

end


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    THR   1          HT1       THR   1  15.186   3.228   5.557
    2   2H    THR   1          HT2       THR   1  16.059   4.278   4.546
    3   3H    THR   1          HT3       THR   1  15.662   2.714   4.012
    4    HA   THR   1           HA       THR   1  13.706   4.887   4.583
    5    HB   THR   1           HB       THR   1  14.699   3.636   2.000
    6    HG1  THR   1           HG1      THR   1  16.303   4.931   2.555
    7   1HG2  THR   1          HG21      THR   1  12.468   4.396   1.675
    8   2HG2  THR   1          HG22      THR   1  13.493   5.691   1.058
    9   3HG2  THR   1          HG23      THR   1  12.740   5.843   2.646
   10    H    THR   2           HN       THR   2  11.594   4.162   4.652
   11    HA   THR   2           HA       THR   2  11.100   1.265   4.029
   12    HB   THR   2           HB       THR   2   9.691   3.001   6.075
   13    HG1  THR   2           HG1      THR   2  11.081   1.918   7.564
   14   1HG2  THR   2          HG21      THR   2   8.934   0.891   6.979
   15   2HG2  THR   2          HG22      THR   2   9.964  -0.008   5.864
   16   3HG2  THR   2          HG23      THR   2   8.581   0.899   5.251
   17    H    PHE   3           HN       PHE   3   9.296   0.822   2.765
   18    HA   PHE   3           HA       PHE   3   8.110   2.952   1.199
   19   1HB   PHE   3          HB2       PHE   3   7.349   0.033   1.588
   20   2HB   PHE   3          HB1       PHE   3   6.787   1.063   0.272
   21    HD1  PHE   3           HD1      PHE   3   9.034   2.524  -0.668
   22    HD2  PHE   3           HD2      PHE   3   8.939  -1.504   0.831
   23    HE1  PHE   3           HE1      PHE   3  11.086   1.995  -1.956
   24    HE2  PHE   3           HE2      PHE   3  10.991  -2.029  -0.457
   25    HZ   PHE   3           HZ       PHE   3  12.065  -0.280  -1.849
   26    H    LYS   4           HN       LYS   4   5.713   3.354   1.127
   27    HA   LYS   4           HA       LYS   4   4.290   2.815   3.699
   28   1HB   LYS   4          HB2       LYS   4   5.554   5.021   3.708
   29   2HB   LYS   4          HB1       LYS   4   4.498   5.544   2.405
   30   1HG   LYS   4          HG2       LYS   4   2.524   5.159   3.821
   31   2HG   LYS   4          HG1       LYS   4   3.568   4.626   5.137
   32   1HD   LYS   4          HD2       LYS   4   4.240   6.749   5.647
   33   2HD   LYS   4          HD1       LYS   4   4.235   7.264   3.961
   34   1HE   LYS   4          HE2       LYS   4   2.304   8.367   4.462
   35   2HE   LYS   4          HE1       LYS   4   1.532   6.769   4.511
   36   1HZ   LYS   4          HZ1       LYS   4   2.361   6.585   6.841
   37   2HZ   LYS   4          HZ2       LYS   4   1.180   7.786   6.619
   38   3HZ   LYS   4          HZ3       LYS   4   2.817   8.216   6.764
   39    H    LEU   5           HN       LEU   5   2.010   2.851   3.488
   40    HA   LEU   5           HA       LEU   5   0.828   3.477   0.834
   41   1HB   LEU   5          HB2       LEU   5   1.639   0.971   1.272
   42   2HB   LEU   5          HB1       LEU   5   0.120   0.881   2.156
   43    HG   LEU   5           HG       LEU   5  -0.245   2.212  -0.414
   44   1HD1  LEU   5          HD11      LEU   5   0.353   0.538  -1.933
   45   2HD1  LEU   5          HD12      LEU   5   0.446  -0.706  -0.675
   46   3HD1  LEU   5          HD13      LEU   5   1.715   0.517  -0.806
   47   1HD2  LEU   5          HD21      LEU   5  -1.384  -0.308   0.837
   48   2HD2  LEU   5          HD22      LEU   5  -2.016   0.471  -0.614
   49   3HD2  LEU   5          HD23      LEU   5  -2.075   1.312   0.936
   50    H    ILE   6           HN       ILE   6  -1.224   4.317   1.070
   51    HA   ILE   6           HA       ILE   6  -2.350   4.402   3.839
   52    HB   ILE   6           HB       ILE   6  -2.658   6.149   1.382
   53   1HG1  ILE   6          HG12      ILE   6  -0.474   6.282   2.550
   54   2HG1  ILE   6          HG11      ILE   6  -1.386   7.783   2.707
   55   1HG2  ILE   6          HG21      ILE   6  -4.636   6.737   2.338
   56   2HG2  ILE   6          HG22      ILE   6  -3.631   7.612   3.493
   57   3HG2  ILE   6          HG23      ILE   6  -4.217   5.994   3.882
   58   1HD1  ILE   6          HD11      ILE   6  -1.122   7.603   4.940
   59   2HD1  ILE   6          HD12      ILE   6  -0.448   5.981   4.782
   60   3HD1  ILE   6          HD13      ILE   6  -2.194   6.203   4.891
   61    H    ILE   7           HN       ILE   7  -4.262   3.358   4.208
   62    HA   ILE   7           HA       ILE   7  -5.589   1.907   2.024
   63    HB   ILE   7           HB       ILE   7  -6.175   2.186   4.993
   64   1HG1  ILE   7          HG12      ILE   7  -4.791  -0.077   3.526
   65   2HG1  ILE   7          HG11      ILE   7  -3.915   1.230   4.324
   66   1HG2  ILE   7          HG21      ILE   7  -8.146   1.378   3.863
   67   2HG2  ILE   7          HG22      ILE   7  -7.366  -0.016   4.608
   68   3HG2  ILE   7          HG23      ILE   7  -7.193   0.270   2.877
   69   1HD1  ILE   7          HD11      ILE   7  -5.517  -0.988   5.524
   70   2HD1  ILE   7          HD12      ILE   7  -5.509   0.567   6.356
   71   3HD1  ILE   7          HD13      ILE   7  -3.993  -0.285   6.065
   72    H    ASN   8           HN       ASN   8  -7.098   2.940   0.790
   73    HA   ASN   8           HA       ASN   8  -8.722   5.133   2.027
   74   1HB   ASN   8          HB2       ASN   8  -7.732   4.477  -0.746
   75   2HB   ASN   8          HB1       ASN   8  -9.093   5.577  -0.524
   76   1HD2  ASN   8          HD21      ASN   8  -7.729   7.379  -1.326
   77   2HD2  ASN   8          HD22      ASN   8  -6.544   8.071  -0.313
   78    H    GLY   9           HN       GLY   9  -9.599   2.649   2.725
   79   1HA   GLY   9          HA2       GLY   9 -11.563   1.658   0.777
   80   2HA   GLY   9          HA1       GLY   9 -11.286   1.005   2.396
   81    H    LYS  10           HN       LYS  10 -13.832   1.795   1.056
   82    HA   LYS  10           HA       LYS  10 -14.918   4.215   1.997
   83   1HB   LYS  10          HB2       LYS  10 -16.187   1.485   1.627
   84   2HB   LYS  10          HB1       LYS  10 -17.081   3.003   1.728
   85   1HG   LYS  10          HG2       LYS  10 -15.582   3.801  -0.217
   86   2HG   LYS  10          HG1       LYS  10 -15.169   2.098  -0.427
   87   1HD   LYS  10          HD2       LYS  10 -17.266   1.539  -1.175
   88   2HD   LYS  10          HD1       LYS  10 -18.063   2.745  -0.164
   89   1HE   LYS  10          HE2       LYS  10 -18.321   3.825  -2.187
   90   2HE   LYS  10          HE1       LYS  10 -16.669   4.377  -1.845
   91   1HZ   LYS  10          HZ1       LYS  10 -17.446   1.953  -3.379
   92   2HZ   LYS  10          HZ2       LYS  10 -15.852   2.339  -2.936
   93   3HZ   LYS  10          HZ3       LYS  10 -16.708   3.347  -4.002
   94    H    THR  11           HN       THR  11 -14.446   1.143   3.683
   95    HA   THR  11           HA       THR  11 -15.574   2.380   6.176
   96    HB   THR  11           HB       THR  11 -15.312  -0.545   5.409
   97    HG1  THR  11           HG1      THR  11 -17.494  -0.395   4.915
   98   1HG2  THR  11          HG21      THR  11 -16.616   0.945   7.685
   99   2HG2  THR  11          HG22      THR  11 -15.462  -0.386   7.767
  100   3HG2  THR  11          HG23      THR  11 -17.118  -0.685   7.239
  101    H    LEU  12           HN       LEU  12 -12.929   0.469   4.785
  102    HA   LEU  12           HA       LEU  12 -11.467   0.567   7.390
  103   1HB   LEU  12          HB2       LEU  12 -11.101  -1.001   4.818
  104   2HB   LEU  12          HB1       LEU  12 -10.029  -1.134   6.211
  105    HG   LEU  12           HG       LEU  12 -12.453  -1.468   7.416
  106   1HD1  LEU  12          HD11      LEU  12 -13.864  -2.867   6.051
  107   2HD1  LEU  12          HD12      LEU  12 -12.670  -2.896   4.752
  108   3HD1  LEU  12          HD13      LEU  12 -13.531  -1.403   5.127
  109   1HD2  LEU  12          HD21      LEU  12 -10.702  -3.569   6.101
  110   2HD2  LEU  12          HD22      LEU  12 -11.927  -3.919   7.319
  111   3HD2  LEU  12          HD23      LEU  12 -10.528  -2.929   7.735
  112    H    LYS  13           HN       LYS  13  -9.696   1.893   7.598
  113    HA   LYS  13           HA       LYS  13  -8.284   2.884   5.178
  114   1HB   LYS  13          HB2       LYS  13  -9.878   4.504   7.164
  115   2HB   LYS  13          HB1       LYS  13  -8.557   5.238   6.254
  116   1HG   LYS  13          HG2       LYS  13  -9.630   4.523   4.138
  117   2HG   LYS  13          HG1       LYS  13 -10.966   3.833   5.061
  118   1HD   LYS  13          HD2       LYS  13 -11.848   5.921   4.595
  119   2HD   LYS  13          HD1       LYS  13 -11.035   6.271   6.121
  120   1HE   LYS  13          HE2       LYS  13  -8.962   6.757   4.517
  121   2HE   LYS  13          HE1       LYS  13 -10.256   7.066   3.341
  122   1HZ   LYS  13          HZ1       LYS  13  -9.864   9.080   4.542
  123   2HZ   LYS  13          HZ2       LYS  13  -9.961   8.280   6.037
  124   3HZ   LYS  13          HZ3       LYS  13 -11.347   8.449   5.069
  125    H    GLY  14           HN       GLY  14  -6.532   4.607   6.188
  126   1HA   GLY  14          HA2       GLY  14  -5.279   4.880   8.428
  127   2HA   GLY  14          HA1       GLY  14  -5.194   3.118   8.403
  128    H    GLU  15           HN       GLU  15  -2.856   3.275   8.363
  129    HA   GLU  15           HA       GLU  15  -1.799   3.703   5.610
  130   1HB   GLU  15          HB2       GLU  15   0.062   5.044   6.566
  131   2HB   GLU  15          HB1       GLU  15  -1.500   5.804   6.864
  132   1HG   GLU  15          HG2       GLU  15  -0.703   5.928   9.007
  133   2HG   GLU  15          HG1       GLU  15  -1.309   4.275   9.092
  134    H    THR  16           HN       THR  16   0.491   2.781   5.455
  135    HA   THR  16           HA       THR  16   1.337   0.889   7.534
  136    HB   THR  16           HB       THR  16  -0.566  -0.280   6.506
  137    HG1  THR  16           HG1      THR  16   0.508  -2.107   6.335
  138   1HG2  THR  16          HG21      THR  16   0.940   0.302   3.946
  139   2HG2  THR  16          HG22      THR  16  -0.731   0.707   4.345
  140   3HG2  THR  16          HG23      THR  16  -0.278  -0.971   4.053
  141    H    THR  17           HN       THR  17   3.454   0.088   7.131
  142    HA   THR  17           HA       THR  17   4.759   0.965   4.580
  143    HB   THR  17           HB       THR  17   6.716   1.611   6.042
  144    HG1  THR  17           HG1      THR  17   4.780   1.392   8.100
  145   1HG2  THR  17          HG21      THR  17   4.043   2.984   6.317
  146   2HG2  THR  17          HG22      THR  17   5.388   3.410   5.257
  147   3HG2  THR  17          HG23      THR  17   5.517   3.675   6.996
  148    H    THR  18           HN       THR  18   6.689  -0.313   4.064
  149    HA   THR  18           HA       THR  18   7.062  -2.791   5.656
  150    HB   THR  18           HB       THR  18   5.684  -2.459   3.087
  151    HG1  THR  18           HG1      THR  18   4.921  -3.682   4.809
  152   1HG2  THR  18          HG21      THR  18   7.935  -4.497   3.135
  153   2HG2  THR  18          HG22      THR  18   7.894  -3.040   2.140
  154   3HG2  THR  18          HG23      THR  18   6.707  -4.320   1.879
  155    H    GLU  19           HN       GLU  19   9.078  -3.965   4.835
  156    HA   GLU  19           HA       GLU  19  11.109  -2.017   3.789
  157   1HB   GLU  19          HB2       GLU  19  11.291  -2.516   6.217
  158   2HB   GLU  19          HB1       GLU  19  11.401  -4.236   5.844
  159   1HG   GLU  19          HG2       GLU  19  13.557  -4.075   5.090
  160   2HG   GLU  19          HG1       GLU  19  13.307  -2.468   4.407
  161    H    ALA  20           HN       ALA  20  11.774  -2.709   1.790
  162    HA   ALA  20           HA       ALA  20  12.444  -5.564   1.374
  163   1HB   ALA  20          HB1       ALA  20  10.202  -5.729   0.747
  164   2HB   ALA  20          HB2       ALA  20  10.950  -5.315  -0.795
  165   3HB   ALA  20          HB3       ALA  20  10.145  -4.067   0.158
  166    H    VAL  21           HN       VAL  21  13.212  -5.789  -1.041
  167    HA   VAL  21           HA       VAL  21  15.446  -4.093  -1.493
  168    HB   VAL  21           HB       VAL  21  15.498  -5.240  -3.695
  169   1HG1  VAL  21          HG11      VAL  21  14.525  -7.253  -1.679
  170   2HG1  VAL  21          HG12      VAL  21  16.024  -6.365  -1.404
  171   3HG1  VAL  21          HG13      VAL  21  15.855  -7.392  -2.829
  172   1HG2  VAL  21          HG21      VAL  21  13.270  -5.294  -4.459
  173   2HG2  VAL  21          HG22      VAL  21  12.654  -5.903  -2.924
  174   3HG2  VAL  21          HG23      VAL  21  13.563  -6.969  -3.995
  175    H    ASP  22           HN       ASP  22  12.165  -3.983  -2.873
  176    HA   ASP  22           HA       ASP  22  12.573  -1.137  -3.602
  177   1HB   ASP  22          HB2       ASP  22  11.785  -3.332  -5.551
  178   2HB   ASP  22          HB1       ASP  22  11.826  -1.610  -5.927
  179    H    ALA  23           HN       ALA  23  10.467  -0.104  -4.129
  180    HA   ALA  23           HA       ALA  23   8.343  -0.883  -2.380
  181   1HB   ALA  23          HB1       ALA  23   8.338   1.368  -2.966
  182   2HB   ALA  23          HB2       ALA  23   7.111   0.766  -4.080
  183   3HB   ALA  23          HB3       ALA  23   8.760   1.034  -4.645
  184    H    ALA  24           HN       ALA  24   9.065  -1.731  -5.715
  185    HA   ALA  24           HA       ALA  24   6.502  -2.681  -6.551
  186   1HB   ALA  24          HB1       ALA  24   8.298  -2.386  -8.123
  187   2HB   ALA  24          HB2       ALA  24   7.977  -4.119  -8.073
  188   3HB   ALA  24          HB3       ALA  24   9.360  -3.453  -7.205
  189    H    THR  25           HN       THR  25   9.205  -4.354  -4.925
  190    HA   THR  25           HA       THR  25   7.902  -6.921  -4.728
  191    HB   THR  25           HB       THR  25  10.185  -5.551  -3.265
  192    HG1  THR  25           HG1      THR  25  10.061  -7.600  -5.219
  193   1HG2  THR  25          HG21      THR  25   9.381  -8.474  -3.108
  194   2HG2  THR  25          HG22      THR  25   9.172  -7.298  -1.806
  195   3HG2  THR  25          HG23      THR  25  10.795  -7.739  -2.349
  196    H    ALA  26           HN       ALA  26   8.339  -4.247  -2.373
  197    HA   ALA  26           HA       ALA  26   6.924  -5.427  -0.212
  198   1HB   ALA  26          HB1       ALA  26   6.582  -2.944   0.408
  199   2HB   ALA  26          HB2       ALA  26   7.404  -2.576  -1.113
  200   3HB   ALA  26          HB3       ALA  26   8.248  -3.470   0.151
  201    H    GLU  27           HN       GLU  27   5.715  -3.001  -2.552
  202    HA   GLU  27           HA       GLU  27   3.065  -2.769  -1.873
  203   1HB   GLU  27          HB2       GLU  27   4.260  -1.648  -3.740
  204   2HB   GLU  27          HB1       GLU  27   4.182  -3.143  -4.671
  205   1HG   GLU  27          HG2       GLU  27   1.576  -2.909  -4.073
  206   2HG   GLU  27          HG1       GLU  27   2.016  -1.202  -4.020
  207    H    LYS  28           HN       LYS  28   4.466  -5.570  -3.584
  208    HA   LYS  28           HA       LYS  28   1.987  -6.879  -4.247
  209   1HB   LYS  28          HB2       LYS  28   4.731  -8.003  -3.548
  210   2HB   LYS  28          HB1       LYS  28   3.463  -8.878  -4.405
  211   1HG   LYS  28          HG2       LYS  28   3.705  -7.611  -6.341
  212   2HG   LYS  28          HG1       LYS  28   4.376  -6.228  -5.475
  213   1HD   LYS  28          HD2       LYS  28   6.339  -7.027  -6.360
  214   2HD   LYS  28          HD1       LYS  28   6.286  -8.044  -4.920
  215   1HE   LYS  28          HE2       LYS  28   5.589  -9.933  -6.115
  216   2HE   LYS  28          HE1       LYS  28   4.910  -8.963  -7.438
  217   1HZ   LYS  28          HZ1       LYS  28   7.020  -9.872  -8.126
  218   2HZ   LYS  28          HZ2       LYS  28   7.789  -9.238  -6.750
  219   3HZ   LYS  28          HZ3       LYS  28   7.174  -8.193  -7.941
  220    H    VAL  29           HN       VAL  29   4.138  -7.037  -1.420
  221    HA   VAL  29           HA       VAL  29   2.532  -8.927   0.093
  222    HB   VAL  29           HB       VAL  29   4.737  -6.922   0.665
  223   1HG1  VAL  29          HG11      VAL  29   4.883  -7.773   2.968
  224   2HG1  VAL  29          HG12      VAL  29   3.460  -8.781   2.700
  225   3HG1  VAL  29          HG13      VAL  29   3.308  -7.020   2.694
  226   1HG2  VAL  29          HG21      VAL  29   4.475  -9.881   0.321
  227   2HG2  VAL  29          HG22      VAL  29   5.744  -9.274   1.386
  228   3HG2  VAL  29          HG23      VAL  29   5.704  -8.784  -0.308
  229    H    LEU  30           HN       LEU  30   2.682  -5.374  -0.166
  230    HA   LEU  30           HA       LEU  30   0.892  -4.812   2.001
  231   1HB   LEU  30          HB2       LEU  30   1.780  -3.390  -0.515
  232   2HB   LEU  30          HB1       LEU  30   0.619  -2.643   0.570
  233    HG   LEU  30           HG       LEU  30   3.188  -2.126   0.829
  234   1HD1  LEU  30          HD11      LEU  30   1.596  -1.193   2.346
  235   2HD1  LEU  30          HD12      LEU  30   2.885  -1.918   3.316
  236   3HD1  LEU  30          HD13      LEU  30   1.338  -2.755   3.128
  237   1HD2  LEU  30          HD21      LEU  30   2.964  -4.785   2.247
  238   2HD2  LEU  30          HD22      LEU  30   4.167  -3.584   2.655
  239   3HD2  LEU  30          HD23      LEU  30   4.147  -4.276   1.046
  240    H    LYS  31           HN       LYS  31   0.437  -5.659  -1.386
  241    HA   LYS  31           HA       LYS  31  -2.378  -5.089  -1.644
  242   1HB   LYS  31          HB2       LYS  31  -0.447  -5.893  -3.323
  243   2HB   LYS  31          HB1       LYS  31  -1.040  -7.477  -2.888
  244   1HG   LYS  31          HG2       LYS  31  -2.919  -5.293  -3.789
  245   2HG   LYS  31          HG1       LYS  31  -2.116  -6.353  -4.946
  246   1HD   LYS  31          HD2       LYS  31  -3.918  -7.244  -2.671
  247   2HD   LYS  31          HD1       LYS  31  -4.336  -7.244  -4.383
  248   1HE   LYS  31          HE2       LYS  31  -1.888  -8.649  -4.211
  249   2HE   LYS  31          HE1       LYS  31  -2.894  -9.261  -2.878
  250   1HZ   LYS  31          HZ1       LYS  31  -4.706  -9.613  -4.387
  251   2HZ   LYS  31          HZ2       LYS  31  -3.338 -10.385  -5.031
  252   3HZ   LYS  31          HZ3       LYS  31  -3.857  -8.899  -5.670
  253    H    GLN  32           HN       GLN  32  -0.534  -7.952  -0.648
  254    HA   GLN  32           HA       GLN  32  -2.648  -9.775  -0.162
  255   1HB   GLN  32          HB2       GLN  32   0.141  -9.323   0.750
  256   2HB   GLN  32          HB1       GLN  32  -0.843 -10.419   1.720
  257   1HG   GLN  32          HG2       GLN  32  -1.341 -11.784  -0.229
  258   2HG   GLN  32          HG1       GLN  32  -0.497 -10.644  -1.279
  259   1HE2  GLN  32          HE21      GLN  32   0.048 -12.915   1.447
  260   2HE2  GLN  32          HE22      GLN  32   1.696 -13.180   1.098
  261    H    TYR  33           HN       TYR  33  -1.246  -7.252   1.916
  262    HA   TYR  33           HA       TYR  33  -2.790  -7.782   4.296
  263   1HB   TYR  33          HB2       TYR  33  -0.773  -6.389   4.245
  264   2HB   TYR  33          HB1       TYR  33  -1.548  -5.256   3.138
  265    HD1  TYR  33           HD1      TYR  33  -1.700  -6.697   6.545
  266    HD2  TYR  33           HD2      TYR  33  -2.998  -3.543   3.940
  267    HE1  TYR  33           HE1      TYR  33  -2.664  -5.505   8.479
  268    HE2  TYR  33           HE2      TYR  33  -3.960  -2.339   5.880
  269    HH   TYR  33           HH       TYR  33  -4.858  -3.337   8.403
  270    H    ILE  34           HN       ILE  34  -3.314  -5.765   1.431
  271    HA   ILE  34           HA       ILE  34  -5.802  -4.557   2.259
  272    HB   ILE  34           HB       ILE  34  -4.605  -5.164  -0.463
  273   1HG1  ILE  34          HG12      ILE  34  -3.281  -3.775   1.280
  274   2HG1  ILE  34          HG11      ILE  34  -3.471  -3.097  -0.330
  275   1HG2  ILE  34          HG21      ILE  34  -6.656  -4.509  -1.183
  276   2HG2  ILE  34          HG22      ILE  34  -6.066  -2.891  -0.803
  277   3HG2  ILE  34          HG23      ILE  34  -7.068  -3.759   0.359
  278   1HD1  ILE  34          HD11      ILE  34  -3.913  -1.579   1.748
  279   2HD1  ILE  34          HD12      ILE  34  -5.448  -2.443   1.846
  280   3HD1  ILE  34          HD13      ILE  34  -5.048  -1.519   0.398
  281    H    ASN  35           HN       ASN  35  -4.934  -7.619   0.757
  282    HA   ASN  35           HA       ASN  35  -7.444  -8.423  -0.313
  283   1HB   ASN  35          HB2       ASN  35  -5.144  -9.472  -0.565
  284   2HB   ASN  35          HB1       ASN  35  -5.367 -10.168   1.040
  285   1HD2  ASN  35          HD21      ASN  35  -5.927 -12.335   0.761
  286   2HD2  ASN  35          HD22      ASN  35  -7.068 -12.907  -0.359
  287    H    ASP  36           HN       ASP  36  -6.246  -8.370   2.995
  288    HA   ASP  36           HA       ASP  36  -8.355 -10.079   4.085
  289   1HB   ASP  36          HB2       ASP  36  -6.222  -8.244   5.196
  290   2HB   ASP  36          HB1       ASP  36  -7.357  -9.093   6.247
  291    H    ASN  37           HN       ASN  37  -7.727  -6.577   3.899
  292    HA   ASN  37           HA       ASN  37 -10.114  -5.831   5.401
  293   1HB   ASN  37          HB2       ASN  37  -8.197  -4.341   3.577
  294   2HB   ASN  37          HB1       ASN  37  -9.449  -3.554   4.545
  295   1HD2  ASN  37          HD21      ASN  37  -7.925  -2.451   5.945
  296   2HD2  ASN  37          HD22      ASN  37  -6.961  -3.299   7.068
  297    H    GLY  38           HN       GLY  38  -9.321  -6.376   2.014
  298   1HA   GLY  38          HA2       GLY  38 -10.840  -6.748   0.230
  299   2HA   GLY  38          HA1       GLY  38 -12.168  -6.323   1.311
  300    H    ILE  39           HN       ILE  39  -9.330  -4.293   0.853
  301    HA   ILE  39           HA       ILE  39 -11.095  -2.246  -0.453
  302    HB   ILE  39           HB       ILE  39  -8.648  -1.948   1.324
  303   1HG1  ILE  39          HG12      ILE  39 -10.615  -2.790   2.554
  304   2HG1  ILE  39          HG11      ILE  39 -10.265  -1.121   3.009
  305   1HG2  ILE  39          HG21      ILE  39  -8.787  -0.062  -0.166
  306   2HG2  ILE  39          HG22      ILE  39  -9.414   0.462   1.397
  307   3HG2  ILE  39          HG23      ILE  39 -10.527   0.079   0.084
  308   1HD1  ILE  39          HD11      ILE  39 -12.630  -2.237   1.665
  309   2HD1  ILE  39          HD12      ILE  39 -11.984  -0.803   0.868
  310   3HD1  ILE  39          HD13      ILE  39 -12.455  -0.731   2.566
  311    H    ASP  40           HN       ASP  40 -10.356  -3.496  -2.488
  312    HA   ASP  40           HA       ASP  40  -7.653  -2.532  -3.373
  313   1HB   ASP  40          HB2       ASP  40  -8.338  -5.077  -3.036
  314   2HB   ASP  40          HB1       ASP  40  -9.089  -4.852  -4.620
  315    H    GLY  41           HN       GLY  41  -7.824  -0.963  -4.923
  316   1HA   GLY  41          HA2       GLY  41  -9.848  -1.235  -7.055
  317   2HA   GLY  41          HA1       GLY  41  -9.967   0.219  -6.059
  318    H    GLU  42           HN       GLU  42  -8.165   1.727  -6.092
  319    HA   GLU  42           HA       GLU  42  -6.307   1.372  -8.420
  320   1HB   GLU  42          HB2       GLU  42  -8.415   3.340  -7.868
  321   2HB   GLU  42          HB1       GLU  42  -6.862   4.097  -8.226
  322   1HG   GLU  42          HG2       GLU  42  -6.837   3.351 -10.390
  323   2HG   GLU  42          HG1       GLU  42  -7.654   1.840  -9.989
  324    H    TRP  43           HN       TRP  43  -4.243   1.434  -7.649
  325    HA   TRP  43           HA       TRP  43  -3.655   2.881  -5.110
  326   1HB   TRP  43          HB2       TRP  43  -2.134   0.911  -6.848
  327   2HB   TRP  43          HB1       TRP  43  -1.451   1.659  -5.416
  328    HD1  TRP  43           HD1      TRP  43  -5.117   0.493  -5.435
  329    HE1  TRP  43           HE1      TRP  43  -5.335  -1.499  -3.836
  330    HE3  TRP  43           HE3      TRP  43  -0.214  -0.233  -4.289
  331    HZ2  TRP  43           HZ2      TRP  43  -3.661  -3.160  -2.239
  332    HZ3  TRP  43           HZ3      TRP  43   0.452  -2.020  -2.697
  333    HH2  TRP  43           HH2      TRP  43  -1.260  -3.479  -1.674
  334    H    THR  44           HN       THR  44  -1.584   4.173  -5.107
  335    HA   THR  44           HA       THR  44  -0.675   5.207  -7.727
  336    HB   THR  44           HB       THR  44  -1.164   7.536  -7.049
  337    HG1  THR  44           HG1      THR  44  -2.572   7.774  -5.212
  338   1HG2  THR  44          HG21      THR  44  -3.491   7.496  -7.522
  339   2HG2  THR  44          HG22      THR  44  -3.697   5.917  -6.766
  340   3HG2  THR  44          HG23      THR  44  -2.842   6.054  -8.302
  341    H    TYR  45           HN       TYR  45   1.496   5.569  -7.601
  342    HA   TYR  45           HA       TYR  45   2.840   5.294  -4.984
  343   1HB   TYR  45          HB2       TYR  45   3.589   4.049  -6.973
  344   2HB   TYR  45          HB1       TYR  45   3.830   5.560  -7.847
  345    HD1  TYR  45           HD1      TYR  45   4.752   4.218  -4.456
  346    HD2  TYR  45           HD2      TYR  45   6.052   6.199  -8.038
  347    HE1  TYR  45           HE1      TYR  45   7.043   4.396  -3.526
  348    HE2  TYR  45           HE2      TYR  45   8.343   6.379  -7.107
  349    HH   TYR  45           HH       TYR  45   9.455   4.609  -4.611
  350    H    ASP  46           HN       ASP  46   4.559   6.893  -4.383
  351    HA   ASP  46           HA       ASP  46   4.170   9.624  -5.546
  352   1HB   ASP  46          HB2       ASP  46   4.263   8.941  -2.584
  353   2HB   ASP  46          HB1       ASP  46   4.019  10.539  -3.281
  354    H    ASP  47           HN       ASP  47   6.130  10.537  -5.991
  355    HA   ASP  47           HA       ASP  47   8.618   9.193  -5.317
  356   1HB   ASP  47          HB2       ASP  47   8.165  10.462  -7.406
  357   2HB   ASP  47          HB1       ASP  47   8.058  11.948  -6.462
  358    H    ALA  48           HN       ALA  48   6.640  11.286  -3.504
  359    HA   ALA  48           HA       ALA  48   8.429  13.054  -2.208
  360   1HB   ALA  48          HB1       ALA  48   6.171  13.380  -1.739
  361   2HB   ALA  48          HB2       ALA  48   6.672  12.539  -0.272
  362   3HB   ALA  48          HB3       ALA  48   5.856  11.652  -1.562
  363    H    THR  49           HN       THR  49   7.179  10.121  -0.615
  364    HA   THR  49           HA       THR  49   9.939   9.542   0.409
  365    HB   THR  49           HB       THR  49   8.558  10.737   2.084
  366    HG1  THR  49           HG1      THR  49   9.950   9.078   2.794
  367   1HG2  THR  49          HG21      THR  49   6.499   9.596   2.946
  368   2HG2  THR  49          HG22      THR  49   6.635   8.443   1.616
  369   3HG2  THR  49          HG23      THR  49   6.340  10.149   1.277
  370    H    LYS  50           HN       LYS  50   8.526   8.321  -1.827
  371    HA   LYS  50           HA       LYS  50   7.978   6.198  -2.670
  372   1HB   LYS  50          HB2       LYS  50   9.422   5.390  -0.123
  373   2HB   LYS  50          HB1       LYS  50   9.118   4.332  -1.500
  374   1HG   LYS  50          HG2       LYS  50  10.529   5.622  -2.930
  375   2HG   LYS  50          HG1       LYS  50  10.615   6.945  -1.767
  376   1HD   LYS  50          HD2       LYS  50  12.224   5.919  -0.520
  377   2HD   LYS  50          HD1       LYS  50  11.507   4.321  -0.729
  378   1HE   LYS  50          HE2       LYS  50  12.389   4.276  -3.076
  379   2HE   LYS  50          HE1       LYS  50  13.215   5.813  -2.752
  380   1HZ   LYS  50          HZ1       LYS  50  14.298   4.783  -0.845
  381   2HZ   LYS  50          HZ2       LYS  50  14.673   3.943  -2.273
  382   3HZ   LYS  50          HZ3       LYS  50  13.535   3.307  -1.184
  383    H    THR  51           HN       THR  51   5.820   7.354  -1.496
  384    HA   THR  51           HA       THR  51   4.646   5.458   0.470
  385    HB   THR  51           HB       THR  51   3.163   7.775  -0.723
  386    HG1  THR  51           HG1      THR  51   4.329   9.157   0.724
  387   1HG2  THR  51          HG21      THR  51   3.402   7.586   2.176
  388   2HG2  THR  51          HG22      THR  51   2.820   6.080   1.466
  389   3HG2  THR  51          HG23      THR  51   1.955   7.588   1.170
  390    H    TRP  52           HN       TRP  52   2.011   5.422  -0.217
  391    HA   TRP  52           HA       TRP  52   1.687   4.713  -3.067
  392   1HB   TRP  52          HB2       TRP  52   1.767   2.779  -0.760
  393   2HB   TRP  52          HB1       TRP  52   0.817   2.424  -2.197
  394    HD1  TRP  52           HD1      TRP  52   4.352   2.549  -0.922
  395    HE1  TRP  52           HE1      TRP  52   5.953   1.741  -2.782
  396    HE3  TRP  52           HE3      TRP  52   1.102   2.363  -4.806
  397    HZ2  TRP  52           HZ2      TRP  52   5.842   1.094  -5.581
  398    HZ3  TRP  52           HZ3      TRP  52   1.848   1.648  -7.068
  399    HH2  TRP  52           HH2      TRP  52   4.216   1.012  -7.456
  400    H    THR  53           HN       THR  53  -0.689   3.439  -3.025
  401    HA   THR  53           HA       THR  53  -2.547   4.629  -1.083
  402    HB   THR  53           HB       THR  53  -2.776   5.342  -4.018
  403    HG1  THR  53           HG1      THR  53  -1.353   6.819  -3.660
  404   1HG2  THR  53          HG21      THR  53  -4.202   7.196  -2.934
  405   2HG2  THR  53          HG22      THR  53  -4.165   6.195  -1.483
  406   3HG2  THR  53          HG23      THR  53  -4.880   5.569  -2.968
  407    H    VAL  54           HN       VAL  54  -4.873   3.986  -1.715
  408    HA   VAL  54           HA       VAL  54  -5.316   1.843  -3.616
  409    HB   VAL  54           HB       VAL  54  -3.971   0.550  -2.086
  410   1HG1  VAL  54          HG11      VAL  54  -4.994   0.473   0.393
  411   2HG1  VAL  54          HG12      VAL  54  -5.447   2.120  -0.043
  412   3HG1  VAL  54          HG13      VAL  54  -3.756   1.632  -0.087
  413   1HG2  VAL  54          HG21      VAL  54  -6.433  -0.267  -2.734
  414   2HG2  VAL  54          HG22      VAL  54  -6.655  -0.174  -0.987
  415   3HG2  VAL  54          HG23      VAL  54  -5.399  -1.217  -1.661
  416    H    THR  55           HN       THR  55  -7.123   3.263  -4.045
  417    HA   THR  55           HA       THR  55  -9.137   3.690  -1.915
  418    HB   THR  55           HB       THR  55  -9.259   4.437  -4.846
  419    HG1  THR  55           HG1      THR  55  -8.080   6.233  -4.342
  420   1HG2  THR  55          HG21      THR  55 -10.402   5.635  -2.307
  421   2HG2  THR  55          HG22      THR  55 -11.304   4.806  -3.576
  422   3HG2  THR  55          HG23      THR  55 -10.544   6.362  -3.908
  423    H    GLU  56           HN       GLU  56 -10.985   2.463  -1.743
  424    HA   GLU  56           HA       GLU  56 -11.318   0.009  -3.201
  425   1HB   GLU  56          HB2       GLU  56 -12.159   0.724  -0.878
  426   2HB   GLU  56          HB1       GLU  56 -13.466   1.553  -1.724
  427   1HG   GLU  56          HG2       GLU  56 -12.997  -1.241  -2.586
  428   2HG   GLU  56          HG1       GLU  56 -13.578  -1.061  -0.931
  Start of MODEL    2
    1   1H    THR   1          HT1       THR   1  14.758   5.440   4.876
    2   2H    THR   1          HT2       THR   1  14.992   6.886   4.015
    3   3H    THR   1          HT3       THR   1  14.686   5.437   3.181
    4    HA   THR   1           HA       THR   1  12.762   6.804   4.998
    5    HB   THR   1           HB       THR   1  12.698   6.498   1.990
    6    HG1  THR   1           HG1      THR   1  14.128   8.005   1.872
    7   1HG2  THR   1          HG21      THR   1  10.643   7.090   3.438
    8   2HG2  THR   1          HG22      THR   1  11.004   8.144   2.071
    9   3HG2  THR   1          HG23      THR   1  11.444   8.638   3.706
   10    H    THR   2           HN       THR   2  10.693   5.734   5.038
   11    HA   THR   2           HA       THR   2  10.827   2.828   4.345
   12    HB   THR   2           HB       THR   2   8.858   4.269   6.137
   13    HG1  THR   2           HG1      THR   2  11.321   3.082   6.880
   14   1HG2  THR   2          HG21      THR   2   8.750   2.037   7.218
   15   2HG2  THR   2          HG22      THR   2   9.885   1.420   6.017
   16   3HG2  THR   2          HG23      THR   2   8.285   1.970   5.518
   17    H    PHE   3           HN       PHE   3   9.233   1.911   3.032
   18    HA   PHE   3           HA       PHE   3   7.875   3.537   1.107
   19   1HB   PHE   3          HB2       PHE   3   7.326   0.685   2.011
   20   2HB   PHE   3          HB1       PHE   3   6.843   1.386   0.468
   21    HD1  PHE   3           HD1      PHE   3   9.138   2.873  -0.452
   22    HD2  PHE   3           HD2      PHE   3   9.032  -0.879   1.644
   23    HE1  PHE   3           HE1      PHE   3  11.345   2.274  -1.410
   24    HE2  PHE   3           HE2      PHE   3  11.239  -1.473   0.686
   25    HZ   PHE   3           HZ       PHE   3  12.395   0.102  -0.840
   26    H    LYS   4           HN       LYS   4   5.491   3.754   0.856
   27    HA   LYS   4           HA       LYS   4   3.919   3.471   3.380
   28   1HB   LYS   4          HB2       LYS   4   5.042   5.742   3.163
   29   2HB   LYS   4          HB1       LYS   4   4.049   6.011   1.738
   30   1HG   LYS   4          HG2       LYS   4   2.010   5.683   3.073
   31   2HG   LYS   4          HG1       LYS   4   2.990   5.397   4.509
   32   1HD   LYS   4          HD2       LYS   4   3.541   7.610   4.745
   33   2HD   LYS   4          HD1       LYS   4   3.540   7.902   3.006
   34   1HE   LYS   4          HE2       LYS   4   1.543   8.952   3.401
   35   2HE   LYS   4          HE1       LYS   4   0.878   7.309   3.504
   36   1HZ   LYS   4          HZ1       LYS   4   0.443   8.667   5.515
   37   2HZ   LYS   4          HZ2       LYS   4   2.119   8.757   5.783
   38   3HZ   LYS   4          HZ3       LYS   4   1.326   7.255   5.839
   39    H    LEU   5           HN       LEU   5   1.644   3.386   3.022
   40    HA   LEU   5           HA       LEU   5   0.634   3.527   0.231
   41   1HB   LEU   5          HB2       LEU   5   1.519   1.162   1.106
   42   2HB   LEU   5          HB1       LEU   5  -0.053   1.127   1.893
   43    HG   LEU   5           HG       LEU   5  -0.297   2.026  -0.870
   44   1HD1  LEU   5          HD11      LEU   5   1.764   0.404  -0.869
   45   2HD1  LEU   5          HD12      LEU   5   0.489   0.184  -2.073
   46   3HD1  LEU   5          HD13      LEU   5   0.543  -0.853  -0.639
   47   1HD2  LEU   5          HD21      LEU   5  -2.173   1.232   0.486
   48   2HD2  LEU   5          HD22      LEU   5  -1.396  -0.339   0.683
   49   3HD2  LEU   5          HD23      LEU   5  -1.961   0.171  -0.907
   50    H    ILE   6           HN       ILE   6  -1.517   4.195   0.193
   51    HA   ILE   6           HA       ILE   6  -2.816   4.658   2.854
   52    HB   ILE   6           HB       ILE   6  -3.081   6.018   0.155
   53   1HG1  ILE   6          HG12      ILE   6  -0.941   6.437   1.333
   54   2HG1  ILE   6          HG11      ILE   6  -1.934   7.892   1.264
   55   1HG2  ILE   6          HG21      ILE   6  -4.563   6.330   2.743
   56   2HG2  ILE   6          HG22      ILE   6  -5.173   6.413   1.090
   57   3HG2  ILE   6          HG23      ILE   6  -4.255   7.762   1.760
   58   1HD1  ILE   6          HD11      ILE   6  -0.970   6.431   3.587
   59   2HD1  ILE   6          HD12      ILE   6  -2.724   6.605   3.628
   60   3HD1  ILE   6          HD13      ILE   6  -1.699   8.034   3.504
   61    H    ILE   7           HN       ILE   7  -4.703   3.572   3.249
   62    HA   ILE   7           HA       ILE   7  -5.814   1.776   1.200
   63    HB   ILE   7           HB       ILE   7  -6.593   2.376   4.075
   64   1HG1  ILE   7          HG12      ILE   7  -4.997   0.042   2.984
   65   2HG1  ILE   7          HG11      ILE   7  -4.244   1.489   3.655
   66   1HG2  ILE   7          HG21      ILE   7  -7.574   0.011   3.855
   67   2HG2  ILE   7          HG22      ILE   7  -7.412   0.227   2.112
   68   3HG2  ILE   7          HG23      ILE   7  -8.452   1.306   3.042
   69   1HD1  ILE   7          HD11      ILE   7  -5.828  -0.641   5.041
   70   2HD1  ILE   7          HD12      ILE   7  -5.890   1.003   5.678
   71   3HD1  ILE   7          HD13      ILE   7  -4.344   0.163   5.555
   72    H    ASN   8           HN       ASN   8  -7.365   2.485  -0.195
   73    HA   ASN   8           HA       ASN   8  -9.161   4.728   0.667
   74   1HB   ASN   8          HB2       ASN   8  -7.779   3.931  -1.855
   75   2HB   ASN   8          HB1       ASN   8  -9.370   4.672  -2.022
   76   1HD2  ASN   8          HD21      ASN   8  -7.136   6.083  -2.973
   77   2HD2  ASN   8          HD22      ASN   8  -6.832   7.422  -1.960
   78    H    GLY   9           HN       GLY   9  -9.965   2.302   1.594
   79   1HA   GLY   9          HA2       GLY   9 -11.664   0.907  -0.337
   80   2HA   GLY   9          HA1       GLY   9 -11.565   0.566   1.395
   81    H    LYS  10           HN       LYS  10 -14.004   0.796  -0.142
   82    HA   LYS  10           HA       LYS  10 -15.339   3.267   0.013
   83   1HB   LYS  10          HB2       LYS  10 -16.320   0.421   0.375
   84   2HB   LYS  10          HB1       LYS  10 -17.381   1.800   0.083
   85   1HG   LYS  10          HG2       LYS  10 -16.149   2.262  -2.033
   86   2HG   LYS  10          HG1       LYS  10 -15.178   0.815  -1.755
   87   1HD   LYS  10          HD2       LYS  10 -16.832  -0.098  -3.083
   88   2HD   LYS  10          HD1       LYS  10 -17.589  -0.304  -1.503
   89   1HE   LYS  10          HE2       LYS  10 -19.016   1.563  -1.811
   90   2HE   LYS  10          HE1       LYS  10 -18.025   2.206  -3.136
   91   1HZ   LYS  10          HZ1       LYS  10 -18.608   0.387  -4.514
   92   2HZ   LYS  10          HZ2       LYS  10 -20.064   0.965  -3.857
   93   3HZ   LYS  10          HZ3       LYS  10 -19.350  -0.447  -3.237
   94    H    THR  11           HN       THR  11 -14.642   0.922   2.544
   95    HA   THR  11           HA       THR  11 -15.963   2.741   4.536
   96    HB   THR  11           HB       THR  11 -15.696  -0.278   4.658
   97    HG1  THR  11           HG1      THR  11 -17.847  -0.294   3.994
   98   1HG2  THR  11          HG21      THR  11 -17.017   1.836   6.326
   99   2HG2  THR  11          HG22      THR  11 -16.075   0.437   6.840
  100   3HG2  THR  11          HG23      THR  11 -17.726   0.222   6.257
  101    H    LEU  12           HN       LEU  12 -13.379   0.345   3.972
  102    HA   LEU  12           HA       LEU  12 -12.007   1.091   6.484
  103   1HB   LEU  12          HB2       LEU  12 -11.414  -0.846   4.223
  104   2HB   LEU  12          HB1       LEU  12 -10.447  -0.713   5.693
  105    HG   LEU  12           HG       LEU  12 -13.417  -1.134   5.892
  106   1HD1  LEU  12          HD11      LEU  12 -13.209  -3.483   5.688
  107   2HD1  LEU  12          HD12      LEU  12 -11.449  -3.420   5.778
  108   3HD1  LEU  12          HD13      LEU  12 -12.279  -2.852   4.329
  109   1HD2  LEU  12          HD21      LEU  12 -11.245  -2.280   7.634
  110   2HD2  LEU  12          HD22      LEU  12 -12.909  -1.880   8.060
  111   3HD2  LEU  12          HD23      LEU  12 -11.727  -0.594   7.817
  112    H    LYS  13           HN       LYS  13 -10.076   2.267   6.558
  113    HA   LYS  13           HA       LYS  13  -8.658   3.019   4.085
  114   1HB   LYS  13          HB2       LYS  13 -10.481   4.811   5.660
  115   2HB   LYS  13          HB1       LYS  13  -9.053   5.511   4.896
  116   1HG   LYS  13          HG2       LYS  13  -9.932   4.097   2.809
  117   2HG   LYS  13          HG1       LYS  13 -11.476   4.303   3.636
  118   1HD   LYS  13          HD2       LYS  13  -9.696   6.690   3.300
  119   2HD   LYS  13          HD1       LYS  13 -10.631   6.127   1.915
  120   1HE   LYS  13          HE2       LYS  13 -12.714   6.308   3.207
  121   2HE   LYS  13          HE1       LYS  13 -11.795   6.811   4.640
  122   1HZ   LYS  13          HZ1       LYS  13 -12.672   8.689   3.267
  123   2HZ   LYS  13          HZ2       LYS  13 -11.630   8.195   2.019
  124   3HZ   LYS  13          HZ3       LYS  13 -10.993   8.718   3.504
  125    H    GLY  14           HN       GLY  14  -7.036   4.977   4.933
  126   1HA   GLY  14          HA2       GLY  14  -5.872   5.628   7.116
  127   2HA   GLY  14          HA1       GLY  14  -5.794   3.894   7.428
  128    H    GLU  15           HN       GLU  15  -3.396   4.904   7.493
  129    HA   GLU  15           HA       GLU  15  -2.203   4.535   4.763
  130   1HB   GLU  15          HB2       GLU  15  -0.399   6.018   5.634
  131   2HB   GLU  15          HB1       GLU  15  -1.977   6.802   5.696
  132   1HG   GLU  15          HG2       GLU  15  -2.183   6.389   8.056
  133   2HG   GLU  15          HG1       GLU  15  -0.773   5.329   8.053
  134    H    THR  16           HN       THR  16   0.106   3.641   4.901
  135    HA   THR  16           HA       THR  16   0.832   2.096   7.286
  136    HB   THR  16           HB       THR  16  -0.991   0.744   6.343
  137    HG1  THR  16           HG1      THR  16   0.125  -1.116   6.346
  138   1HG2  THR  16          HG21      THR  16  -0.608  -0.289   4.052
  139   2HG2  THR  16          HG22      THR  16   0.664   0.910   3.810
  140   3HG2  THR  16          HG23      THR  16  -1.006   1.429   4.046
  141    H    THR  17           HN       THR  17   3.000   1.405   7.177
  142    HA   THR  17           HA       THR  17   4.440   1.861   4.586
  143    HB   THR  17           HB       THR  17   6.267   2.838   5.996
  144    HG1  THR  17           HG1      THR  17   5.566   3.440   8.148
  145   1HG2  THR  17          HG21      THR  17   4.968   4.944   6.606
  146   2HG2  THR  17          HG22      THR  17   3.516   4.088   6.087
  147   3HG2  THR  17          HG23      THR  17   4.812   4.406   4.934
  148    H    THR  18           HN       THR  18   6.443   0.596   4.411
  149    HA   THR  18           HA       THR  18   6.753  -1.597   6.392
  150    HB   THR  18           HB       THR  18   5.579  -1.710   3.711
  151    HG1  THR  18           HG1      THR  18   6.039  -3.595   5.782
  152   1HG2  THR  18          HG21      THR  18   6.763  -3.653   2.842
  153   2HG2  THR  18          HG22      THR  18   7.881  -3.628   4.207
  154   3HG2  THR  18          HG23      THR  18   7.893  -2.311   3.031
  155    H    GLU  19           HN       GLU  19   8.870  -2.774   5.973
  156    HA   GLU  19           HA       GLU  19  10.928  -0.925   4.804
  157   1HB   GLU  19          HB2       GLU  19  10.840  -1.140   7.316
  158   2HB   GLU  19          HB1       GLU  19  11.184  -2.860   7.130
  159   1HG   GLU  19          HG2       GLU  19  13.352  -2.148   7.334
  160   2HG   GLU  19          HG1       GLU  19  13.171  -1.840   5.606
  161    H    ALA  20           HN       ALA  20  11.764  -1.864   2.975
  162    HA   ALA  20           HA       ALA  20  12.536  -4.728   3.030
  163   1HB   ALA  20          HB1       ALA  20  11.265  -4.785   0.697
  164   2HB   ALA  20          HB2       ALA  20  10.337  -3.473   1.426
  165   3HB   ALA  20          HB3       ALA  20  10.386  -5.057   2.202
  166    H    VAL  21           HN       VAL  21  13.552  -5.257   0.760
  167    HA   VAL  21           HA       VAL  21  15.797  -3.582   0.299
  168    HB   VAL  21           HB       VAL  21  16.074  -5.006  -1.718
  169   1HG1  VAL  21          HG11      VAL  21  15.496  -7.260  -0.360
  170   2HG1  VAL  21          HG12      VAL  21  15.358  -6.095   0.957
  171   3HG1  VAL  21          HG13      VAL  21  16.866  -6.228   0.053
  172   1HG2  VAL  21          HG21      VAL  21  14.196  -6.809  -1.956
  173   2HG2  VAL  21          HG22      VAL  21  13.932  -5.221  -2.672
  174   3HG2  VAL  21          HG23      VAL  21  13.178  -5.628  -1.132
  175    H    ASP  22           HN       ASP  22  12.666  -3.730  -1.383
  176    HA   ASP  22           HA       ASP  22  13.122  -1.003  -2.460
  177   1HB   ASP  22          HB2       ASP  22  12.514  -3.461  -4.142
  178   2HB   ASP  22          HB1       ASP  22  12.583  -1.808  -4.750
  179    H    ALA  23           HN       ALA  23  11.059  -0.097  -3.318
  180    HA   ALA  23           HA       ALA  23   8.801  -0.650  -1.653
  181   1HB   ALA  23          HB1       ALA  23   8.654   1.462  -2.534
  182   2HB   ALA  23          HB2       ALA  23   7.775   0.653  -3.831
  183   3HB   ALA  23          HB3       ALA  23   9.494   1.001  -4.015
  184    H    ALA  24           HN       ALA  24   9.749  -1.877  -4.825
  185    HA   ALA  24           HA       ALA  24   7.287  -3.029  -5.675
  186   1HB   ALA  24          HB1       ALA  24   9.659  -2.777  -6.779
  187   2HB   ALA  24          HB2       ALA  24   8.651  -4.153  -7.227
  188   3HB   ALA  24          HB3       ALA  24   9.961  -4.361  -6.065
  189    H    THR  25           HN       THR  25   9.907  -4.411  -3.678
  190    HA   THR  25           HA       THR  25   8.664  -6.969  -3.240
  191    HB   THR  25           HB       THR  25  10.762  -5.330  -1.779
  192    HG1  THR  25           HG1      THR  25  11.380  -6.066  -3.785
  193   1HG2  THR  25          HG21      THR  25  10.040  -8.241  -1.315
  194   2HG2  THR  25          HG22      THR  25   9.681  -6.921  -0.198
  195   3HG2  THR  25          HG23      THR  25  11.357  -7.358  -0.541
  196    H    ALA  26           HN       ALA  26   8.792  -3.995  -1.228
  197    HA   ALA  26           HA       ALA  26   7.244  -4.959   0.949
  198   1HB   ALA  26          HB1       ALA  26   8.450  -2.908   1.156
  199   2HB   ALA  26          HB2       ALA  26   6.748  -2.438   1.206
  200   3HB   ALA  26          HB3       ALA  26   7.684  -2.226  -0.279
  201    H    GLU  27           HN       GLU  27   6.122  -2.851  -1.715
  202    HA   GLU  27           HA       GLU  27   3.422  -2.691  -1.304
  203   1HB   GLU  27          HB2       GLU  27   5.071  -2.014  -3.269
  204   2HB   GLU  27          HB1       GLU  27   4.383  -3.439  -4.047
  205   1HG   GLU  27          HG2       GLU  27   2.446  -1.584  -2.772
  206   2HG   GLU  27          HG1       GLU  27   3.263  -0.981  -4.214
  207    H    LYS  28           HN       LYS  28   5.076  -5.607  -2.513
  208    HA   LYS  28           HA       LYS  28   2.703  -7.091  -3.233
  209   1HB   LYS  28          HB2       LYS  28   5.424  -8.002  -2.208
  210   2HB   LYS  28          HB1       LYS  28   4.262  -9.024  -3.053
  211   1HG   LYS  28          HG2       LYS  28   4.604  -7.959  -5.096
  212   2HG   LYS  28          HG1       LYS  28   5.167  -6.468  -4.341
  213   1HD   LYS  28          HD2       LYS  28   7.214  -7.286  -4.991
  214   2HD   LYS  28          HD1       LYS  28   7.082  -8.141  -3.453
  215   1HE   LYS  28          HE2       LYS  28   6.485 -10.170  -4.484
  216   2HE   LYS  28          HE1       LYS  28   5.956  -9.363  -5.974
  217   1HZ   LYS  28          HZ1       LYS  28   8.747  -9.400  -4.952
  218   2HZ   LYS  28          HZ2       LYS  28   8.219  -8.681  -6.397
  219   3HZ   LYS  28          HZ3       LYS  28   8.168 -10.369  -6.217
  220    H    VAL  29           HN       VAL  29   4.672  -6.934  -0.265
  221    HA   VAL  29           HA       VAL  29   3.021  -8.688   1.334
  222    HB   VAL  29           HB       VAL  29   5.087  -6.521   1.823
  223   1HG1  VAL  29          HG11      VAL  29   5.081  -7.070   4.222
  224   2HG1  VAL  29          HG12      VAL  29   3.717  -8.163   3.982
  225   3HG1  VAL  29          HG13      VAL  29   3.509  -6.426   3.738
  226   1HG2  VAL  29          HG21      VAL  29   5.489  -8.987   1.002
  227   2HG2  VAL  29          HG22      VAL  29   5.241  -9.388   2.702
  228   3HG2  VAL  29          HG23      VAL  29   6.543  -8.294   2.234
  229    H    LEU  30           HN       LEU  30   2.994  -5.199   0.644
  230    HA   LEU  30           HA       LEU  30   1.038  -4.481   2.611
  231   1HB   LEU  30          HB2       LEU  30   2.029  -3.337  -0.008
  232   2HB   LEU  30          HB1       LEU  30   0.747  -2.533   0.885
  233    HG   LEU  30           HG       LEU  30   3.255  -1.824   1.255
  234   1HD1  LEU  30          HD11      LEU  30   1.265  -2.276   3.478
  235   2HD1  LEU  30          HD12      LEU  30   1.506  -0.810   2.524
  236   3HD1  LEU  30          HD13      LEU  30   2.747  -1.332   3.671
  237   1HD2  LEU  30          HD21      LEU  30   4.313  -3.863   1.815
  238   2HD2  LEU  30          HD22      LEU  30   3.069  -4.296   2.985
  239   3HD2  LEU  30          HD23      LEU  30   4.168  -2.978   3.319
  240    H    LYS  31           HN       LYS  31   0.848  -5.807  -0.644
  241    HA   LYS  31           HA       LYS  31  -1.976  -5.446  -1.133
  242   1HB   LYS  31          HB2       LYS  31   0.101  -6.337  -2.582
  243   2HB   LYS  31          HB1       LYS  31  -0.434  -7.885  -1.974
  244   1HG   LYS  31          HG2       LYS  31  -2.364  -5.953  -3.262
  245   2HG   LYS  31          HG1       LYS  31  -1.438  -7.109  -4.218
  246   1HD   LYS  31          HD2       LYS  31  -3.330  -7.794  -1.944
  247   2HD   LYS  31          HD1       LYS  31  -3.642  -8.045  -3.660
  248   1HE   LYS  31          HE2       LYS  31  -1.140  -9.269  -3.167
  249   2HE   LYS  31          HE1       LYS  31  -2.194  -9.757  -1.820
  250   1HZ   LYS  31          HZ1       LYS  31  -2.624 -11.247  -3.611
  251   2HZ   LYS  31          HZ2       LYS  31  -2.766  -9.977  -4.730
  252   3HZ   LYS  31          HZ3       LYS  31  -3.948 -10.191  -3.530
  253    H    GLN  32           HN       GLN  32  -0.038  -8.029   0.335
  254    HA   GLN  32           HA       GLN  32  -2.068  -9.907   0.947
  255   1HB   GLN  32          HB2       GLN  32   0.626  -9.155   1.935
  256   2HB   GLN  32          HB1       GLN  32  -0.352 -10.159   3.006
  257   1HG   GLN  32          HG2       GLN  32  -0.796 -11.585   0.865
  258   2HG   GLN  32          HG1       GLN  32   0.641 -10.777   0.238
  259   1HE2  GLN  32          HE21      GLN  32   2.063 -12.608   0.339
  260   2HE2  GLN  32          HE22      GLN  32   2.518 -13.336   1.814
  261    H    TYR  33           HN       TYR  33  -0.967  -7.035   2.729
  262    HA   TYR  33           HA       TYR  33  -2.626  -7.349   5.071
  263   1HB   TYR  33          HB2       TYR  33  -0.700  -5.839   4.946
  264   2HB   TYR  33          HB1       TYR  33  -1.464  -4.924   3.647
  265    HD1  TYR  33           HD1      TYR  33  -1.757  -5.889   7.208
  266    HD2  TYR  33           HD2      TYR  33  -3.071  -3.226   4.111
  267    HE1  TYR  33           HE1      TYR  33  -2.921  -4.514   8.894
  268    HE2  TYR  33           HE2      TYR  33  -4.235  -1.837   5.801
  269    HH   TYR  33           HH       TYR  33  -5.156  -2.715   8.584
  270    H    ILE  34           HN       ILE  34  -3.083  -5.768   1.931
  271    HA   ILE  34           HA       ILE  34  -5.688  -4.637   2.444
  272    HB   ILE  34           HB       ILE  34  -4.287  -5.524  -0.097
  273   1HG1  ILE  34          HG12      ILE  34  -3.155  -3.828   1.493
  274   2HG1  ILE  34          HG11      ILE  34  -3.306  -3.375  -0.199
  275   1HG2  ILE  34          HG21      ILE  34  -6.456  -5.193  -0.843
  276   2HG2  ILE  34          HG22      ILE  34  -5.801  -3.563  -1.000
  277   3HG2  ILE  34          HG23      ILE  34  -6.806  -3.978   0.388
  278   1HD1  ILE  34          HD11      ILE  34  -5.141  -1.916   0.271
  279   2HD1  ILE  34          HD12      ILE  34  -3.930  -1.581   1.509
  280   3HD1  ILE  34          HD13      ILE  34  -5.337  -2.572   1.897
  281    H    ASN  35           HN       ASN  35  -4.549  -7.818   1.470
  282    HA   ASN  35           HA       ASN  35  -6.908  -8.939   0.356
  283   1HB   ASN  35          HB2       ASN  35  -4.540  -9.861   0.482
  284   2HB   ASN  35          HB1       ASN  35  -4.894 -10.325   2.146
  285   1HD2  ASN  35          HD21      ASN  35  -6.351 -10.681  -1.143
  286   2HD2  ASN  35          HD22      ASN  35  -6.910 -12.262  -0.880
  287    H    ASP  36           HN       ASP  36  -6.043  -8.270   3.697
  288    HA   ASP  36           HA       ASP  36  -8.141  -9.932   4.876
  289   1HB   ASP  36          HB2       ASP  36  -5.968  -9.308   5.954
  290   2HB   ASP  36          HB1       ASP  36  -6.516  -7.632   6.015
  291    H    ASN  37           HN       ASN  37  -7.654  -6.387   4.605
  292    HA   ASN  37           HA       ASN  37 -10.250  -5.644   5.568
  293   1HB   ASN  37          HB2       ASN  37  -8.296  -4.270   3.690
  294   2HB   ASN  37          HB1       ASN  37  -9.651  -3.466   4.491
  295   1HD2  ASN  37          HD21      ASN  37  -6.699  -2.990   4.873
  296   2HD2  ASN  37          HD22      ASN  37  -6.417  -3.242   6.536
  297    H    GLY  38           HN       GLY  38  -9.076  -6.573   2.376
  298   1HA   GLY  38          HA2       GLY  38 -10.368  -7.313   0.531
  299   2HA   GLY  38          HA1       GLY  38 -11.830  -6.890   1.422
  300    H    ILE  39           HN       ILE  39  -9.040  -4.816   0.668
  301    HA   ILE  39           HA       ILE  39 -10.885  -3.073  -0.937
  302    HB   ILE  39           HB       ILE  39  -8.634  -2.339   0.967
  303   1HG1  ILE  39          HG12      ILE  39 -10.660  -3.130   2.128
  304   2HG1  ILE  39          HG11      ILE  39 -10.456  -1.391   2.355
  305   1HG2  ILE  39          HG21      ILE  39 -10.481  -0.648  -0.734
  306   2HG2  ILE  39          HG22      ILE  39  -8.719  -0.689  -0.779
  307   3HG2  ILE  39          HG23      ILE  39  -9.550  -0.002   0.616
  308   1HD1  ILE  39          HD11      ILE  39 -12.760  -1.681   1.826
  309   2HD1  ILE  39          HD12      ILE  39 -12.399  -2.816   0.525
  310   3HD1  ILE  39          HD13      ILE  39 -12.017  -1.105   0.333
  311    H    ASP  40           HN       ASP  40  -9.928  -4.461  -2.751
  312    HA   ASP  40           HA       ASP  40  -7.234  -3.415  -3.565
  313   1HB   ASP  40          HB2       ASP  40  -6.991  -5.609  -4.726
  314   2HB   ASP  40          HB1       ASP  40  -7.230  -5.806  -2.987
  315    H    GLY  41           HN       GLY  41  -7.472  -2.010  -5.257
  316   1HA   GLY  41          HA2       GLY  41  -9.297  -2.742  -7.475
  317   2HA   GLY  41          HA1       GLY  41  -9.560  -1.177  -6.700
  318    H    GLU  42           HN       GLU  42  -7.827   0.417  -6.827
  319    HA   GLU  42           HA       GLU  42  -5.849  -0.119  -9.019
  320   1HB   GLU  42          HB2       GLU  42  -8.037   1.830  -8.744
  321   2HB   GLU  42          HB1       GLU  42  -6.497   2.575  -9.174
  322   1HG   GLU  42          HG2       GLU  42  -6.411   1.549 -11.223
  323   2HG   GLU  42          HG1       GLU  42  -7.226   0.094 -10.646
  324    H    TRP  43           HN       TRP  43  -3.826   0.096  -8.167
  325    HA   TRP  43           HA       TRP  43  -3.396   1.874  -5.811
  326   1HB   TRP  43          HB2       TRP  43  -1.754  -0.273  -7.193
  327   2HB   TRP  43          HB1       TRP  43  -1.151   0.685  -5.854
  328    HD1  TRP  43           HD1      TRP  43  -4.777  -0.617  -5.907
  329    HE1  TRP  43           HE1      TRP  43  -5.030  -2.347  -4.033
  330    HE3  TRP  43           HE3      TRP  43   0.056  -0.926  -4.367
  331    HZ2  TRP  43           HZ2      TRP  43  -3.406  -3.662  -2.092
  332    HZ3  TRP  43           HZ3      TRP  43   0.681  -2.414  -2.478
  333    HH2  TRP  43           HH2      TRP  43  -1.037  -3.774  -1.341
  334    H    THR  44           HN       THR  44  -1.364   3.221  -5.887
  335    HA   THR  44           HA       THR  44  -0.333   3.912  -8.572
  336    HB   THR  44           HB       THR  44  -0.932   6.304  -8.245
  337    HG1  THR  44           HG1      THR  44  -1.940   6.943  -6.492
  338   1HG2  THR  44          HG21      THR  44  -3.209   6.098  -8.900
  339   2HG2  THR  44          HG22      THR  44  -3.418   4.610  -7.977
  340   3HG2  THR  44          HG23      THR  44  -2.435   4.609  -9.441
  341    H    TYR  45           HN       TYR  45   1.811   4.385  -8.376
  342    HA   TYR  45           HA       TYR  45   3.008   4.520  -5.683
  343   1HB   TYR  45          HB2       TYR  45   3.916   3.092  -7.482
  344   2HB   TYR  45          HB1       TYR  45   4.163   4.513  -8.496
  345    HD1  TYR  45           HD1      TYR  45   6.384   5.171  -8.626
  346    HD2  TYR  45           HD2      TYR  45   4.881   3.622  -4.914
  347    HE1  TYR  45           HE1      TYR  45   8.599   5.541  -7.576
  348    HE2  TYR  45           HE2      TYR  45   7.096   3.989  -3.863
  349    HH   TYR  45           HH       TYR  45   9.716   4.171  -5.115
  350    H    ASP  46           HN       ASP  46   4.612   6.271  -5.192
  351    HA   ASP  46           HA       ASP  46   4.168   8.818  -6.701
  352   1HB   ASP  46          HB2       ASP  46   4.107   8.499  -3.678
  353   2HB   ASP  46          HB1       ASP  46   3.836   9.989  -4.577
  354    H    ASP  47           HN       ASP  47   6.108   9.772  -7.150
  355    HA   ASP  47           HA       ASP  47   8.609   8.655  -6.196
  356   1HB   ASP  47          HB2       ASP  47   9.554  10.514  -7.553
  357   2HB   ASP  47          HB1       ASP  47   8.300   9.636  -8.427
  358    H    ALA  48           HN       ALA  48   6.442  10.841  -4.735
  359    HA   ALA  48           HA       ALA  48   8.089  12.805  -3.531
  360   1HB   ALA  48          HB1       ALA  48   5.792  13.085  -3.239
  361   2HB   ALA  48          HB2       ALA  48   6.232  12.435  -1.659
  362   3HB   ALA  48          HB3       ALA  48   5.529  11.375  -2.884
  363    H    THR  49           HN       THR  49   6.837  10.005  -1.718
  364    HA   THR  49           HA       THR  49   9.545   9.626  -0.486
  365    HB   THR  49           HB       THR  49   8.045  10.950   0.977
  366    HG1  THR  49           HG1      THR  49   9.402   9.510   2.012
  367   1HG2  THR  49          HG21      THR  49   5.889  10.224   0.126
  368   2HG2  THR  49          HG22      THR  49   5.968   9.839   1.846
  369   3HG2  THR  49          HG23      THR  49   6.203   8.567   0.644
  370    H    LYS  50           HN       LYS  50   8.294   8.148  -2.652
  371    HA   LYS  50           HA       LYS  50   7.850   5.939  -3.306
  372   1HB   LYS  50          HB2       LYS  50   9.093   5.391  -0.589
  373   2HB   LYS  50          HB1       LYS  50   8.934   4.223  -1.900
  374   1HG   LYS  50          HG2       LYS  50  11.030   4.917  -2.452
  375   2HG   LYS  50          HG1       LYS  50  10.182   6.268  -3.202
  376   1HD   LYS  50          HD2       LYS  50  10.902   7.750  -1.635
  377   2HD   LYS  50          HD1       LYS  50  10.654   6.612  -0.311
  378   1HE   LYS  50          HE2       LYS  50  12.760   5.510  -0.761
  379   2HE   LYS  50          HE1       LYS  50  12.978   6.435  -2.261
  380   1HZ   LYS  50          HZ1       LYS  50  14.150   7.371  -0.265
  381   2HZ   LYS  50          HZ2       LYS  50  12.621   7.711   0.395
  382   3HZ   LYS  50          HZ3       LYS  50  13.107   8.451  -1.055
  383    H    THR  51           HN       THR  51   5.679   7.327  -2.141
  384    HA   THR  51           HA       THR  51   4.362   5.617  -0.150
  385    HB   THR  51           HB       THR  51   2.915   7.654  -1.808
  386    HG1  THR  51           HG1      THR  51   3.931   9.322  -0.720
  387   1HG2  THR  51          HG21      THR  51   2.907   7.932   1.093
  388   2HG2  THR  51          HG22      THR  51   2.443   6.306   0.591
  389   3HG2  THR  51          HG23      THR  51   1.553   7.703  -0.013
  390    H    TRP  52           HN       TRP  52   1.802   5.343  -1.013
  391    HA   TRP  52           HA       TRP  52   1.722   4.205  -3.738
  392   1HB   TRP  52          HB2       TRP  52   1.712   2.635  -1.166
  393   2HB   TRP  52          HB1       TRP  52   0.887   2.026  -2.595
  394    HD1  TRP  52           HD1      TRP  52   4.315   2.522  -1.121
  395    HE1  TRP  52           HE1      TRP  52   6.077   1.517  -2.718
  396    HE3  TRP  52           HE3      TRP  52   1.369   1.574  -5.137
  397    HZ2  TRP  52           HZ2      TRP  52   6.200   0.440  -5.377
  398    HZ3  TRP  52           HZ3      TRP  52   2.310   0.555  -7.201
  399    HH2  TRP  52           HH2      TRP  52   4.723  -0.014  -7.322
  400    H    THR  53           HN       THR  53  -0.601   2.829  -3.660
  401    HA   THR  53           HA       THR  53  -2.634   4.199  -2.038
  402    HB   THR  53           HB       THR  53  -2.688   4.457  -5.056
  403    HG1  THR  53           HG1      THR  53  -1.026   5.723  -4.515
  404   1HG2  THR  53          HG21      THR  53  -4.236   6.408  -4.302
  405   2HG2  THR  53          HG22      THR  53  -4.303   5.546  -2.765
  406   3HG2  THR  53          HG23      THR  53  -4.865   4.761  -4.241
  407    H    VAL  54           HN       VAL  54  -4.881   3.360  -2.697
  408    HA   VAL  54           HA       VAL  54  -5.141   0.955  -4.284
  409    HB   VAL  54           HB       VAL  54  -3.832  -0.072  -2.543
  410   1HG1  VAL  54          HG11      VAL  54  -4.864   0.149  -0.112
  411   2HG1  VAL  54          HG12      VAL  54  -5.474   1.670  -0.764
  412   3HG1  VAL  54          HG13      VAL  54  -3.742   1.353  -0.742
  413   1HG2  VAL  54          HG21      VAL  54  -5.222  -1.804  -1.901
  414   2HG2  VAL  54          HG22      VAL  54  -6.241  -1.060  -3.139
  415   3HG2  VAL  54          HG23      VAL  54  -6.533  -0.717  -1.434
  416    H    THR  55           HN       THR  55  -6.976   2.214  -4.987
  417    HA   THR  55           HA       THR  55  -9.126   2.764  -3.006
  418    HB   THR  55           HB       THR  55  -9.096   3.339  -5.976
  419    HG1  THR  55           HG1      THR  55  -7.476   4.598  -5.619
  420   1HG2  THR  55          HG21      THR  55 -10.761   4.862  -5.508
  421   2HG2  THR  55          HG22      THR  55 -10.161   5.177  -3.879
  422   3HG2  THR  55          HG23      THR  55 -11.072   3.704  -4.214
  423    H    GLU  56           HN       GLU  56 -10.946   1.484  -2.891
  424    HA   GLU  56           HA       GLU  56 -11.094  -1.013  -4.371
  425   1HB   GLU  56          HB2       GLU  56 -11.963  -0.171  -1.983
  426   2HB   GLU  56          HB1       GLU  56 -13.430   0.151  -2.908
  427   1HG   GLU  56          HG2       GLU  56 -12.019  -2.503  -3.132
  428   2HG   GLU  56          HG1       GLU  56 -13.164  -2.195  -1.825
  Start of MODEL    3
    1   1H    THR   1          HT1       THR   1  15.126   2.128   1.600
    2   2H    THR   1          HT2       THR   1  15.563   2.748   3.120
    3   3H    THR   1          HT3       THR   1  16.234   3.407   1.706
    4    HA   THR   1           HA       THR   1  14.522   4.885   2.550
    5    HB   THR   1           HB       THR   1  13.543   3.390   0.108
    6    HG1  THR   1           HG1      THR   1  15.812   5.058   0.421
    7   1HG2  THR   1          HG21      THR   1  13.373   6.155   1.202
    8   2HG2  THR   1          HG22      THR   1  12.180   5.230   0.291
    9   3HG2  THR   1          HG23      THR   1  13.532   5.992  -0.547
   10    H    THR   2           HN       THR   2  12.069   5.129   2.660
   11    HA   THR   2           HA       THR   2  10.809   2.616   3.716
   12    HB   THR   2           HB       THR   2  10.159   5.455   4.527
   13    HG1  THR   2           HG1      THR   2  11.726   5.339   6.036
   14   1HG2  THR   2          HG21      THR   2   9.102   4.473   6.371
   15   2HG2  THR   2          HG22      THR   2  10.026   2.978   6.226
   16   3HG2  THR   2          HG23      THR   2   8.737   3.334   5.076
   17    H    PHE   3           HN       PHE   3   9.187   1.954   2.374
   18    HA   PHE   3           HA       PHE   3   7.972   3.748   0.401
   19   1HB   PHE   3          HB2       PHE   3   7.412   0.883   1.247
   20   2HB   PHE   3          HB1       PHE   3   6.756   1.656  -0.196
   21    HD1  PHE   3           HD1      PHE   3   8.837   3.094  -1.441
   22    HD2  PHE   3           HD2      PHE   3   9.138  -0.601   0.734
   23    HE1  PHE   3           HE1      PHE   3  10.908   2.532  -2.682
   24    HE2  PHE   3           HE2      PHE   3  11.209  -1.161  -0.508
   25    HZ   PHE   3           HZ       PHE   3  12.094   0.405  -2.215
   26    H    LYS   4           HN       LYS   4   5.485   3.795   0.265
   27    HA   LYS   4           HA       LYS   4   4.168   3.752   2.949
   28   1HB   LYS   4          HB2       LYS   4   5.196   6.012   2.311
   29   2HB   LYS   4          HB1       LYS   4   4.002   6.079   1.021
   30   1HG   LYS   4          HG2       LYS   4   2.184   5.869   2.659
   31   2HG   LYS   4          HG1       LYS   4   3.362   5.777   3.967
   32   1HD   LYS   4          HD2       LYS   4   3.740   8.017   3.953
   33   2HD   LYS   4          HD1       LYS   4   3.727   8.103   2.192
   34   1HE   LYS   4          HE2       LYS   4   1.530   8.708   2.135
   35   2HE   LYS   4          HE1       LYS   4   1.081   7.507   3.363
   36   1HZ   LYS   4          HZ1       LYS   4   2.005   8.898   5.070
   37   2HZ   LYS   4          HZ2       LYS   4   0.892   9.817   4.175
   38   3HZ   LYS   4          HZ3       LYS   4   2.560  10.023   3.928
   39    H    LEU   5           HN       LEU   5   1.846   3.653   2.808
   40    HA   LEU   5           HA       LEU   5   0.558   3.477   0.157
   41   1HB   LEU   5          HB2       LEU   5   1.680   1.213   1.038
   42   2HB   LEU   5          HB1       LEU   5   0.202   1.131   1.987
   43    HG   LEU   5           HG       LEU   5  -0.353   1.880  -0.782
   44   1HD1  LEU   5          HD11      LEU   5   0.379  -0.004  -1.954
   45   2HD1  LEU   5          HD12      LEU   5   0.609  -0.954  -0.476
   46   3HD1  LEU   5          HD13      LEU   5   1.756   0.325  -0.894
   47   1HD2  LEU   5          HD21      LEU   5  -1.962   0.004  -0.556
   48   2HD2  LEU   5          HD22      LEU   5  -2.049   1.110   0.816
   49   3HD2  LEU   5          HD23      LEU   5  -1.215  -0.436   0.981
   50    H    ILE   6           HN       ILE   6  -1.533   4.207   0.351
   51    HA   ILE   6           HA       ILE   6  -2.577   4.688   3.107
   52    HB   ILE   6           HB       ILE   6  -3.187   5.854   0.378
   53   1HG1  ILE   6          HG12      ILE   6  -0.984   6.455   1.346
   54   2HG1  ILE   6          HG11      ILE   6  -2.059   7.850   1.266
   55   1HG2  ILE   6          HG21      ILE   6  -4.235   6.729   3.088
   56   2HG2  ILE   6          HG22      ILE   6  -5.181   5.862   1.879
   57   3HG2  ILE   6          HG23      ILE   6  -4.590   7.487   1.535
   58   1HD1  ILE   6          HD11      ILE   6  -2.581   6.678   3.767
   59   2HD1  ILE   6          HD12      ILE   6  -1.668   8.156   3.467
   60   3HD1  ILE   6          HD13      ILE   6  -0.828   6.611   3.588
   61    H    ILE   7           HN       ILE   7  -4.401   3.640   3.787
   62    HA   ILE   7           HA       ILE   7  -5.624   1.597   2.057
   63    HB   ILE   7           HB       ILE   7  -6.150   2.497   4.912
   64   1HG1  ILE   7          HG12      ILE   7  -4.574   0.114   3.891
   65   2HG1  ILE   7          HG11      ILE   7  -3.834   1.628   4.413
   66   1HG2  ILE   7          HG21      ILE   7  -7.077   0.100   5.043
   67   2HG2  ILE   7          HG22      ILE   7  -7.101   0.137   3.280
   68   3HG2  ILE   7          HG23      ILE   7  -8.070   1.288   4.199
   69   1HD1  ILE   7          HD11      ILE   7  -5.274   1.246   6.584
   70   2HD1  ILE   7          HD12      ILE   7  -3.751   0.381   6.381
   71   3HD1  ILE   7          HD13      ILE   7  -5.279  -0.434   6.048
   72    H    ASN   8           HN       ASN   8  -7.237   2.218   0.677
   73    HA   ASN   8           HA       ASN   8  -9.051   4.457   1.499
   74   1HB   ASN   8          HB2       ASN   8  -8.072   3.349  -1.137
   75   2HB   ASN   8          HB1       ASN   8  -9.472   4.420  -1.058
   76   1HD2  ASN   8          HD21      ASN   8  -8.227   6.104  -2.220
   77   2HD2  ASN   8          HD22      ASN   8  -7.035   7.008  -1.402
   78    H    GLY   9           HN       GLY   9  -9.697   2.104   2.695
   79   1HA   GLY   9          HA2       GLY   9 -11.563   0.568   1.017
   80   2HA   GLY   9          HA1       GLY   9 -11.217   0.272   2.725
   81    H    LYS  10           HN       LYS  10 -13.833   0.547   1.321
   82    HA   LYS  10           HA       LYS  10 -15.137   2.996   1.802
   83   1HB   LYS  10          HB2       LYS  10 -16.148   0.143   1.992
   84   2HB   LYS  10          HB1       LYS  10 -17.178   1.565   1.818
   85   1HG   LYS  10          HG2       LYS  10 -15.773   2.102  -0.278
   86   2HG   LYS  10          HG1       LYS  10 -15.196   0.439  -0.162
   87   1HD   LYS  10          HD2       LYS  10 -17.237  -0.456  -0.726
   88   2HD   LYS  10          HD1       LYS  10 -18.139   0.861   0.025
   89   1HE   LYS  10          HE2       LYS  10 -17.474   2.366  -1.842
   90   2HE   LYS  10          HE1       LYS  10 -16.637   1.004  -2.614
   91   1HZ   LYS  10          HZ1       LYS  10 -19.480   0.898  -1.771
   92   2HZ   LYS  10          HZ2       LYS  10 -18.644  -0.220  -2.740
   93   3HZ   LYS  10          HZ3       LYS  10 -19.001   1.329  -3.340
   94    H    THR  11           HN       THR  11 -14.376   0.360   4.033
   95    HA   THR  11           HA       THR  11 -15.631   1.927   6.264
   96    HB   THR  11           HB       THR  11 -14.985  -1.032   6.131
   97    HG1  THR  11           HG1      THR  11 -16.613  -1.122   4.830
   98   1HG2  THR  11          HG21      THR  11 -16.263  -1.237   8.083
   99   2HG2  THR  11          HG22      THR  11 -17.084   0.301   7.821
  100   3HG2  THR  11          HG23      THR  11 -15.402   0.279   8.350
  101    H    LEU  12           HN       LEU  12 -12.748   0.194   5.172
  102    HA   LEU  12           HA       LEU  12 -11.326   0.893   7.705
  103   1HB   LEU  12          HB2       LEU  12 -10.755  -0.980   5.389
  104   2HB   LEU  12          HB1       LEU  12  -9.644  -0.730   6.737
  105    HG   LEU  12           HG       LEU  12 -12.489  -1.394   7.370
  106   1HD1  LEU  12          HD11      LEU  12 -11.442  -2.957   5.514
  107   2HD1  LEU  12          HD12      LEU  12 -12.307  -3.662   6.880
  108   3HD1  LEU  12          HD13      LEU  12 -10.544  -3.624   6.877
  109   1HD2  LEU  12          HD21      LEU  12  -9.876  -2.342   8.578
  110   2HD2  LEU  12          HD22      LEU  12 -11.480  -2.408   9.309
  111   3HD2  LEU  12          HD23      LEU  12 -10.682  -0.853   9.071
  112    H    LYS  13           HN       LYS  13  -9.500   2.234   7.658
  113    HA   LYS  13           HA       LYS  13  -8.418   3.184   5.072
  114   1HB   LYS  13          HB2       LYS  13 -10.251   4.670   6.875
  115   2HB   LYS  13          HB1       LYS  13  -8.862   5.581   6.281
  116   1HG   LYS  13          HG2       LYS  13  -9.457   4.860   3.953
  117   2HG   LYS  13          HG1       LYS  13 -10.920   4.120   4.602
  118   1HD   LYS  13          HD2       LYS  13 -11.549   6.359   5.558
  119   2HD   LYS  13          HD1       LYS  13 -10.168   7.054   4.709
  120   1HE   LYS  13          HE2       LYS  13 -11.958   5.377   3.035
  121   2HE   LYS  13          HE1       LYS  13 -12.649   6.910   3.605
  122   1HZ   LYS  13          HZ1       LYS  13  -9.935   6.686   2.428
  123   2HZ   LYS  13          HZ2       LYS  13 -10.801   8.107   2.768
  124   3HZ   LYS  13          HZ3       LYS  13 -11.306   7.081   1.512
  125    H    GLY  14           HN       GLY  14  -6.694   5.021   5.690
  126   1HA   GLY  14          HA2       GLY  14  -5.306   5.709   7.749
  127   2HA   GLY  14          HA1       GLY  14  -5.155   3.974   8.026
  128    H    GLU  15           HN       GLU  15  -2.777   4.826   7.832
  129    HA   GLU  15           HA       GLU  15  -1.924   4.507   4.973
  130   1HB   GLU  15          HB2       GLU  15  -0.126   6.143   5.515
  131   2HB   GLU  15          HB1       GLU  15  -1.731   6.838   5.735
  132   1HG   GLU  15          HG2       GLU  15  -1.604   6.410   8.155
  133   2HG   GLU  15          HG1       GLU  15  -0.012   5.678   7.950
  134    H    THR  16           HN       THR  16   0.400   3.707   4.833
  135    HA   THR  16           HA       THR  16   1.501   2.359   7.209
  136    HB   THR  16           HB       THR  16  -0.311   0.854   6.510
  137    HG1  THR  16           HG1      THR  16   1.325  -0.336   7.218
  138   1HG2  THR  16          HG21      THR  16   1.055   1.058   3.816
  139   2HG2  THR  16          HG22      THR  16  -0.631   1.393   4.212
  140   3HG2  THR  16          HG23      THR  16  -0.038  -0.266   4.222
  141    H    THR  17           HN       THR  17   3.675   1.743   6.892
  142    HA   THR  17           HA       THR  17   4.833   2.195   4.163
  143    HB   THR  17           HB       THR  17   6.751   3.283   5.413
  144    HG1  THR  17           HG1      THR  17   6.660   3.053   7.483
  145   1HG2  THR  17          HG21      THR  17   3.976   4.396   5.277
  146   2HG2  THR  17          HG22      THR  17   5.419   4.876   4.385
  147   3HG2  THR  17          HG23      THR  17   5.229   5.346   6.074
  148    H    THR  18           HN       THR  18   6.869   1.018   3.833
  149    HA   THR  18           HA       THR  18   7.522  -1.039   5.871
  150    HB   THR  18           HB       THR  18   6.062  -1.373   3.347
  151    HG1  THR  18           HG1      THR  18   6.819  -3.087   5.477
  152   1HG2  THR  18          HG21      THR  18   8.500  -3.142   3.720
  153   2HG2  THR  18          HG22      THR  18   8.302  -1.930   2.454
  154   3HG2  THR  18          HG23      THR  18   7.238  -3.338   2.502
  155    H    GLU  19           HN       GLU  19   9.637  -2.140   5.251
  156    HA   GLU  19           HA       GLU  19  11.430  -0.266   3.737
  157   1HB   GLU  19          HB2       GLU  19  11.628  -0.340   6.264
  158   2HB   GLU  19          HB1       GLU  19  12.103  -2.032   6.111
  159   1HG   GLU  19          HG2       GLU  19  13.800  -0.946   4.319
  160   2HG   GLU  19          HG1       GLU  19  13.617   0.430   5.408
  161    H    ALA  20           HN       ALA  20  12.074  -1.286   1.873
  162    HA   ALA  20           HA       ALA  20  13.055  -4.080   2.009
  163   1HB   ALA  20          HB1       ALA  20  10.786  -4.528   1.558
  164   2HB   ALA  20          HB2       ALA  20  11.506  -4.502  -0.051
  165   3HB   ALA  20          HB3       ALA  20  10.615  -3.098   0.539
  166    H    VAL  21           HN       VAL  21  13.784  -4.709  -0.350
  167    HA   VAL  21           HA       VAL  21  15.812  -2.922  -1.223
  168    HB   VAL  21           HB       VAL  21  15.938  -4.476  -3.156
  169   1HG1  VAL  21          HG11      VAL  21  16.557  -6.353  -1.899
  170   2HG1  VAL  21          HG12      VAL  21  15.232  -6.143  -0.754
  171   3HG1  VAL  21          HG13      VAL  21  16.622  -5.058  -0.704
  172   1HG2  VAL  21          HG21      VAL  21  13.713  -4.907  -3.797
  173   2HG2  VAL  21          HG22      VAL  21  13.200  -5.254  -2.147
  174   3HG2  VAL  21          HG23      VAL  21  14.194  -6.416  -3.024
  175    H    ASP  22           HN       ASP  22  12.509  -3.422  -2.458
  176    HA   ASP  22           HA       ASP  22  12.600  -0.754  -3.756
  177   1HB   ASP  22          HB2       ASP  22  12.002  -3.366  -5.191
  178   2HB   ASP  22          HB1       ASP  22  11.854  -1.760  -5.904
  179    H    ALA  23           HN       ALA  23  10.386  -0.056  -4.380
  180    HA   ALA  23           HA       ALA  23   8.392  -0.679  -2.424
  181   1HB   ALA  23          HB1       ALA  23   8.691   0.908  -4.898
  182   2HB   ALA  23          HB2       ALA  23   7.931   1.350  -3.369
  183   3HB   ALA  23          HB3       ALA  23   7.034   0.408  -4.560
  184    H    ALA  24           HN       ALA  24   9.123  -2.080  -5.566
  185    HA   ALA  24           HA       ALA  24   6.660  -3.428  -6.094
  186   1HB   ALA  24          HB1       ALA  24   8.746  -3.106  -7.554
  187   2HB   ALA  24          HB2       ALA  24   7.993  -4.699  -7.633
  188   3HB   ALA  24          HB3       ALA  24   9.451  -4.459  -6.670
  189    H    THR  25           HN       THR  25   9.562  -4.472  -4.295
  190    HA   THR  25           HA       THR  25   8.539  -7.069  -3.555
  191    HB   THR  25           HB       THR  25  10.704  -5.226  -2.488
  192    HG1  THR  25           HG1      THR  25  10.672  -7.566  -4.079
  193   1HG2  THR  25          HG21      THR  25  10.217  -8.127  -1.738
  194   2HG2  THR  25          HG22      THR  25   9.917  -6.746  -0.677
  195   3HG2  THR  25          HG23      THR  25  11.563  -7.121  -1.197
  196    H    ALA  26           HN       ALA  26   8.766  -3.962  -1.766
  197    HA   ALA  26           HA       ALA  26   7.523  -4.840   0.634
  198   1HB   ALA  26          HB1       ALA  26   8.658  -2.742   0.591
  199   2HB   ALA  26          HB2       ALA  26   6.955  -2.319   0.788
  200   3HB   ALA  26          HB3       ALA  26   7.726  -2.179  -0.796
  201    H    GLU  27           HN       GLU  27   6.044  -3.018  -2.069
  202    HA   GLU  27           HA       GLU  27   3.398  -2.889  -1.347
  203   1HB   GLU  27          HB2       GLU  27   4.457  -2.054  -3.437
  204   2HB   GLU  27          HB1       GLU  27   4.483  -3.702  -4.064
  205   1HG   GLU  27          HG2       GLU  27   1.905  -3.635  -3.506
  206   2HG   GLU  27          HG1       GLU  27   2.138  -1.889  -3.604
  207    H    LYS  28           HN       LYS  28   5.023  -5.838  -2.522
  208    HA   LYS  28           HA       LYS  28   2.659  -7.460  -2.836
  209   1HB   LYS  28          HB2       LYS  28   5.513  -8.177  -2.049
  210   2HB   LYS  28          HB1       LYS  28   4.312  -9.316  -2.659
  211   1HG   LYS  28          HG2       LYS  28   4.379  -8.446  -4.814
  212   2HG   LYS  28          HG1       LYS  28   4.934  -6.863  -4.269
  213   1HD   LYS  28          HD2       LYS  28   6.940  -7.647  -5.073
  214   2HD   LYS  28          HD1       LYS  28   7.029  -8.345  -3.455
  215   1HE   LYS  28          HE2       LYS  28   6.262 -10.486  -4.238
  216   2HE   LYS  28          HE1       LYS  28   5.827  -9.816  -5.823
  217   1HZ   LYS  28          HZ1       LYS  28   8.019 -10.893  -5.855
  218   2HZ   LYS  28          HZ2       LYS  28   8.564  -9.813  -4.662
  219   3HZ   LYS  28          HZ3       LYS  28   8.125  -9.236  -6.199
  220    H    VAL  29           HN       VAL  29   4.892  -6.905  -0.123
  221    HA   VAL  29           HA       VAL  29   3.505  -8.587   1.790
  222    HB   VAL  29           HB       VAL  29   5.520  -6.320   1.870
  223   1HG1  VAL  29          HG11      VAL  29   5.796  -6.671   4.288
  224   2HG1  VAL  29          HG12      VAL  29   4.471  -7.835   4.285
  225   3HG1  VAL  29          HG13      VAL  29   4.151  -6.133   3.936
  226   1HG2  VAL  29          HG21      VAL  29   5.676  -9.246   2.650
  227   2HG2  VAL  29          HG22      VAL  29   7.022  -8.107   2.618
  228   3HG2  VAL  29          HG23      VAL  29   6.227  -8.574   1.115
  229    H    LEU  30           HN       LEU  30   3.297  -5.156   0.846
  230    HA   LEU  30           HA       LEU  30   1.509  -4.350   2.937
  231   1HB   LEU  30          HB2       LEU  30   2.200  -3.370   0.160
  232   2HB   LEU  30          HB1       LEU  30   0.992  -2.537   1.125
  233    HG   LEU  30           HG       LEU  30   3.500  -1.741   1.179
  234   1HD1  LEU  30          HD11      LEU  30   1.853  -0.687   2.552
  235   2HD1  LEU  30          HD12      LEU  30   3.230  -1.081   3.589
  236   3HD1  LEU  30          HD13      LEU  30   1.774  -2.083   3.630
  237   1HD2  LEU  30          HD21      LEU  30   4.666  -2.717   3.202
  238   2HD2  LEU  30          HD22      LEU  30   4.668  -3.714   1.763
  239   3HD2  LEU  30          HD23      LEU  30   3.571  -4.080   3.091
  240    H    LYS  31           HN       LYS  31   1.064  -5.889  -0.199
  241    HA   LYS  31           HA       LYS  31  -1.800  -5.637  -0.446
  242   1HB   LYS  31          HB2       LYS  31   0.157  -6.572  -2.020
  243   2HB   LYS  31          HB1       LYS  31  -0.262  -8.089  -1.261
  244   1HG   LYS  31          HG2       LYS  31  -2.375  -6.312  -2.483
  245   2HG   LYS  31          HG1       LYS  31  -1.497  -7.497  -3.449
  246   1HD   LYS  31          HD2       LYS  31  -3.143  -8.092  -0.968
  247   2HD   LYS  31          HD1       LYS  31  -3.600  -8.467  -2.628
  248   1HE   LYS  31          HE2       LYS  31  -1.017  -9.572  -2.293
  249   2HE   LYS  31          HE1       LYS  31  -1.927 -10.005  -0.827
  250   1HZ   LYS  31          HZ1       LYS  31  -2.311 -11.569  -2.692
  251   2HZ   LYS  31          HZ2       LYS  31  -2.969 -10.292  -3.600
  252   3HZ   LYS  31          HZ3       LYS  31  -3.733 -10.805  -2.172
  253    H    GLN  32           HN       GLN  32   0.338  -8.071   0.999
  254    HA   GLN  32           HA       GLN  32  -1.572  -9.948   1.922
  255   1HB   GLN  32          HB2       GLN  32   1.180  -9.068   2.610
  256   2HB   GLN  32          HB1       GLN  32   0.332 -10.039   3.814
  257   1HG   GLN  32          HG2       GLN  32  -0.054 -11.812   2.213
  258   2HG   GLN  32          HG1       GLN  32   0.594 -10.824   0.903
  259   1HE2  GLN  32          HE21      GLN  32   1.443 -12.976   3.507
  260   2HE2  GLN  32          HE22      GLN  32   3.134 -12.889   3.299
  261    H    TYR  33           HN       TYR  33  -0.387  -6.938   3.398
  262    HA   TYR  33           HA       TYR  33  -1.819  -7.133   5.899
  263   1HB   TYR  33          HB2       TYR  33   0.058  -5.603   5.501
  264   2HB   TYR  33          HB1       TYR  33  -0.848  -4.779   4.233
  265    HD1  TYR  33           HD1      TYR  33  -0.776  -5.539   7.855
  266    HD2  TYR  33           HD2      TYR  33  -2.446  -3.088   4.754
  267    HE1  TYR  33           HE1      TYR  33  -1.807  -4.091   9.565
  268    HE2  TYR  33           HE2      TYR  33  -3.477  -1.626   6.468
  269    HH   TYR  33           HH       TYR  33  -2.629  -1.778   9.768
  270    H    ILE  34           HN       ILE  34  -2.581  -5.736   2.728
  271    HA   ILE  34           HA       ILE  34  -5.158  -4.630   3.397
  272    HB   ILE  34           HB       ILE  34  -3.964  -5.661   0.804
  273   1HG1  ILE  34          HG12      ILE  34  -2.755  -3.827   2.187
  274   2HG1  ILE  34          HG11      ILE  34  -3.033  -3.519   0.479
  275   1HG2  ILE  34          HG21      ILE  34  -6.391  -5.423   0.604
  276   2HG2  ILE  34          HG22      ILE  34  -5.581  -4.154  -0.313
  277   3HG2  ILE  34          HG23      ILE  34  -6.302  -3.786   1.254
  278   1HD1  ILE  34          HD11      ILE  34  -3.633  -1.718   2.367
  279   2HD1  ILE  34          HD12      ILE  34  -5.141  -2.633   2.398
  280   3HD1  ILE  34          HD13      ILE  34  -4.596  -1.882   0.898
  281    H    ASN  35           HN       ASN  35  -4.034  -7.834   2.461
  282    HA   ASN  35           HA       ASN  35  -6.485  -9.057   1.696
  283   1HB   ASN  35          HB2       ASN  35  -4.094  -9.912   1.535
  284   2HB   ASN  35          HB1       ASN  35  -4.207 -10.319   3.247
  285   1HD2  ASN  35          HD21      ASN  35  -4.018 -12.138   0.807
  286   2HD2  ASN  35          HD22      ASN  35  -5.353 -13.178   0.944
  287    H    ASP  36           HN       ASP  36  -5.201  -8.242   4.868
  288    HA   ASP  36           HA       ASP  36  -7.030  -9.920   6.394
  289   1HB   ASP  36          HB2       ASP  36  -4.791  -9.083   7.145
  290   2HB   ASP  36          HB1       ASP  36  -5.453  -7.448   7.183
  291    H    ASN  37           HN       ASN  37  -6.940  -6.467   5.490
  292    HA   ASN  37           HA       ASN  37  -9.436  -5.825   6.860
  293   1HB   ASN  37          HB2       ASN  37  -7.648  -4.449   4.838
  294   2HB   ASN  37          HB1       ASN  37  -9.102  -3.686   5.491
  295   1HD2  ASN  37          HD21      ASN  37  -6.221  -2.912   5.928
  296   2HD2  ASN  37          HD22      ASN  37  -5.998  -2.955   7.618
  297    H    GLY  38           HN       GLY  38  -8.508  -6.858   3.625
  298   1HA   GLY  38          HA2       GLY  38  -9.941  -7.805   1.979
  299   2HA   GLY  38          HA1       GLY  38 -11.333  -7.319   2.948
  300    H    ILE  39           HN       ILE  39  -8.753  -5.092   2.101
  301    HA   ILE  39           HA       ILE  39 -10.711  -3.574   0.413
  302    HB   ILE  39           HB       ILE  39  -8.286  -2.680   2.011
  303   1HG1  ILE  39          HG12      ILE  39 -10.157  -3.411   3.444
  304   2HG1  ILE  39          HG11      ILE  39  -9.963  -1.658   3.524
  305   1HG2  ILE  39          HG21      ILE  39  -8.536  -1.116   0.251
  306   2HG2  ILE  39          HG22      ILE  39  -9.406  -0.390   1.602
  307   3HG2  ILE  39          HG23      ILE  39 -10.297  -1.200   0.313
  308   1HD1  ILE  39          HD11      ILE  39 -11.767  -1.437   1.792
  309   2HD1  ILE  39          HD12      ILE  39 -12.331  -2.164   3.296
  310   3HD1  ILE  39          HD13      ILE  39 -12.018  -3.180   1.889
  311    H    ASP  40           HN       ASP  40  -9.817  -5.245  -1.274
  312    HA   ASP  40           HA       ASP  40  -7.260  -4.216  -2.464
  313   1HB   ASP  40          HB2       ASP  40  -8.609  -6.907  -2.303
  314   2HB   ASP  40          HB1       ASP  40  -7.444  -6.579  -3.591
  315    H    GLY  41           HN       GLY  41  -8.019  -2.679  -3.940
  316   1HA   GLY  41          HA2       GLY  41  -9.901  -3.692  -6.028
  317   2HA   GLY  41          HA1       GLY  41 -10.119  -2.083  -5.334
  318    H    GLU  42           HN       GLU  42  -8.524  -0.450  -5.803
  319    HA   GLU  42           HA       GLU  42  -6.676  -1.122  -8.069
  320   1HB   GLU  42          HB2       GLU  42  -8.990   0.655  -7.901
  321   2HB   GLU  42          HB1       GLU  42  -7.544   1.531  -8.397
  322   1HG   GLU  42          HG2       GLU  42  -7.366   0.398 -10.380
  323   2HG   GLU  42          HG1       GLU  42  -8.002  -1.102  -9.702
  324    H    TRP  43           HN       TRP  43  -4.614  -0.658  -7.457
  325    HA   TRP  43           HA       TRP  43  -4.122   1.320  -5.282
  326   1HB   TRP  43          HB2       TRP  43  -2.428  -0.759  -6.705
  327   2HB   TRP  43          HB1       TRP  43  -1.797   0.324  -5.478
  328    HD1  TRP  43           HD1      TRP  43  -5.290  -1.212  -5.042
  329    HE1  TRP  43           HE1      TRP  43  -5.198  -2.890  -3.105
  330    HE3  TRP  43           HE3      TRP  43  -0.283  -1.204  -4.127
  331    HZ2  TRP  43           HZ2      TRP  43  -3.268  -4.046  -1.359
  332    HZ3  TRP  43           HZ3      TRP  43   0.657  -2.590  -2.292
  333    HH2  TRP  43           HH2      TRP  43  -0.822  -4.004  -0.914
  334    H    THR  44           HN       THR  44  -2.116   2.723  -5.664
  335    HA   THR  44           HA       THR  44  -1.509   3.363  -8.485
  336    HB   THR  44           HB       THR  44  -2.147   5.743  -8.142
  337    HG1  THR  44           HG1      THR  44  -2.877   6.406  -6.275
  338   1HG2  THR  44          HG21      THR  44  -4.513   3.986  -7.484
  339   2HG2  THR  44          HG22      THR  44  -3.733   3.946  -9.065
  340   3HG2  THR  44          HG23      THR  44  -4.476   5.437  -8.486
  341    H    TYR  45           HN       TYR  45   0.626   3.886  -8.597
  342    HA   TYR  45           HA       TYR  45   2.126   4.277  -6.066
  343   1HB   TYR  45          HB2       TYR  45   2.802   2.581  -7.739
  344   2HB   TYR  45          HB1       TYR  45   2.988   3.848  -8.950
  345    HD1  TYR  45           HD1      TYR  45   3.998   3.499  -5.346
  346    HD2  TYR  45           HD2      TYR  45   5.224   4.303  -9.383
  347    HE1  TYR  45           HE1      TYR  45   6.313   3.916  -4.561
  348    HE2  TYR  45           HE2      TYR  45   7.537   4.722  -8.598
  349    HH   TYR  45           HH       TYR  45   8.500   5.528  -6.064
  350    H    ASP  46           HN       ASP  46   3.758   6.047  -5.969
  351    HA   ASP  46           HA       ASP  46   3.244   8.341  -7.820
  352   1HB   ASP  46          HB2       ASP  46   3.365   8.502  -4.787
  353   2HB   ASP  46          HB1       ASP  46   3.055   9.837  -5.893
  354    H    ASP  47           HN       ASP  47   5.172   9.101  -8.562
  355    HA   ASP  47           HA       ASP  47   7.710   8.133  -7.548
  356   1HB   ASP  47          HB2       ASP  47   8.597   9.686  -9.279
  357   2HB   ASP  47          HB1       ASP  47   7.288   8.685  -9.905
  358    H    ALA  48           HN       ALA  48   5.651  10.611  -6.429
  359    HA   ALA  48           HA       ALA  48   7.344  12.745  -5.705
  360   1HB   ALA  48          HB1       ALA  48   5.636  12.698  -3.656
  361   2HB   ALA  48          HB2       ALA  48   4.862  11.447  -4.633
  362   3HB   ALA  48          HB3       ALA  48   5.079  13.073  -5.287
  363    H    THR  49           HN       THR  49   6.299  10.268  -3.361
  364    HA   THR  49           HA       THR  49   9.082  10.197  -2.247
  365    HB   THR  49           HB       THR  49   7.654  11.706  -0.927
  366    HG1  THR  49           HG1      THR  49   8.445  10.873   0.818
  367   1HG2  THR  49          HG21      THR  49   5.450  11.309  -0.731
  368   2HG2  THR  49          HG22      THR  49   5.797   9.856   0.206
  369   3HG2  THR  49          HG23      THR  49   5.650   9.759  -1.550
  370    H    LYS  50           HN       LYS  50   7.719   8.323  -4.034
  371    HA   LYS  50           HA       LYS  50   7.328   6.017  -4.256
  372   1HB   LYS  50          HB2       LYS  50   8.908   6.038  -1.663
  373   2HB   LYS  50          HB1       LYS  50   8.667   4.632  -2.698
  374   1HG   LYS  50          HG2       LYS  50   9.785   5.821  -4.561
  375   2HG   LYS  50          HG1       LYS  50  10.061   7.203  -3.500
  376   1HD   LYS  50          HD2       LYS  50  11.732   6.152  -2.340
  377   2HD   LYS  50          HD1       LYS  50  10.966   4.569  -2.468
  378   1HE   LYS  50          HE2       LYS  50  11.951   4.105  -4.512
  379   2HE   LYS  50          HE1       LYS  50  12.016   5.815  -4.983
  380   1HZ   LYS  50          HZ1       LYS  50  14.213   4.933  -4.346
  381   2HZ   LYS  50          HZ2       LYS  50  13.615   4.603  -2.791
  382   3HZ   LYS  50          HZ3       LYS  50  13.712   6.206  -3.344
  383    H    THR  51           HN       THR  51   5.104   7.291  -3.266
  384    HA   THR  51           HA       THR  51   4.187   5.723  -0.896
  385    HB   THR  51           HB       THR  51   3.015   8.087  -2.410
  386    HG1  THR  51           HG1      THR  51   3.753   9.243  -0.640
  387   1HG2  THR  51          HG21      THR  51   2.099   6.527  -0.003
  388   2HG2  THR  51          HG22      THR  51   1.158   7.071  -1.392
  389   3HG2  THR  51          HG23      THR  51   1.683   8.233  -0.174
  390    H    TRP  52           HN       TRP  52   1.859   4.884  -1.106
  391    HA   TRP  52           HA       TRP  52   1.237   3.990  -3.900
  392   1HB   TRP  52          HB2       TRP  52   1.583   2.436  -1.339
  393   2HB   TRP  52          HB1       TRP  52   0.626   1.799  -2.669
  394    HD1  TRP  52           HD1      TRP  52   4.191   2.493  -1.618
  395    HE1  TRP  52           HE1      TRP  52   5.792   1.505  -3.387
  396    HE3  TRP  52           HE3      TRP  52   0.823   1.237  -5.187
  397    HZ2  TRP  52           HZ2      TRP  52   5.638   0.321  -6.000
  398    HZ3  TRP  52           HZ3      TRP  52   1.548   0.175  -7.317
  399    HH2  TRP  52           HH2      TRP  52   3.953  -0.286  -7.723
  400    H    THR  53           HN       THR  53  -1.009   2.581  -3.508
  401    HA   THR  53           HA       THR  53  -2.848   3.916  -1.633
  402    HB   THR  53           HB       THR  53  -3.424   4.064  -4.594
  403    HG1  THR  53           HG1      THR  53  -2.096   5.973  -2.971
  404   1HG2  THR  53          HG21      THR  53  -4.500   5.290  -2.076
  405   2HG2  THR  53          HG22      THR  53  -5.374   4.536  -3.410
  406   3HG2  THR  53          HG23      THR  53  -4.682   6.146  -3.608
  407    H    VAL  54           HN       VAL  54  -5.179   3.007  -2.116
  408    HA   VAL  54           HA       VAL  54  -5.446   0.497  -3.537
  409    HB   VAL  54           HB       VAL  54  -3.980  -0.325  -1.792
  410   1HG1  VAL  54          HG11      VAL  54  -5.546   1.536  -0.143
  411   2HG1  VAL  54          HG12      VAL  54  -3.877   1.004   0.029
  412   3HG1  VAL  54          HG13      VAL  54  -5.187   0.003   0.648
  413   1HG2  VAL  54          HG21      VAL  54  -6.338  -1.496  -2.280
  414   2HG2  VAL  54          HG22      VAL  54  -6.596  -1.112  -0.579
  415   3HG2  VAL  54          HG23      VAL  54  -5.229  -2.124  -1.056
  416    H    THR  55           HN       THR  55  -7.388   1.586  -4.208
  417    HA   THR  55           HA       THR  55  -9.412   2.282  -2.154
  418    HB   THR  55           HB       THR  55  -9.669   2.406  -5.163
  419    HG1  THR  55           HG1      THR  55  -8.381   4.237  -3.421
  420   1HG2  THR  55          HG21      THR  55 -10.731   4.148  -2.921
  421   2HG2  THR  55          HG22      THR  55 -11.653   2.902  -3.762
  422   3HG2  THR  55          HG23      THR  55 -11.097   4.330  -4.637
  423    H    GLU  56           HN       GLU  56 -11.049   0.886  -1.624
  424    HA   GLU  56           HA       GLU  56 -11.203  -1.800  -2.588
  425   1HB   GLU  56          HB2       GLU  56 -12.082  -0.697  -0.427
  426   2HB   GLU  56          HB1       GLU  56 -13.481  -0.212  -1.385
  427   1HG   GLU  56          HG2       GLU  56 -13.519  -2.749  -2.085
  428   2HG   GLU  56          HG1       GLU  56 -12.586  -2.970  -0.604
  Start of MODEL    4
    1   1H    THR   1          HT1       THR   1  15.154   2.998   5.002
    2   2H    THR   1          HT2       THR   1  15.893   4.229   4.094
    3   3H    THR   1          HT3       THR   1  15.303   2.836   3.321
    4    HA   THR   1           HA       THR   1  13.674   4.935   4.663
    5    HB   THR   1           HB       THR   1  13.732   4.041   1.775
    6    HG1  THR   1           HG1      THR   1  15.224   6.136   2.968
    7   1HG2  THR   1          HG21      THR   1  11.812   5.386   2.511
    8   2HG2  THR   1          HG22      THR   1  12.835   6.318   1.418
    9   3HG2  THR   1          HG23      THR   1  12.906   6.610   3.156
   10    H    THR   2           HN       THR   2  11.571   4.325   5.112
   11    HA   THR   2           HA       THR   2  10.823   1.484   4.592
   12    HB   THR   2           HB       THR   2   9.439   3.525   6.345
   13    HG1  THR   2           HG1      THR   2  11.544   3.504   7.022
   14   1HG2  THR   2          HG21      THR   2   8.302   1.360   5.873
   15   2HG2  THR   2          HG22      THR   2   8.721   1.544   7.576
   16   3HG2  THR   2          HG23      THR   2   9.700   0.512   6.534
   17    H    PHE   3           HN       PHE   3   9.109   0.990   3.250
   18    HA   PHE   3           HA       PHE   3   7.999   3.030   1.506
   19   1HB   PHE   3          HB2       PHE   3   7.239   0.128   2.001
   20   2HB   PHE   3          HB1       PHE   3   6.747   1.086   0.605
   21    HD1  PHE   3           HD1      PHE   3   9.055   2.525  -0.260
   22    HD2  PHE   3           HD2      PHE   3   8.860  -1.442   1.391
   23    HE1  PHE   3           HE1      PHE   3  11.179   1.941  -1.401
   24    HE2  PHE   3           HE2      PHE   3  10.982  -2.019   0.249
   25    HZ   PHE   3           HZ       PHE   3  12.142  -0.329  -1.146
   26    H    LYS   4           HN       LYS   4   5.628   3.444   1.313
   27    HA   LYS   4           HA       LYS   4   4.099   3.049   3.858
   28   1HB   LYS   4          HB2       LYS   4   5.387   5.299   3.546
   29   2HB   LYS   4          HB1       LYS   4   4.143   5.663   2.354
   30   1HG   LYS   4          HG2       LYS   4   2.424   5.113   4.143
   31   2HG   LYS   4          HG1       LYS   4   3.756   5.084   5.295
   32   1HD   LYS   4          HD2       LYS   4   3.535   7.313   5.501
   33   2HD   LYS   4          HD1       LYS   4   4.128   7.461   3.847
   34   1HE   LYS   4          HE2       LYS   4   1.846   7.348   2.972
   35   2HE   LYS   4          HE1       LYS   4   1.208   7.066   4.603
   36   1HZ   LYS   4          HZ1       LYS   4   2.260   9.164   5.294
   37   2HZ   LYS   4          HZ2       LYS   4   1.078   9.406   4.098
   38   3HZ   LYS   4          HZ3       LYS   4   2.726   9.453   3.690
   39    H    LEU   5           HN       LEU   5   1.806   3.062   3.556
   40    HA   LEU   5           HA       LEU   5   0.716   3.458   0.827
   41   1HB   LEU   5          HB2       LEU   5   1.594   1.000   1.406
   42   2HB   LEU   5          HB1       LEU   5   0.050   0.896   2.238
   43    HG   LEU   5           HG       LEU   5  -0.253   2.095  -0.408
   44   1HD1  LEU   5          HD11      LEU   5   1.748   0.410  -0.631
   45   2HD1  LEU   5          HD12      LEU   5   0.434   0.358  -1.813
   46   3HD1  LEU   5          HD13      LEU   5   0.486  -0.820  -0.491
   47   1HD2  LEU   5          HD21      LEU   5  -1.394  -0.359   0.964
   48   2HD2  LEU   5          HD22      LEU   5  -1.969   0.279  -0.576
   49   3HD2  LEU   5          HD23      LEU   5  -2.128   1.243   0.892
   50    H    ILE   6           HN       ILE   6  -1.382   4.230   0.957
   51    HA   ILE   6           HA       ILE   6  -2.605   4.383   3.685
   52    HB   ILE   6           HB       ILE   6  -2.913   6.038   1.162
   53   1HG1  ILE   6          HG12      ILE   6  -0.742   6.289   2.329
   54   2HG1  ILE   6          HG11      ILE   6  -1.709   7.758   2.445
   55   1HG2  ILE   6          HG21      ILE   6  -4.085   7.627   2.826
   56   2HG2  ILE   6          HG22      ILE   6  -4.249   6.211   3.864
   57   3HG2  ILE   6          HG23      ILE   6  -4.999   6.226   2.268
   58   1HD1  ILE   6          HD11      ILE   6  -2.474   6.233   4.670
   59   2HD1  ILE   6          HD12      ILE   6  -1.419   7.645   4.681
   60   3HD1  ILE   6          HD13      ILE   6  -0.726   6.028   4.568
   61    H    ILE   7           HN       ILE   7  -4.599   3.454   4.019
   62    HA   ILE   7           HA       ILE   7  -5.778   1.824   1.859
   63    HB   ILE   7           HB       ILE   7  -6.493   2.240   4.784
   64   1HG1  ILE   7          HG12      ILE   7  -5.009  -0.059   3.477
   65   2HG1  ILE   7          HG11      ILE   7  -4.198   1.286   4.279
   66   1HG2  ILE   7          HG21      ILE   7  -7.463  -0.179   4.250
   67   2HG2  ILE   7          HG22      ILE   7  -7.563   0.475   2.615
   68   3HG2  ILE   7          HG23      ILE   7  -8.419   1.270   3.936
   69   1HD1  ILE   7          HD11      ILE   7  -4.349  -0.192   6.053
   70   2HD1  ILE   7          HD12      ILE   7  -5.847  -0.912   5.462
   71   3HD1  ILE   7          HD13      ILE   7  -5.877   0.667   6.248
   72    H    ASN   8           HN       ASN   8  -7.204   2.823   0.496
   73    HA   ASN   8           HA       ASN   8  -8.944   5.011   1.577
   74   1HB   ASN   8          HB2       ASN   8  -7.747   4.328  -1.105
   75   2HB   ASN   8          HB1       ASN   8  -9.141   5.402  -1.004
   76   1HD2  ASN   8          HD21      ASN   8  -7.534   7.074  -1.862
   77   2HD2  ASN   8          HD22      ASN   8  -6.533   7.873  -0.736
   78    H    GLY   9           HN       GLY   9  -9.878   2.567   2.281
   79   1HA   GLY   9          HA2       GLY   9 -11.589   1.385   0.234
   80   2HA   GLY   9          HA1       GLY   9 -11.572   0.953   1.947
   81    H    LYS  10           HN       LYS  10 -13.961   1.331   0.426
   82    HA   LYS  10           HA       LYS  10 -15.191   3.853   0.589
   83   1HB   LYS  10          HB2       LYS  10 -16.247   1.034   0.877
   84   2HB   LYS  10          HB1       LYS  10 -17.298   2.440   0.707
   85   1HG   LYS  10          HG2       LYS  10 -15.104   2.247  -1.277
   86   2HG   LYS  10          HG1       LYS  10 -16.355   1.010  -1.408
   87   1HD   LYS  10          HD2       LYS  10 -18.086   2.668  -1.620
   88   2HD   LYS  10          HD1       LYS  10 -16.968   3.969  -1.211
   89   1HE   LYS  10          HE2       LYS  10 -15.619   3.207  -3.293
   90   2HE   LYS  10          HE1       LYS  10 -17.101   2.345  -3.755
   91   1HZ   LYS  10          HZ1       LYS  10 -16.953   5.221  -3.016
   92   2HZ   LYS  10          HZ2       LYS  10 -18.351   4.382  -3.495
   93   3HZ   LYS  10          HZ3       LYS  10 -17.085   4.632  -4.601
   94    H    THR  11           HN       THR  11 -14.521   1.528   3.126
   95    HA   THR  11           HA       THR  11 -15.719   3.413   5.124
   96    HB   THR  11           HB       THR  11 -15.832   0.391   5.274
   97    HG1  THR  11           HG1      THR  11 -17.817   2.188   4.343
   98   1HG2  THR  11          HG21      THR  11 -16.130   1.940   7.319
   99   2HG2  THR  11          HG22      THR  11 -17.383   0.734   7.023
  100   3HG2  THR  11          HG23      THR  11 -17.653   2.416   6.568
  101    H    LEU  12           HN       LEU  12 -13.515   0.646   4.604
  102    HA   LEU  12           HA       LEU  12 -12.093   1.088   7.129
  103   1HB   LEU  12          HB2       LEU  12 -11.544  -0.625   4.681
  104   2HB   LEU  12          HB1       LEU  12 -10.680  -0.755   6.213
  105    HG   LEU  12           HG       LEU  12 -13.673  -0.900   6.238
  106   1HD1  LEU  12          HD11      LEU  12 -11.806  -2.893   5.043
  107   2HD1  LEU  12          HD12      LEU  12 -13.499  -2.572   4.668
  108   3HD1  LEU  12          HD13      LEU  12 -13.076  -3.517   6.096
  109   1HD2  LEU  12          HD21      LEU  12 -12.777  -2.756   7.967
  110   2HD2  LEU  12          HD22      LEU  12 -12.904  -1.052   8.405
  111   3HD2  LEU  12          HD23      LEU  12 -11.348  -1.723   7.916
  112    H    LYS  13           HN       LYS  13 -10.026   2.024   7.347
  113    HA   LYS  13           HA       LYS  13  -8.573   2.997   4.964
  114   1HB   LYS  13          HB2       LYS  13 -10.086   4.707   6.931
  115   2HB   LYS  13          HB1       LYS  13  -8.667   5.352   6.105
  116   1HG   LYS  13          HG2       LYS  13  -9.805   4.482   3.937
  117   2HG   LYS  13          HG1       LYS  13 -11.272   4.419   4.914
  118   1HD   LYS  13          HD2       LYS  13 -11.304   6.737   5.251
  119   2HD   LYS  13          HD1       LYS  13  -9.585   6.909   4.895
  120   1HE   LYS  13          HE2       LYS  13  -9.936   7.018   2.631
  121   2HE   LYS  13          HE1       LYS  13 -11.255   5.831   2.682
  122   1HZ   LYS  13          HZ1       LYS  13 -11.394   8.643   3.638
  123   2HZ   LYS  13          HZ2       LYS  13 -12.643   7.500   3.779
  124   3HZ   LYS  13          HZ3       LYS  13 -12.141   8.028   2.245
  125    H    GLY  14           HN       GLY  14  -6.747   4.634   6.076
  126   1HA   GLY  14          HA2       GLY  14  -5.470   4.765   8.291
  127   2HA   GLY  14          HA1       GLY  14  -5.543   3.003   8.274
  128    H    GLU  15           HN       GLU  15  -3.073   4.245   8.373
  129    HA   GLU  15           HA       GLU  15  -2.000   4.022   5.584
  130   1HB   GLU  15          HB2       GLU  15  -0.111   5.349   6.531
  131   2HB   GLU  15          HB1       GLU  15  -1.658   6.170   6.725
  132   1HG   GLU  15          HG2       GLU  15  -1.644   5.951   9.003
  133   2HG   GLU  15          HG1       GLU  15  -0.862   4.372   8.952
  134    H    THR  16           HN       THR  16   0.227   3.002   5.468
  135    HA   THR  16           HA       THR  16   0.997   1.199   7.667
  136    HB   THR  16           HB       THR  16  -0.873   0.013   6.604
  137    HG1  THR  16           HG1      THR  16   0.609  -1.414   7.234
  138   1HG2  THR  16          HG21      THR  16   0.733   0.506   4.087
  139   2HG2  THR  16          HG22      THR  16  -0.950   0.928   4.410
  140   3HG2  THR  16          HG23      THR  16  -0.493  -0.760   4.188
  141    H    THR  17           HN       THR  17   3.100   0.310   7.349
  142    HA   THR  17           HA       THR  17   4.542   1.109   4.850
  143    HB   THR  17           HB       THR  17   6.386   1.918   6.291
  144    HG1  THR  17           HG1      THR  17   6.140   0.762   8.124
  145   1HG2  THR  17          HG21      THR  17   5.434   3.962   6.358
  146   2HG2  THR  17          HG22      THR  17   4.252   3.444   7.559
  147   3HG2  THR  17          HG23      THR  17   3.936   3.185   5.844
  148    H    THR  18           HN       THR  18   6.516  -0.182   4.509
  149    HA   THR  18           HA       THR  18   6.795  -2.589   6.221
  150    HB   THR  18           HB       THR  18   5.550  -2.379   3.572
  151    HG1  THR  18           HG1      THR  18   4.597  -3.547   5.147
  152   1HG2  THR  18          HG21      THR  18   7.787  -4.415   3.832
  153   2HG2  THR  18          HG22      THR  18   7.810  -3.003   2.775
  154   3HG2  THR  18          HG23      THR  18   6.631  -4.288   2.504
  155    H    GLU  19           HN       GLU  19   8.830  -3.834   5.441
  156    HA   GLU  19           HA       GLU  19  10.927  -1.904   4.496
  157   1HB   GLU  19          HB2       GLU  19  10.996  -2.421   6.929
  158   2HB   GLU  19          HB1       GLU  19  11.112  -4.139   6.546
  159   1HG   GLU  19          HG2       GLU  19  13.238  -3.825   5.448
  160   2HG   GLU  19          HG1       GLU  19  13.095  -2.071   5.563
  161    H    ALA  20           HN       ALA  20  11.850  -2.612   2.606
  162    HA   ALA  20           HA       ALA  20  12.448  -5.461   2.181
  163   1HB   ALA  20          HB1       ALA  20  11.022  -5.285  -0.012
  164   2HB   ALA  20          HB2       ALA  20  10.212  -3.963   0.831
  165   3HB   ALA  20          HB3       ALA  20  10.197  -5.588   1.517
  166    H    VAL  21           HN       VAL  21  13.336  -5.711  -0.168
  167    HA   VAL  21           HA       VAL  21  15.546  -3.971  -0.571
  168    HB   VAL  21           HB       VAL  21  15.722  -5.179  -2.735
  169   1HG1  VAL  21          HG11      VAL  21  14.718  -7.267  -0.856
  170   2HG1  VAL  21          HG12      VAL  21  16.021  -6.223  -0.287
  171   3HG1  VAL  21          HG13      VAL  21  16.240  -7.191  -1.745
  172   1HG2  VAL  21          HG21      VAL  21  12.864  -5.894  -2.068
  173   2HG2  VAL  21          HG22      VAL  21  13.845  -6.964  -3.068
  174   3HG2  VAL  21          HG23      VAL  21  13.532  -5.310  -3.592
  175    H    ASP  22           HN       ASP  22  12.326  -3.987  -2.089
  176    HA   ASP  22           HA       ASP  22  12.689  -1.152  -2.882
  177   1HB   ASP  22          HB2       ASP  22  12.045  -3.422  -4.800
  178   2HB   ASP  22          HB1       ASP  22  12.056  -1.710  -5.222
  179    H    ALA  23           HN       ALA  23  10.583  -0.184  -3.491
  180    HA   ALA  23           HA       ALA  23   8.406  -0.985  -1.825
  181   1HB   ALA  23          HB1       ALA  23   8.239   1.224  -2.446
  182   2HB   ALA  23          HB2       ALA  23   7.242   0.555  -3.738
  183   3HB   ALA  23          HB3       ALA  23   8.939   0.930  -4.038
  184    H    ALA  24           HN       ALA  24   9.307  -1.928  -5.087
  185    HA   ALA  24           HA       ALA  24   6.810  -2.962  -6.017
  186   1HB   ALA  24          HB1       ALA  24   9.609  -4.028  -6.518
  187   2HB   ALA  24          HB2       ALA  24   8.952  -2.594  -7.306
  188   3HB   ALA  24          HB3       ALA  24   8.218  -4.172  -7.591
  189    H    THR  25           HN       THR  25   9.462  -4.516  -4.199
  190    HA   THR  25           HA       THR  25   8.191  -7.100  -3.971
  191    HB   THR  25           HB       THR  25  10.392  -5.645  -2.466
  192    HG1  THR  25           HG1      THR  25  10.377  -7.764  -4.346
  193   1HG2  THR  25          HG21      THR  25  10.992  -7.788  -1.444
  194   2HG2  THR  25          HG22      THR  25   9.626  -8.573  -2.237
  195   3HG2  THR  25          HG23      THR  25   9.341  -7.356  -0.989
  196    H    ALA  26           HN       ALA  26   8.500  -4.350  -1.678
  197    HA   ALA  26           HA       ALA  26   6.990  -5.487   0.445
  198   1HB   ALA  26          HB1       ALA  26   6.600  -2.978   0.968
  199   2HB   ALA  26          HB2       ALA  26   7.530  -2.664  -0.502
  200   3HB   ALA  26          HB3       ALA  26   8.275  -3.522   0.846
  201    H    GLU  27           HN       GLU  27   5.897  -3.137  -2.024
  202    HA   GLU  27           HA       GLU  27   3.217  -2.881  -1.485
  203   1HB   GLU  27          HB2       GLU  27   4.517  -1.830  -3.329
  204   2HB   GLU  27          HB1       GLU  27   4.463  -3.355  -4.213
  205   1HG   GLU  27          HG2       GLU  27   1.861  -3.135  -3.834
  206   2HG   GLU  27          HG1       GLU  27   2.242  -1.425  -3.629
  207    H    LYS  28           HN       LYS  28   4.706  -5.745  -2.999
  208    HA   LYS  28           HA       LYS  28   2.259  -7.078  -3.749
  209   1HB   LYS  28          HB2       LYS  28   4.971  -8.161  -2.882
  210   2HB   LYS  28          HB1       LYS  28   3.743  -9.081  -3.751
  211   1HG   LYS  28          HG2       LYS  28   4.061  -7.899  -5.728
  212   2HG   LYS  28          HG1       LYS  28   4.686  -6.474  -4.896
  213   1HD   LYS  28          HD2       LYS  28   6.687  -7.301  -5.672
  214   2HD   LYS  28          HD1       LYS  28   6.585  -8.240  -4.182
  215   1HE   LYS  28          HE2       LYS  28   5.781 -10.173  -5.331
  216   2HE   LYS  28          HE1       LYS  28   5.437  -9.243  -6.803
  217   1HZ   LYS  28          HZ1       LYS  28   7.756  -8.776  -7.069
  218   2HZ   LYS  28          HZ2       LYS  28   7.578 -10.457  -6.899
  219   3HZ   LYS  28          HZ3       LYS  28   8.136  -9.522  -5.594
  220    H    VAL  29           HN       VAL  29   4.290  -7.167  -0.826
  221    HA   VAL  29           HA       VAL  29   2.614  -8.991   0.681
  222    HB   VAL  29           HB       VAL  29   4.774  -6.946   1.285
  223   1HG1  VAL  29          HG11      VAL  29   3.244  -6.979   3.243
  224   2HG1  VAL  29          HG12      VAL  29   4.809  -7.705   3.624
  225   3HG1  VAL  29          HG13      VAL  29   3.409  -8.736   3.325
  226   1HG2  VAL  29          HG21      VAL  29   6.176  -8.803   1.525
  227   2HG2  VAL  29          HG22      VAL  29   5.098  -9.318   0.228
  228   3HG2  VAL  29          HG23      VAL  29   4.834  -9.894   1.874
  229    H    LEU  30           HN       LEU  30   2.744  -5.453   0.280
  230    HA   LEU  30           HA       LEU  30   0.853  -4.818   2.339
  231   1HB   LEU  30          HB2       LEU  30   1.851  -3.497  -0.190
  232   2HB   LEU  30          HB1       LEU  30   0.629  -2.716   0.799
  233    HG   LEU  30           HG       LEU  30   3.178  -2.163   1.167
  234   1HD1  LEU  30          HD11      LEU  30   1.509  -1.173   2.553
  235   2HD1  LEU  30          HD12      LEU  30   2.741  -1.851   3.625
  236   3HD1  LEU  30          HD13      LEU  30   1.207  -2.700   3.387
  237   1HD2  LEU  30          HD21      LEU  30   2.898  -4.761   2.684
  238   2HD2  LEU  30          HD22      LEU  30   4.062  -3.529   3.113
  239   3HD2  LEU  30          HD23      LEU  30   4.145  -4.286   1.536
  240    H    LYS  31           HN       LYS  31   0.558  -5.817  -1.025
  241    HA   LYS  31           HA       LYS  31  -2.249  -5.287  -1.430
  242   1HB   LYS  31          HB2       LYS  31  -0.241  -6.137  -2.988
  243   2HB   LYS  31          HB1       LYS  31  -0.833  -7.710  -2.511
  244   1HG   LYS  31          HG2       LYS  31  -2.700  -5.593  -3.584
  245   2HG   LYS  31          HG1       LYS  31  -1.833  -6.687  -4.660
  246   1HD   LYS  31          HD2       LYS  31  -3.720  -7.512  -2.429
  247   2HD   LYS  31          HD1       LYS  31  -4.064  -7.588  -4.156
  248   1HE   LYS  31          HE2       LYS  31  -1.606  -8.948  -3.819
  249   2HE   LYS  31          HE1       LYS  31  -2.663  -9.520  -2.508
  250   1HZ   LYS  31          HZ1       LYS  31  -4.419  -9.904  -4.109
  251   2HZ   LYS  31          HZ2       LYS  31  -3.030 -10.761  -4.584
  252   3HZ   LYS  31          HZ3       LYS  31  -3.451  -9.316  -5.372
  253    H    GLN  32           HN       GLN  32  -0.425  -8.087  -0.235
  254    HA   GLN  32           HA       GLN  32  -2.535  -9.914   0.234
  255   1HB   GLN  32          HB2       GLN  32   0.200  -9.384   1.251
  256   2HB   GLN  32          HB1       GLN  32  -0.816 -10.433   2.239
  257   1HG   GLN  32          HG2       GLN  32  -1.248 -11.878   0.301
  258   2HG   GLN  32          HG1       GLN  32  -0.266 -10.821  -0.714
  259   1HE2  GLN  32          HE21      GLN  32   2.002 -11.118  -0.678
  260   2HE2  GLN  32          HE22      GLN  32   2.792 -12.236   0.341
  261    H    TYR  33           HN       TYR  33  -1.276  -7.277   2.261
  262    HA   TYR  33           HA       TYR  33  -2.945  -7.726   4.576
  263   1HB   TYR  33          HB2       TYR  33  -0.936  -6.319   4.582
  264   2HB   TYR  33          HB1       TYR  33  -1.653  -5.240   3.385
  265    HD1  TYR  33           HD1      TYR  33  -2.006  -6.546   6.833
  266    HD2  TYR  33           HD2      TYR  33  -3.144  -3.499   4.034
  267    HE1  TYR  33           HE1      TYR  33  -3.088  -5.283   8.657
  268    HE2  TYR  33           HE2      TYR  33  -4.224  -2.224   5.863
  269    HH   TYR  33           HH       TYR  33  -5.262  -2.870   8.192
  270    H    ILE  34           HN       ILE  34  -3.313  -5.828   1.605
  271    HA   ILE  34           HA       ILE  34  -5.855  -4.615   2.236
  272    HB   ILE  34           HB       ILE  34  -4.491  -5.318  -0.383
  273   1HG1  ILE  34          HG12      ILE  34  -3.289  -3.843   1.376
  274   2HG1  ILE  34          HG11      ILE  34  -3.391  -3.231  -0.268
  275   1HG2  ILE  34          HG21      ILE  34  -6.731  -3.358   0.183
  276   2HG2  ILE  34          HG22      ILE  34  -6.856  -4.845  -0.757
  277   3HG2  ILE  34          HG23      ILE  34  -5.879  -3.504  -1.355
  278   1HD1  ILE  34          HD11      ILE  34  -3.983  -1.656   1.745
  279   2HD1  ILE  34          HD12      ILE  34  -5.522  -2.518   1.732
  280   3HD1  ILE  34          HD13      ILE  34  -4.996  -1.630   0.301
  281    H    ASN  35           HN       ASN  35  -4.876  -7.724   0.907
  282    HA   ASN  35           HA       ASN  35  -7.312  -8.597  -0.273
  283   1HB   ASN  35          HB2       ASN  35  -4.998  -9.638  -0.347
  284   2HB   ASN  35          HB1       ASN  35  -5.303 -10.261   1.275
  285   1HD2  ASN  35          HD21      ASN  35  -4.972 -11.832  -1.256
  286   2HD2  ASN  35          HD22      ASN  35  -6.405 -12.725  -1.431
  287    H    ASP  36           HN       ASP  36  -6.319  -8.392   3.096
  288    HA   ASP  36           HA       ASP  36  -8.448 -10.087   4.147
  289   1HB   ASP  36          HB2       ASP  36  -6.066  -9.164   5.049
  290   2HB   ASP  36          HB1       ASP  36  -7.144  -7.997   5.816
  291    H    ASN  37           HN       ASN  37  -7.862  -6.549   4.243
  292    HA   ASN  37           HA       ASN  37 -10.396  -5.827   5.356
  293   1HB   ASN  37          HB2       ASN  37  -8.491  -4.337   3.515
  294   2HB   ASN  37          HB1       ASN  37  -9.777  -3.579   4.461
  295   1HD2  ASN  37          HD21      ASN  37  -9.054  -2.754   6.419
  296   2HD2  ASN  37          HD22      ASN  37  -7.738  -3.365   7.316
  297    H    GLY  38           HN       GLY  38  -9.344  -6.353   2.012
  298   1HA   GLY  38          HA2       GLY  38 -10.772  -6.987   0.201
  299   2HA   GLY  38          HA1       GLY  38 -12.170  -6.518   1.169
  300    H    ILE  39           HN       ILE  39  -9.352  -4.456   0.727
  301    HA   ILE  39           HA       ILE  39 -11.077  -2.558  -0.832
  302    HB   ILE  39           HB       ILE  39  -8.766  -2.073   1.082
  303   1HG1  ILE  39          HG12      ILE  39 -10.812  -2.857   2.219
  304   2HG1  ILE  39          HG11      ILE  39 -10.516  -1.153   2.574
  305   1HG2  ILE  39          HG21      ILE  39  -8.804  -0.298  -0.538
  306   2HG2  ILE  39          HG22      ILE  39  -9.584   0.323   0.916
  307   3HG2  ILE  39          HG23      ILE  39 -10.562  -0.185  -0.461
  308   1HD1  ILE  39          HD11      ILE  39 -12.534  -2.312   0.634
  309   2HD1  ILE  39          HD12      ILE  39 -12.104  -0.602   0.659
  310   3HD1  ILE  39          HD13      ILE  39 -12.855  -1.343   2.072
  311    H    ASP  40           HN       ASP  40 -10.186  -3.929  -2.716
  312    HA   ASP  40           HA       ASP  40  -7.450  -2.975  -3.505
  313   1HB   ASP  40          HB2       ASP  40  -8.904  -5.566  -3.641
  314   2HB   ASP  40          HB1       ASP  40  -7.918  -5.160  -5.050
  315    H    GLY  41           HN       GLY  41  -7.837  -1.255  -4.885
  316   1HA   GLY  41          HA2       GLY  41  -9.633  -1.770  -7.208
  317   2HA   GLY  41          HA1       GLY  41  -9.814  -0.269  -6.295
  318    H    GLU  42           HN       GLU  42  -8.059   1.277  -6.352
  319    HA   GLU  42           HA       GLU  42  -6.090   0.823  -8.571
  320   1HB   GLU  42          HB2       GLU  42  -8.241   2.780  -8.210
  321   2HB   GLU  42          HB1       GLU  42  -6.686   3.554  -8.510
  322   1HG   GLU  42          HG2       GLU  42  -6.539   2.749 -10.643
  323   2HG   GLU  42          HG1       GLU  42  -7.313   1.219 -10.230
  324    H    TRP  43           HN       TRP  43  -4.052   0.972  -7.755
  325    HA   TRP  43           HA       TRP  43  -3.569   2.513  -5.248
  326   1HB   TRP  43          HB2       TRP  43  -1.961   0.519  -6.878
  327   2HB   TRP  43          HB1       TRP  43  -1.331   1.330  -5.455
  328    HD1  TRP  43           HD1      TRP  43  -4.971   0.093  -5.518
  329    HE1  TRP  43           HE1      TRP  43  -5.187  -1.854  -3.863
  330    HE3  TRP  43           HE3      TRP  43  -0.081  -0.505  -4.245
  331    HZ2  TRP  43           HZ2      TRP  43  -3.516  -3.431  -2.177
  332    HZ3  TRP  43           HZ3      TRP  43   0.580  -2.228  -2.582
  333    HH2  TRP  43           HH2      TRP  43  -1.124  -3.685  -1.552
  334    H    THR  44           HN       THR  44  -1.517   3.839  -5.234
  335    HA   THR  44           HA       THR  44  -0.571   4.807  -7.868
  336    HB   THR  44           HB       THR  44  -1.090   7.142  -7.277
  337    HG1  THR  44           HG1      THR  44  -1.081   7.058  -5.074
  338   1HG2  THR  44          HG21      THR  44  -3.419   7.071  -7.736
  339   2HG2  THR  44          HG22      THR  44  -3.612   5.522  -6.915
  340   3HG2  THR  44          HG23      THR  44  -2.766   5.602  -8.461
  341    H    TYR  45           HN       TYR  45   1.594   5.158  -7.721
  342    HA   TYR  45           HA       TYR  45   2.872   5.050  -5.044
  343   1HB   TYR  45          HB2       TYR  45   3.584   3.559  -6.885
  344   2HB   TYR  45          HB1       TYR  45   3.963   4.963  -7.881
  345    HD1  TYR  45           HD1      TYR  45   6.252   5.315  -8.059
  346    HD2  TYR  45           HD2      TYR  45   4.623   4.015  -4.304
  347    HE1  TYR  45           HE1      TYR  45   8.508   5.435  -7.039
  348    HE2  TYR  45           HE2      TYR  45   6.879   4.133  -3.284
  349    HH   TYR  45           HH       TYR  45   9.471   3.975  -4.535
  350    H    ASP  46           HN       ASP  46   4.621   6.644  -4.556
  351    HA   ASP  46           HA       ASP  46   4.434   9.218  -6.071
  352   1HB   ASP  46          HB2       ASP  46   4.307   8.926  -3.048
  353   2HB   ASP  46          HB1       ASP  46   4.188  10.428  -3.959
  354    H    ASP  47           HN       ASP  47   6.471   9.918  -6.541
  355    HA   ASP  47           HA       ASP  47   8.836   8.599  -5.510
  356   1HB   ASP  47          HB2       ASP  47   9.977  10.328  -6.892
  357   2HB   ASP  47          HB1       ASP  47   8.661   9.549  -7.768
  358    H    ALA  48           HN       ALA  48   6.871  11.051  -4.173
  359    HA   ALA  48           HA       ALA  48   8.660  12.875  -2.975
  360   1HB   ALA  48          HB1       ALA  48   5.980  11.686  -2.330
  361   2HB   ALA  48          HB2       ALA  48   6.391  13.355  -2.733
  362   3HB   ALA  48          HB3       ALA  48   6.754  12.722  -1.128
  363    H    THR  49           HN       THR  49   7.157  10.213  -1.140
  364    HA   THR  49           HA       THR  49   9.794   9.692   0.190
  365    HB   THR  49           HB       THR  49   8.361  11.115   1.598
  366    HG1  THR  49           HG1      THR  49   8.454   9.837   3.376
  367   1HG2  THR  49          HG21      THR  49   6.252   9.298   2.243
  368   2HG2  THR  49          HG22      THR  49   6.284   9.487   0.489
  369   3HG2  THR  49          HG23      THR  49   6.124  10.904   1.527
  370    H    LYS  50           HN       LYS  50   8.462   8.256  -1.993
  371    HA   LYS  50           HA       LYS  50   7.930   6.054  -2.618
  372   1HB   LYS  50          HB2       LYS  50   9.145   5.463   0.102
  373   2HB   LYS  50          HB1       LYS  50   8.992   4.328  -1.236
  374   1HG   LYS  50          HG2       LYS  50  10.317   6.694  -2.197
  375   2HG   LYS  50          HG1       LYS  50  11.122   6.159  -0.724
  376   1HD   LYS  50          HD2       LYS  50  10.734   3.775  -2.038
  377   2HD   LYS  50          HD1       LYS  50  11.020   4.881  -3.380
  378   1HE   LYS  50          HE2       LYS  50  12.832   4.835  -0.954
  379   2HE   LYS  50          HE1       LYS  50  13.116   3.798  -2.365
  380   1HZ   LYS  50          HZ1       LYS  50  13.145   5.695  -3.788
  381   2HZ   LYS  50          HZ2       LYS  50  14.220   6.008  -2.509
  382   3HZ   LYS  50          HZ3       LYS  50  12.683   6.731  -2.527
  383    H    THR  51           HN       THR  51   5.737   7.424  -1.595
  384    HA   THR  51           HA       THR  51   4.428   5.631   0.387
  385    HB   THR  51           HB       THR  51   3.608   8.245  -0.933
  386    HG1  THR  51           HG1      THR  51   4.555   7.631   1.668
  387   1HG2  THR  51          HG21      THR  51   2.004   8.230   1.117
  388   2HG2  THR  51          HG22      THR  51   2.290   6.489   1.132
  389   3HG2  THR  51          HG23      THR  51   1.574   7.253  -0.287
  390    H    TRP  52           HN       TRP  52   2.110   4.998  -0.166
  391    HA   TRP  52           HA       TRP  52   1.734   4.495  -3.096
  392   1HB   TRP  52          HB2       TRP  52   1.747   2.630  -0.729
  393   2HB   TRP  52          HB1       TRP  52   0.867   2.222  -2.198
  394    HD1  TRP  52           HD1      TRP  52   4.355   2.473  -0.785
  395    HE1  TRP  52           HE1      TRP  52   6.039   1.614  -2.544
  396    HE3  TRP  52           HE3      TRP  52   1.256   2.034  -4.768
  397    HZ2  TRP  52           HZ2      TRP  52   6.046   0.833  -5.311
  398    HZ3  TRP  52           HZ3      TRP  52   2.098   1.230  -6.966
  399    HH2  TRP  52           HH2      TRP  52   4.491   0.627  -7.238
  400    H    THR  53           HN       THR  53  -0.630   3.204  -3.081
  401    HA   THR  53           HA       THR  53  -2.555   4.431  -1.229
  402    HB   THR  53           HB       THR  53  -2.708   5.051  -4.190
  403    HG1  THR  53           HG1      THR  53  -1.687   6.620  -2.060
  404   1HG2  THR  53          HG21      THR  53  -4.105   6.986  -3.037
  405   2HG2  THR  53          HG22      THR  53  -4.239   5.805  -1.735
  406   3HG2  THR  53          HG23      THR  53  -4.832   5.410  -3.348
  407    H    VAL  54           HN       VAL  54  -4.859   3.746  -1.928
  408    HA   VAL  54           HA       VAL  54  -5.193   1.526  -3.768
  409    HB   VAL  54           HB       VAL  54  -3.915   0.330  -2.097
  410   1HG1  VAL  54          HG11      VAL  54  -5.504   1.999  -0.251
  411   2HG1  VAL  54          HG12      VAL  54  -3.848   1.416  -0.108
  412   3HG1  VAL  54          HG13      VAL  54  -5.193   0.353   0.300
  413   1HG2  VAL  54          HG21      VAL  54  -6.320  -0.553  -2.886
  414   2HG2  VAL  54          HG22      VAL  54  -6.652  -0.418  -1.160
  415   3HG2  VAL  54          HG23      VAL  54  -5.337  -1.452  -1.724
  416    H    THR  55           HN       THR  55  -6.972   2.952  -4.337
  417    HA   THR  55           HA       THR  55  -9.108   3.410  -2.334
  418    HB   THR  55           HB       THR  55  -9.062   4.112  -5.278
  419    HG1  THR  55           HG1      THR  55  -7.880   5.463  -3.083
  420   1HG2  THR  55          HG21      THR  55 -11.164   4.446  -3.980
  421   2HG2  THR  55          HG22      THR  55 -10.476   5.965  -4.555
  422   3HG2  THR  55          HG23      THR  55 -10.279   5.491  -2.868
  423    H    GLU  56           HN       GLU  56 -10.985   2.205  -2.277
  424    HA   GLU  56           HA       GLU  56 -11.210  -0.274  -3.736
  425   1HB   GLU  56          HB2       GLU  56 -12.163   0.493  -1.444
  426   2HB   GLU  56          HB1       GLU  56 -13.473   1.206  -2.387
  427   1HG   GLU  56          HG2       GLU  56 -12.639  -1.677  -2.738
  428   2HG   GLU  56          HG1       GLU  56 -13.839  -1.193  -1.539
  Start of MODEL    5
    1   1H    THR   1          HT1       THR   1  15.385   1.023   4.249
    2   2H    THR   1          HT2       THR   1  16.209   1.930   3.074
    3   3H    THR   1          HT3       THR   1  15.055   0.776   2.604
    4    HA   THR   1           HA       THR   1  14.511   3.309   4.072
    5    HB   THR   1           HB       THR   1  13.624   2.403   1.327
    6    HG1  THR   1           HG1      THR   1  15.758   2.457   1.054
    7   1HG2  THR   1          HG21      THR   1  12.363   4.263   1.841
    8   2HG2  THR   1          HG22      THR   1  13.794   5.062   1.189
    9   3HG2  THR   1          HG23      THR   1  13.583   4.917   2.934
   10    H    THR   2           HN       THR   2  12.174   3.650   4.375
   11    HA   THR   2           HA       THR   2  10.671   1.072   4.672
   12    HB   THR   2           HB       THR   2  10.147   3.676   6.112
   13    HG1  THR   2           HG1      THR   2  11.909   1.594   6.886
   14   1HG2  THR   2          HG21      THR   2   8.614   1.546   6.094
   15   2HG2  THR   2          HG22      THR   2   8.942   2.367   7.620
   16   3HG2  THR   2          HG23      THR   2   9.823   0.898   7.202
   17    H    PHE   3           HN       PHE   3   9.093   0.865   3.144
   18    HA   PHE   3           HA       PHE   3   8.083   3.165   1.630
   19   1HB   PHE   3          HB2       PHE   3   7.311   0.225   1.705
   20   2HB   PHE   3          HB1       PHE   3   6.815   1.374   0.463
   21    HD1  PHE   3           HD1      PHE   3   9.072   2.902  -0.264
   22    HD2  PHE   3           HD2      PHE   3   8.975  -1.222   0.939
   23    HE1  PHE   3           HE1      PHE   3  11.192   2.496  -1.483
   24    HE2  PHE   3           HE2      PHE   3  11.095  -1.626  -0.282
   25    HZ   PHE   3           HZ       PHE   3  12.203   0.233  -1.492
   26    H    LYS   4           HN       LYS   4   5.620   3.432   1.428
   27    HA   LYS   4           HA       LYS   4   4.150   2.757   3.939
   28   1HB   LYS   4          HB2       LYS   4   5.309   4.991   4.104
   29   2HB   LYS   4          HB1       LYS   4   4.346   5.533   2.742
   30   1HG   LYS   4          HG2       LYS   4   2.278   5.068   3.990
   31   2HG   LYS   4          HG1       LYS   4   3.229   4.518   5.367
   32   1HD   LYS   4          HD2       LYS   4   3.723   6.632   6.029
   33   2HD   LYS   4          HD1       LYS   4   4.006   7.182   4.378
   34   1HE   LYS   4          HE2       LYS   4   1.814   7.847   4.081
   35   2HE   LYS   4          HE1       LYS   4   1.177   6.570   5.138
   36   1HZ   LYS   4          HZ1       LYS   4   2.767   8.909   6.057
   37   2HZ   LYS   4          HZ2       LYS   4   2.091   7.704   7.045
   38   3HZ   LYS   4          HZ3       LYS   4   1.082   8.774   6.194
   39    H    LEU   5           HN       LEU   5   1.877   2.732   3.675
   40    HA   LEU   5           HA       LEU   5   0.737   3.408   1.014
   41   1HB   LEU   5          HB2       LEU   5   1.597   0.901   1.426
   42   2HB   LEU   5          HB1       LEU   5   0.040   0.763   2.232
   43    HG   LEU   5           HG       LEU   5  -0.257   2.158  -0.303
   44   1HD1  LEU   5          HD11      LEU   5   0.593  -0.709  -0.646
   45   2HD1  LEU   5          HD12      LEU   5   1.796   0.585  -0.685
   46   3HD1  LEU   5          HD13      LEU   5   0.476   0.574  -1.861
   47   1HD2  LEU   5          HD21      LEU   5  -1.950   0.388  -0.653
   48   2HD2  LEU   5          HD22      LEU   5  -2.083   1.086   0.961
   49   3HD2  LEU   5          HD23      LEU   5  -1.319  -0.488   0.741
   50    H    ILE   6           HN       ILE   6  -1.447   4.011   1.184
   51    HA   ILE   6           HA       ILE   6  -2.568   4.064   3.964
   52    HB   ILE   6           HB       ILE   6  -2.890   5.871   1.549
   53   1HG1  ILE   6          HG12      ILE   6  -0.740   6.037   2.780
   54   2HG1  ILE   6          HG11      ILE   6  -1.703   7.504   2.949
   55   1HG2  ILE   6          HG21      ILE   6  -4.996   5.691   2.892
   56   2HG2  ILE   6          HG22      ILE   6  -4.282   7.302   2.948
   57   3HG2  ILE   6          HG23      ILE   6  -4.091   6.205   4.316
   58   1HD1  ILE   6          HD11      ILE   6  -0.699   5.786   5.012
   59   2HD1  ILE   6          HD12      ILE   6  -2.461   5.733   5.055
   60   3HD1  ILE   6          HD13      ILE   6  -1.621   7.278   5.187
   61    H    ILE   7           HN       ILE   7  -4.426   2.917   4.282
   62    HA   ILE   7           HA       ILE   7  -5.688   1.474   2.066
   63    HB   ILE   7           HB       ILE   7  -6.370   1.734   5.017
   64   1HG1  ILE   7          HG12      ILE   7  -4.837  -0.449   3.571
   65   2HG1  ILE   7          HG11      ILE   7  -4.070   0.849   4.487
   66   1HG2  ILE   7          HG21      ILE   7  -8.278   0.869   3.824
   67   2HG2  ILE   7          HG22      ILE   7  -7.479  -0.505   4.588
   68   3HG2  ILE   7          HG23      ILE   7  -7.260  -0.205   2.864
   69   1HD1  ILE   7          HD11      ILE   7  -4.212  -0.745   6.152
   70   2HD1  ILE   7          HD12      ILE   7  -5.663  -1.479   5.469
   71   3HD1  ILE   7          HD13      ILE   7  -5.779   0.035   6.367
   72    H    ASN   8           HN       ASN   8  -7.162   2.510   0.786
   73    HA   ASN   8           HA       ASN   8  -8.899   4.622   2.009
   74   1HB   ASN   8          HB2       ASN   8  -7.801   4.079  -0.753
   75   2HB   ASN   8          HB1       ASN   8  -9.155   5.183  -0.515
   76   1HD2  ASN   8          HD21      ASN   8  -7.750   7.002  -1.201
   77   2HD2  ASN   8          HD22      ASN   8  -6.585   7.635  -0.129
   78    H    GLY   9           HN       GLY   9  -9.709   2.068   2.562
   79   1HA   GLY   9          HA2       GLY   9 -11.543   1.075   0.502
   80   2HA   GLY   9          HA1       GLY   9 -11.354   0.414   2.131
   81    H    LYS  10           HN       LYS  10 -13.808   1.247   0.567
   82    HA   LYS  10           HA       LYS  10 -14.997   3.609   1.514
   83   1HB   LYS  10          HB2       LYS  10 -16.152   0.876   0.895
   84   2HB   LYS  10          HB1       LYS  10 -17.130   2.332   1.087
   85   1HG   LYS  10          HG2       LYS  10 -15.923   3.411  -0.759
   86   2HG   LYS  10          HG1       LYS  10 -14.898   1.986  -0.938
   87   1HD   LYS  10          HD2       LYS  10 -16.557   0.745  -1.928
   88   2HD   LYS  10          HD1       LYS  10 -17.840   1.535  -1.010
   89   1HE   LYS  10          HE2       LYS  10 -16.391   3.305  -2.899
   90   2HE   LYS  10          HE1       LYS  10 -17.384   2.039  -3.648
   91   1HZ   LYS  10          HZ1       LYS  10 -18.666   4.065  -3.106
   92   2HZ   LYS  10          HZ2       LYS  10 -18.309   3.827  -1.462
   93   3HZ   LYS  10          HZ3       LYS  10 -19.244   2.687  -2.305
   94    H    THR  11           HN       THR  11 -14.625   0.486   3.125
   95    HA   THR  11           HA       THR  11 -15.978   1.614   5.555
   96    HB   THR  11           HB       THR  11 -15.551  -1.294   4.831
   97    HG1  THR  11           HG1      THR  11 -17.726   0.427   4.242
   98   1HG2  THR  11          HG21      THR  11 -16.157  -1.161   7.090
   99   2HG2  THR  11          HG22      THR  11 -17.714  -1.368   6.289
  100   3HG2  THR  11          HG23      THR  11 -17.204   0.233   6.825
  101    H    LEU  12           HN       LEU  12 -13.080   0.076   4.288
  102    HA   LEU  12           HA       LEU  12 -11.906  -0.009   7.044
  103   1HB   LEU  12          HB2       LEU  12 -11.203  -1.410   4.445
  104   2HB   LEU  12          HB1       LEU  12 -10.315  -1.609   5.956
  105    HG   LEU  12           HG       LEU  12 -13.270  -1.997   6.052
  106   1HD1  LEU  12          HD11      LEU  12 -12.669  -4.492   5.456
  107   2HD1  LEU  12          HD12      LEU  12 -11.337  -3.752   4.568
  108   3HD1  LEU  12          HD13      LEU  12 -13.004  -3.340   4.164
  109   1HD2  LEU  12          HD21      LEU  12 -12.345  -3.946   7.515
  110   2HD2  LEU  12          HD22      LEU  12 -12.179  -2.297   8.119
  111   3HD2  LEU  12          HD23      LEU  12 -10.799  -3.108   7.377
  112    H    LYS  13           HN       LYS  13  -9.846   0.949   7.378
  113    HA   LYS  13           HA       LYS  13  -8.442   2.324   5.186
  114   1HB   LYS  13          HB2       LYS  13 -10.215   3.662   7.199
  115   2HB   LYS  13          HB1       LYS  13  -8.748   4.500   6.694
  116   1HG   LYS  13          HG2       LYS  13  -9.680   3.712   4.276
  117   2HG   LYS  13          HG1       LYS  13 -11.205   3.887   5.144
  118   1HD   LYS  13          HD2       LYS  13 -10.301   6.173   5.916
  119   2HD   LYS  13          HD1       LYS  13  -9.087   5.980   4.650
  120   1HE   LYS  13          HE2       LYS  13 -11.282   5.389   3.201
  121   2HE   LYS  13          HE1       LYS  13 -12.014   6.479   4.395
  122   1HZ   LYS  13          HZ1       LYS  13 -10.188   8.048   3.978
  123   2HZ   LYS  13          HZ2       LYS  13 -11.117   7.770   2.583
  124   3HZ   LYS  13          HZ3       LYS  13  -9.597   7.031   2.756
  125    H    GLY  14           HN       GLY  14  -6.707   3.884   6.472
  126   1HA   GLY  14          HA2       GLY  14  -5.572   3.827   8.803
  127   2HA   GLY  14          HA1       GLY  14  -5.464   2.092   8.508
  128    H    GLU  15           HN       GLU  15  -3.087   3.108   8.905
  129    HA   GLU  15           HA       GLU  15  -1.910   3.676   6.199
  130   1HB   GLU  15          HB2       GLU  15  -0.936   4.406   8.984
  131   2HB   GLU  15          HB1       GLU  15  -0.162   4.875   7.471
  132   1HG   GLU  15          HG2       GLU  15  -2.702   5.755   7.023
  133   2HG   GLU  15          HG1       GLU  15  -2.592   5.966   8.769
  134    H    THR  16           HN       THR  16   0.306   2.733   5.897
  135    HA   THR  16           HA       THR  16   1.196   0.628   7.743
  136    HB   THR  16           HB       THR  16  -0.698  -0.440   6.599
  137    HG1  THR  16           HG1      THR  16   0.415  -2.223   5.933
  138   1HG2  THR  16          HG21      THR  16  -0.887   0.780   4.565
  139   2HG2  THR  16          HG22      THR  16  -0.416  -0.849   4.085
  140   3HG2  THR  16          HG23      THR  16   0.786   0.442   4.115
  141    H    THR  17           HN       THR  17   3.320  -0.065   7.270
  142    HA   THR  17           HA       THR  17   4.614   1.014   4.797
  143    HB   THR  17           HB       THR  17   6.533   1.663   6.347
  144    HG1  THR  17           HG1      THR  17   6.154   1.676   8.484
  145   1HG2  THR  17          HG21      THR  17   5.195   3.436   5.496
  146   2HG2  THR  17          HG22      THR  17   5.275   3.707   7.236
  147   3HG2  THR  17          HG23      THR  17   3.829   2.997   6.520
  148    H    THR  18           HN       THR  18   6.621  -0.151   4.270
  149    HA   THR  18           HA       THR  18   7.100  -2.652   5.796
  150    HB   THR  18           HB       THR  18   5.763  -2.315   3.202
  151    HG1  THR  18           HG1      THR  18   5.163  -3.618   5.042
  152   1HG2  THR  18          HG21      THR  18   8.018  -2.774   2.302
  153   2HG2  THR  18          HG22      THR  18   6.900  -4.103   1.984
  154   3HG2  THR  18          HG23      THR  18   8.102  -4.248   3.268
  155    H    GLU  19           HN       GLU  19   9.197  -3.683   4.998
  156    HA   GLU  19           HA       GLU  19  11.127  -1.606   4.012
  157   1HB   GLU  19          HB2       GLU  19  11.258  -2.122   6.453
  158   2HB   GLU  19          HB1       GLU  19  11.539  -3.817   6.054
  159   1HG   GLU  19          HG2       GLU  19  13.445  -2.687   4.514
  160   2HG   GLU  19          HG1       GLU  19  13.367  -1.484   5.802
  161    H    ALA  20           HN       ALA  20  11.821  -2.255   2.006
  162    HA   ALA  20           HA       ALA  20  12.703  -5.061   1.616
  163   1HB   ALA  20          HB1       ALA  20  10.481  -5.343   0.937
  164   2HB   ALA  20          HB2       ALA  20  11.262  -4.920  -0.587
  165   3HB   ALA  20          HB3       ALA  20  10.363  -3.697   0.313
  166    H    VAL  21           HN       VAL  21  13.519  -5.217  -0.807
  167    HA   VAL  21           HA       VAL  21  15.682  -3.418  -1.181
  168    HB   VAL  21           HB       VAL  21  15.817  -4.505  -3.411
  169   1HG1  VAL  21          HG11      VAL  21  15.354  -6.014  -0.889
  170   2HG1  VAL  21          HG12      VAL  21  16.783  -5.954  -1.920
  171   3HG1  VAL  21          HG13      VAL  21  15.407  -6.958  -2.378
  172   1HG2  VAL  21          HG21      VAL  21  13.964  -6.317  -3.769
  173   2HG2  VAL  21          HG22      VAL  21  13.610  -4.648  -4.214
  174   3HG2  VAL  21          HG23      VAL  21  12.995  -5.305  -2.699
  175    H    ASP  22           HN       ASP  22  12.427  -3.409  -2.628
  176    HA   ASP  22           HA       ASP  22  12.734  -0.530  -3.278
  177   1HB   ASP  22          HB2       ASP  22  12.082  -2.706  -5.299
  178   2HB   ASP  22          HB1       ASP  22  12.059  -0.974  -5.631
  179    H    ALA  23           HN       ALA  23  10.608   0.441  -3.796
  180    HA   ALA  23           HA       ALA  23   8.473  -0.483  -2.134
  181   1HB   ALA  23          HB1       ALA  23   7.242   1.173  -3.874
  182   2HB   ALA  23          HB2       ALA  23   8.918   1.559  -4.265
  183   3HB   ALA  23          HB3       ALA  23   8.325   1.771  -2.617
  184    H    ALA  24           HN       ALA  24   9.302  -1.175  -5.480
  185    HA   ALA  24           HA       ALA  24   6.796  -2.191  -6.408
  186   1HB   ALA  24          HB1       ALA  24   8.195  -3.287  -8.095
  187   2HB   ALA  24          HB2       ALA  24   9.616  -3.113  -7.065
  188   3HB   ALA  24          HB3       ALA  24   8.850  -1.684  -7.759
  189    H    THR  25           HN       THR  25   9.532  -3.810  -4.786
  190    HA   THR  25           HA       THR  25   8.333  -6.436  -4.714
  191    HB   THR  25           HB       THR  25  10.529  -5.032  -3.154
  192    HG1  THR  25           HG1      THR  25  11.469  -5.472  -4.964
  193   1HG2  THR  25          HG21      THR  25   9.846  -7.989  -3.125
  194   2HG2  THR  25          HG22      THR  25   9.561  -6.874  -1.785
  195   3HG2  THR  25          HG23      THR  25  11.211  -7.226  -2.308
  196    H    ALA  26           HN       ALA  26   8.622  -3.843  -2.246
  197    HA   ALA  26           HA       ALA  26   7.207  -5.161  -0.166
  198   1HB   ALA  26          HB1       ALA  26   6.754  -2.709   0.534
  199   2HB   ALA  26          HB2       ALA  26   7.622  -2.264  -0.940
  200   3HB   ALA  26          HB3       ALA  26   8.443  -3.181   0.322
  201    H    GLU  27           HN       GLU  27   5.964  -2.684  -2.433
  202    HA   GLU  27           HA       GLU  27   3.293  -2.567  -1.808
  203   1HB   GLU  27          HB2       GLU  27   4.502  -1.342  -3.607
  204   2HB   GLU  27          HB1       GLU  27   4.473  -2.802  -4.596
  205   1HG   GLU  27          HG2       GLU  27   1.880  -2.709  -4.139
  206   2HG   GLU  27          HG1       GLU  27   2.201  -1.007  -3.807
  207    H    LYS  28           HN       LYS  28   4.835  -5.261  -3.561
  208    HA   LYS  28           HA       LYS  28   2.415  -6.625  -4.340
  209   1HB   LYS  28          HB2       LYS  28   5.184  -7.671  -3.622
  210   2HB   LYS  28          HB1       LYS  28   3.965  -8.567  -4.528
  211   1HG   LYS  28          HG2       LYS  28   4.188  -7.228  -6.418
  212   2HG   LYS  28          HG1       LYS  28   4.795  -5.852  -5.497
  213   1HD   LYS  28          HD2       LYS  28   6.798  -6.553  -6.379
  214   2HD   LYS  28          HD1       LYS  28   6.762  -7.613  -4.969
  215   1HE   LYS  28          HE2       LYS  28   5.780  -9.420  -6.316
  216   2HE   LYS  28          HE1       LYS  28   5.746  -8.357  -7.737
  217   1HZ   LYS  28          HZ1       LYS  28   7.767  -9.765  -7.621
  218   2HZ   LYS  28          HZ2       LYS  28   8.195  -8.982  -6.176
  219   3HZ   LYS  28          HZ3       LYS  28   8.108  -8.104  -7.628
  220    H    VAL  29           HN       VAL  29   4.525  -6.845  -1.482
  221    HA   VAL  29           HA       VAL  29   2.953  -8.831  -0.069
  222    HB   VAL  29           HB       VAL  29   5.073  -6.770   0.612
  223   1HG1  VAL  29          HG11      VAL  29   5.197  -7.672   2.898
  224   2HG1  VAL  29          HG12      VAL  29   3.811  -8.715   2.576
  225   3HG1  VAL  29          HG13      VAL  29   3.606  -6.960   2.608
  226   1HG2  VAL  29          HG21      VAL  29   4.916  -9.754   0.288
  227   2HG2  VAL  29          HG22      VAL  29   6.201  -9.044   1.266
  228   3HG2  VAL  29          HG23      VAL  29   6.050  -8.615  -0.438
  229    H    LEU  30           HN       LEU  30   2.965  -5.270  -0.206
  230    HA   LEU  30           HA       LEU  30   1.109  -4.847   1.936
  231   1HB   LEU  30          HB2       LEU  30   1.994  -3.317  -0.517
  232   2HB   LEU  30          HB1       LEU  30   0.776  -2.650   0.558
  233    HG   LEU  30           HG       LEU  30   3.311  -2.033   0.898
  234   1HD1  LEU  30          HD11      LEU  30   1.643  -1.220   2.402
  235   2HD1  LEU  30          HD12      LEU  30   2.941  -1.914   3.381
  236   3HD1  LEU  30          HD13      LEU  30   1.440  -2.814   3.133
  237   1HD2  LEU  30          HD21      LEU  30   4.314  -3.503   2.699
  238   2HD2  LEU  30          HD22      LEU  30   4.355  -4.149   1.073
  239   3HD2  LEU  30          HD23      LEU  30   3.169  -4.743   2.231
  240    H    LYS  31           HN       LYS  31   0.754  -5.637  -1.475
  241    HA   LYS  31           HA       LYS  31  -2.075  -5.155  -1.775
  242   1HB   LYS  31          HB2       LYS  31  -0.091  -5.838  -3.440
  243   2HB   LYS  31          HB1       LYS  31  -0.623  -7.457  -3.054
  244   1HG   LYS  31          HG2       LYS  31  -2.581  -5.334  -3.932
  245   2HG   LYS  31          HG1       LYS  31  -1.713  -6.325  -5.102
  246   1HD   LYS  31          HD2       LYS  31  -3.511  -7.356  -2.883
  247   2HD   LYS  31          HD1       LYS  31  -3.900  -7.329  -4.602
  248   1HE   LYS  31          HE2       LYS  31  -1.395  -8.629  -4.422
  249   2HE   LYS  31          HE1       LYS  31  -2.396  -9.320  -3.124
  250   1HZ   LYS  31          HZ1       LYS  31  -4.166  -9.707  -4.676
  251   2HZ   LYS  31          HZ2       LYS  31  -2.754 -10.406  -5.312
  252   3HZ   LYS  31          HZ3       LYS  31  -3.323  -8.927  -5.924
  253    H    GLN  32           HN       GLN  32  -0.144  -7.974  -0.826
  254    HA   GLN  32           HA       GLN  32  -2.191  -9.888  -0.419
  255   1HB   GLN  32          HB2       GLN  32   0.565  -9.351   0.537
  256   2HB   GLN  32          HB1       GLN  32  -0.387 -10.493   1.486
  257   1HG   GLN  32          HG2       GLN  32  -0.270 -10.735  -1.509
  258   2HG   GLN  32          HG1       GLN  32   1.014 -11.413  -0.507
  259   1HE2  GLN  32          HE21      GLN  32   0.553 -13.646  -0.575
  260   2HE2  GLN  32          HE22      GLN  32  -0.946 -14.321  -0.119
  261    H    TYR  33           HN       TYR  33  -0.930  -7.358   1.734
  262    HA   TYR  33           HA       TYR  33  -2.491  -8.008   4.075
  263   1HB   TYR  33          HB2       TYR  33  -0.520  -6.544   4.086
  264   2HB   TYR  33          HB1       TYR  33  -1.328  -5.406   3.008
  265    HD1  TYR  33           HD1      TYR  33  -1.430  -6.944   6.372
  266    HD2  TYR  33           HD2      TYR  33  -2.881  -3.798   3.839
  267    HE1  TYR  33           HE1      TYR  33  -2.463  -5.854   8.330
  268    HE2  TYR  33           HE2      TYR  33  -3.912  -2.696   5.804
  269    HH   TYR  33           HH       TYR  33  -3.150  -3.083   8.745
  270    H    ILE  34           HN       ILE  34  -3.033  -5.908   1.267
  271    HA   ILE  34           HA       ILE  34  -5.572  -4.815   2.076
  272    HB   ILE  34           HB       ILE  34  -4.320  -5.337  -0.638
  273   1HG1  ILE  34          HG12      ILE  34  -3.086  -3.919   1.156
  274   2HG1  ILE  34          HG11      ILE  34  -3.264  -3.236  -0.455
  275   1HG2  ILE  34          HG21      ILE  34  -5.802  -3.497  -1.432
  276   2HG2  ILE  34          HG22      ILE  34  -6.597  -3.496   0.141
  277   3HG2  ILE  34          HG23      ILE  34  -6.703  -4.916  -0.898
  278   1HD1  ILE  34          HD11      ILE  34  -3.878  -1.873   1.786
  279   2HD1  ILE  34          HD12      ILE  34  -5.436  -2.651   1.497
  280   3HD1  ILE  34          HD13      ILE  34  -4.723  -1.616   0.259
  281    H    ASN  35           HN       ASN  35  -4.606  -7.886   0.695
  282    HA   ASN  35           HA       ASN  35  -6.979  -8.773  -0.557
  283   1HB   ASN  35          HB2       ASN  35  -4.663  -9.829  -0.436
  284   2HB   ASN  35          HB1       ASN  35  -5.118 -10.437   1.156
  285   1HD2  ASN  35          HD21      ASN  35  -5.621 -12.624   0.886
  286   2HD2  ASN  35          HD22      ASN  35  -6.619 -13.243  -0.339
  287    H    ASP  36           HN       ASP  36  -5.982  -9.357   2.845
  288    HA   ASP  36           HA       ASP  36  -8.427 -10.594   3.666
  289   1HB   ASP  36          HB2       ASP  36  -7.550 -10.084   5.945
  290   2HB   ASP  36          HB1       ASP  36  -6.309 -10.758   4.890
  291    H    ASN  37           HN       ASN  37  -7.553  -7.220   3.261
  292    HA   ASN  37           HA       ASN  37  -9.804  -6.193   4.846
  293   1HB   ASN  37          HB2       ASN  37  -7.876  -4.901   2.884
  294   2HB   ASN  37          HB1       ASN  37  -8.964  -4.025   3.965
  295   1HD2  ASN  37          HD21      ASN  37  -8.709  -4.881   6.409
  296   2HD2  ASN  37          HD22      ASN  37  -7.094  -5.041   6.936
  297    H    GLY  38           HN       GLY  38  -9.113  -6.956   1.480
  298   1HA   GLY  38          HA2       GLY  38 -10.618  -7.203  -0.319
  299   2HA   GLY  38          HA1       GLY  38 -11.937  -6.817   0.787
  300    H    ILE  39           HN       ILE  39  -9.127  -4.745   0.385
  301    HA   ILE  39           HA       ILE  39 -10.915  -2.685  -0.869
  302    HB   ILE  39           HB       ILE  39  -8.468  -2.387   0.908
  303   1HG1  ILE  39          HG12      ILE  39 -10.380  -3.313   2.149
  304   2HG1  ILE  39          HG11      ILE  39 -10.101  -1.635   2.624
  305   1HG2  ILE  39          HG21      ILE  39  -9.395  -0.001   1.069
  306   2HG2  ILE  39          HG22      ILE  39 -10.379  -0.406  -0.338
  307   3HG2  ILE  39          HG23      ILE  39  -8.619  -0.443  -0.451
  308   1HD1  ILE  39          HD11      ILE  39 -12.286  -2.742   0.858
  309   2HD1  ILE  39          HD12      ILE  39 -11.852  -1.034   0.814
  310   3HD1  ILE  39          HD13      ILE  39 -12.443  -1.755   2.310
  311    H    ASP  40           HN       ASP  40 -10.087  -3.999  -2.888
  312    HA   ASP  40           HA       ASP  40  -7.418  -2.938  -3.755
  313   1HB   ASP  40          HB2       ASP  40  -7.448  -4.907  -5.288
  314   2HB   ASP  40          HB1       ASP  40  -7.586  -5.386  -3.594
  315    H    GLY  41           HN       GLY  41  -7.691  -1.196  -5.093
  316   1HA   GLY  41          HA2       GLY  41  -9.654  -1.407  -7.305
  317   2HA   GLY  41          HA1       GLY  41  -9.797  -0.013  -6.229
  318    H    GLU  42           HN       GLU  42  -8.028   1.524  -6.175
  319    HA   GLU  42           HA       GLU  42  -6.107   1.301  -8.466
  320   1HB   GLU  42          HB2       GLU  42  -8.305   3.178  -7.946
  321   2HB   GLU  42          HB1       GLU  42  -6.772   3.998  -8.241
  322   1HG   GLU  42          HG2       GLU  42  -6.646   3.287 -10.415
  323   2HG   GLU  42          HG1       GLU  42  -7.433   1.747 -10.067
  324    H    TRP  43           HN       TRP  43  -4.069   1.449  -7.643
  325    HA   TRP  43           HA       TRP  43  -3.618   2.841  -5.046
  326   1HB   TRP  43          HB2       TRP  43  -1.958   1.007  -6.806
  327   2HB   TRP  43          HB1       TRP  43  -1.348   1.740  -5.334
  328    HD1  TRP  43           HD1      TRP  43  -4.950   0.404  -5.476
  329    HE1  TRP  43           HE1      TRP  43  -5.107  -1.652  -3.953
  330    HE3  TRP  43           HE3      TRP  43  -0.043  -0.136  -4.246
  331    HZ2  TRP  43           HZ2      TRP  43  -3.392  -3.288  -2.375
  332    HZ3  TRP  43           HZ3      TRP  43   0.670  -1.946  -2.701
  333    HH2  TRP  43           HH2      TRP  43  -0.993  -3.515  -1.768
  334    H    THR  44           HN       THR  44  -1.624   4.239  -4.945
  335    HA   THR  44           HA       THR  44  -0.694   5.395  -7.506
  336    HB   THR  44           HB       THR  44  -1.319   7.677  -6.771
  337    HG1  THR  44           HG1      THR  44  -2.805   7.781  -4.985
  338   1HG2  THR  44          HG21      THR  44  -3.626   7.534  -7.329
  339   2HG2  THR  44          HG22      THR  44  -3.768   5.914  -6.647
  340   3HG2  THR  44          HG23      THR  44  -2.866   6.165  -8.142
  341    H    TYR  45           HN       TYR  45   1.450   5.853  -7.306
  342    HA   TYR  45           HA       TYR  45   2.742   5.547  -4.673
  343   1HB   TYR  45          HB2       TYR  45   3.613   4.457  -6.701
  344   2HB   TYR  45          HB1       TYR  45   3.780   6.024  -7.492
  345    HD1  TYR  45           HD1      TYR  45   4.719   4.528  -4.170
  346    HD2  TYR  45           HD2      TYR  45   5.948   6.842  -7.572
  347    HE1  TYR  45           HE1      TYR  45   6.973   4.796  -3.172
  348    HE2  TYR  45           HE2      TYR  45   8.202   7.113  -6.574
  349    HH   TYR  45           HH       TYR  45   9.180   7.061  -4.204
  350    H    ASP  46           HN       ASP  46   4.372   7.209  -3.970
  351    HA   ASP  46           HA       ASP  46   3.828   9.973  -4.980
  352   1HB   ASP  46          HB2       ASP  46   3.918   9.123  -2.062
  353   2HB   ASP  46          HB1       ASP  46   3.596  10.745  -2.667
  354    H    ASP  47           HN       ASP  47   5.731  11.043  -5.321
  355    HA   ASP  47           HA       ASP  47   8.289   9.807  -4.698
  356   1HB   ASP  47          HB2       ASP  47   7.764  11.182  -6.710
  357   2HB   ASP  47          HB1       ASP  47   7.591  12.597  -5.670
  358    H    ALA  48           HN       ALA  48   6.172  11.638  -2.775
  359    HA   ALA  48           HA       ALA  48   7.829  13.441  -1.356
  360   1HB   ALA  48          HB1       ALA  48   5.559  13.586  -0.872
  361   2HB   ALA  48          HB2       ALA  48   6.105  12.667   0.531
  362   3HB   ALA  48          HB3       ALA  48   5.354  11.832  -0.831
  363    H    THR  49           HN       THR  49   6.790  10.311   0.001
  364    HA   THR  49           HA       THR  49   9.577   9.854   1.009
  365    HB   THR  49           HB       THR  49   8.138  10.881   2.747
  366    HG1  THR  49           HG1      THR  49   8.765   9.485   4.231
  367   1HG2  THR  49          HG21      THR  49   6.161   9.563   3.561
  368   2HG2  THR  49          HG22      THR  49   6.351   8.506   2.160
  369   3HG2  THR  49          HG23      THR  49   5.952  10.209   1.932
  370    H    LYS  50           HN       LYS  50   8.267   8.666  -1.286
  371    HA   LYS  50           HA       LYS  50   7.840   6.561  -2.236
  372   1HB   LYS  50          HB2       LYS  50   9.265   5.696   0.301
  373   2HB   LYS  50          HB1       LYS  50   9.040   4.695  -1.132
  374   1HG   LYS  50          HG2       LYS  50  10.358   6.237  -2.476
  375   2HG   LYS  50          HG1       LYS  50  10.495   7.354  -1.119
  376   1HD   LYS  50          HD2       LYS  50  12.170   6.164  -0.159
  377   2HD   LYS  50          HD1       LYS  50  11.364   4.624  -0.454
  378   1HE   LYS  50          HE2       LYS  50  12.984   4.272  -2.018
  379   2HE   LYS  50          HE1       LYS  50  12.112   5.455  -3.012
  380   1HZ   LYS  50          HZ1       LYS  50  13.343   7.225  -1.877
  381   2HZ   LYS  50          HZ2       LYS  50  14.388   6.170  -2.702
  382   3HZ   LYS  50          HZ3       LYS  50  14.228   6.064  -1.014
  383    H    THR  51           HN       THR  51   5.626   7.591  -0.997
  384    HA   THR  51           HA       THR  51   4.500   5.536   0.826
  385    HB   THR  51           HB       THR  51   2.940   7.851  -0.269
  386    HG1  THR  51           HG1      THR  51   4.021   9.237   1.178
  387   1HG2  THR  51          HG21      THR  51   2.640   6.027   1.824
  388   2HG2  THR  51          HG22      THR  51   1.706   7.503   1.582
  389   3HG2  THR  51          HG23      THR  51   3.132   7.524   2.618
  390    H    TRP  52           HN       TRP  52   1.880   5.424   0.092
  391    HA   TRP  52           HA       TRP  52   1.638   4.848  -2.799
  392   1HB   TRP  52          HB2       TRP  52   1.746   2.809  -0.585
  393   2HB   TRP  52          HB1       TRP  52   0.841   2.488  -2.058
  394    HD1  TRP  52           HD1      TRP  52   4.350   2.721  -0.706
  395    HE1  TRP  52           HE1      TRP  52   6.016   2.050  -2.564
  396    HE3  TRP  52           HE3      TRP  52   1.175   2.518  -4.653
  397    HZ2  TRP  52           HZ2      TRP  52   5.981   1.494  -5.383
  398    HZ3  TRP  52           HZ3      TRP  52   1.990   1.916  -6.923
  399    HH2  TRP  52           HH2      TRP  52   4.391   1.402  -7.289
  400    H    THR  53           HN       THR  53  -0.680   3.488  -2.879
  401    HA   THR  53           HA       THR  53  -2.625   4.511  -0.924
  402    HB   THR  53           HB       THR  53  -2.881   5.314  -3.830
  403    HG1  THR  53           HG1      THR  53  -2.132   7.374  -3.067
  404   1HG2  THR  53          HG21      THR  53  -4.236   7.165  -2.509
  405   2HG2  THR  53          HG22      THR  53  -4.292   5.919  -1.262
  406   3HG2  THR  53          HG23      THR  53  -4.965   5.598  -2.861
  407    H    VAL  54           HN       VAL  54  -4.915   3.821  -1.673
  408    HA   VAL  54           HA       VAL  54  -5.207   1.706  -3.635
  409    HB   VAL  54           HB       VAL  54  -3.879   0.449  -2.042
  410   1HG1  VAL  54          HG11      VAL  54  -3.829   1.349   0.029
  411   2HG1  VAL  54          HG12      VAL  54  -5.216   0.311   0.351
  412   3HG1  VAL  54          HG13      VAL  54  -5.461   1.995  -0.106
  413   1HG2  VAL  54          HG21      VAL  54  -6.588  -0.441  -1.149
  414   2HG2  VAL  54          HG22      VAL  54  -5.245  -1.395  -1.787
  415   3HG2  VAL  54          HG23      VAL  54  -6.262  -0.450  -2.883
  416    H    THR  55           HN       THR  55  -7.032   3.103  -4.105
  417    HA   THR  55           HA       THR  55  -9.150   3.389  -2.051
  418    HB   THR  55           HB       THR  55  -9.198   4.277  -4.941
  419    HG1  THR  55           HG1      THR  55  -8.060   6.083  -4.311
  420   1HG2  THR  55          HG21      THR  55 -11.263   4.631  -3.761
  421   2HG2  THR  55          HG22      THR  55 -10.452   6.194  -3.864
  422   3HG2  THR  55          HG23      THR  55 -10.414   5.279  -2.357
  423    H    GLU  56           HN       GLU  56 -10.847   1.974  -1.955
  424    HA   GLU  56           HA       GLU  56 -11.084  -0.350  -3.595
  425   1HB   GLU  56          HB2       GLU  56 -12.028   0.254  -1.251
  426   2HB   GLU  56          HB1       GLU  56 -13.370   0.981  -2.136
  427   1HG   GLU  56          HG2       GLU  56 -12.571  -1.762  -2.965
  428   2HG   GLU  56          HG1       GLU  56 -13.357  -1.613  -1.393
  Start of MODEL    6
    1   1H    THR   1          HT1       THR   1  14.988   3.585   4.499
    2   2H    THR   1          HT2       THR   1  14.172   4.993   4.986
    3   3H    THR   1          HT3       THR   1  15.604   5.109   4.080
    4    HA   THR   1           HA       THR   1  13.533   5.510   2.763
    5    HB   THR   1           HB       THR   1  15.709   4.891   1.803
    6    HG1  THR   1           HG1      THR   1  14.538   4.799   0.081
    7   1HG2  THR   1          HG21      THR   1  16.567   2.939   2.582
    8   2HG2  THR   1          HG22      THR   1  15.632   2.193   1.286
    9   3HG2  THR   1          HG23      THR   1  14.973   2.265   2.920
   10    H    THR   2           HN       THR   2  11.884   4.556   4.478
   11    HA   THR   2           HA       THR   2  11.049   1.775   3.890
   12    HB   THR   2           HB       THR   2   9.765   3.833   5.703
   13    HG1  THR   2           HG1      THR   2  11.267   3.415   7.170
   14   1HG2  THR   2          HG21      THR   2   9.966   0.820   5.929
   15   2HG2  THR   2          HG22      THR   2   8.588   1.661   5.219
   16   3HG2  THR   2          HG23      THR   2   8.984   1.898   6.921
   17    H    PHE   3           HN       PHE   3   9.231   1.273   2.681
   18    HA   PHE   3           HA       PHE   3   8.044   3.345   0.994
   19   1HB   PHE   3          HB2       PHE   3   7.450   0.395   1.414
   20   2HB   PHE   3          HB1       PHE   3   6.803   1.374   0.097
   21    HD1  PHE   3           HD1      PHE   3   8.896   2.956  -0.929
   22    HD2  PHE   3           HD2      PHE   3   9.166  -1.013   0.698
   23    HE1  PHE   3           HE1      PHE   3  10.963   2.558  -2.240
   24    HE2  PHE   3           HE2      PHE   3  11.232  -1.409  -0.614
   25    HZ   PHE   3           HZ       PHE   3  12.130   0.376  -2.082
   26    H    LYS   4           HN       LYS   4   5.603   3.552   0.858
   27    HA   LYS   4           HA       LYS   4   4.205   3.052   3.452
   28   1HB   LYS   4          HB2       LYS   4   5.268   5.340   3.364
   29   2HB   LYS   4          HB1       LYS   4   4.250   5.700   1.981
   30   1HG   LYS   4          HG2       LYS   4   2.235   5.331   3.299
   31   2HG   LYS   4          HG1       LYS   4   3.203   4.854   4.692
   32   1HD   LYS   4          HD2       LYS   4   3.986   7.028   5.060
   33   2HD   LYS   4          HD1       LYS   4   3.650   7.532   3.405
   34   1HE   LYS   4          HE2       LYS   4   1.713   8.424   4.199
   35   2HE   LYS   4          HE1       LYS   4   1.140   6.759   4.427
   36   1HZ   LYS   4          HZ1       LYS   4   2.691   8.389   6.371
   37   2HZ   LYS   4          HZ2       LYS   4   2.336   6.740   6.574
   38   3HZ   LYS   4          HZ3       LYS   4   1.080   7.884   6.533
   39    H    LEU   5           HN       LEU   5   1.914   2.957   3.240
   40    HA   LEU   5           HA       LEU   5   0.724   3.292   0.540
   41   1HB   LEU   5          HB2       LEU   5   1.691   0.877   1.177
   42   2HB   LEU   5          HB1       LEU   5   0.159   0.756   2.033
   43    HG   LEU   5           HG       LEU   5  -0.250   1.875  -0.621
   44   1HD1  LEU   5          HD11      LEU   5   1.858   0.342  -0.886
   45   2HD1  LEU   5          HD12      LEU   5   0.521   0.175  -2.031
   46   3HD1  LEU   5          HD13      LEU   5   0.699  -0.980  -0.699
   47   1HD2  LEU   5          HD21      LEU   5  -1.792  -0.141  -0.738
   48   2HD2  LEU   5          HD22      LEU   5  -2.070   0.934   0.633
   49   3HD2  LEU   5          HD23      LEU   5  -1.205  -0.586   0.865
   50    H    ILE   6           HN       ILE   6  -1.433   3.915   0.691
   51    HA   ILE   6           HA       ILE   6  -2.558   4.159   3.456
   52    HB   ILE   6           HB       ILE   6  -2.910   5.722   0.882
   53   1HG1  ILE   6          HG12      ILE   6  -0.807   6.084   2.154
   54   2HG1  ILE   6          HG11      ILE   6  -1.828   7.521   2.156
   55   1HG2  ILE   6          HG21      ILE   6  -5.058   5.643   2.095
   56   2HG2  ILE   6          HG22      ILE   6  -4.349   7.255   2.185
   57   3HG2  ILE   6          HG23      ILE   6  -4.248   6.170   3.571
   58   1HD1  ILE   6          HD11      ILE   6  -0.853   6.000   4.400
   59   2HD1  ILE   6          HD12      ILE   6  -2.616   5.965   4.396
   60   3HD1  ILE   6          HD13      ILE   6  -1.765   7.509   4.407
   61    H    ILE   7           HN       ILE   7  -4.514   3.173   3.879
   62    HA   ILE   7           HA       ILE   7  -5.689   1.429   1.807
   63    HB   ILE   7           HB       ILE   7  -6.332   1.901   4.739
   64   1HG1  ILE   7          HG12      ILE   7  -4.845  -0.431   3.513
   65   2HG1  ILE   7          HG11      ILE   7  -4.007   1.006   4.101
   66   1HG2  ILE   7          HG21      ILE   7  -8.181   0.894   3.358
   67   2HG2  ILE   7          HG22      ILE   7  -7.578  -0.176   4.625
   68   3HG2  ILE   7          HG23      ILE   7  -7.086  -0.428   2.950
   69   1HD1  ILE   7          HD11      ILE   7  -5.448  -1.107   5.633
   70   2HD1  ILE   7          HD12      ILE   7  -5.550   0.545   6.244
   71   3HD1  ILE   7          HD13      ILE   7  -3.976  -0.227   6.045
   72    H    ASN   8           HN       ASN   8  -7.167   2.367   0.449
   73    HA   ASN   8           HA       ASN   8  -8.987   4.480   1.541
   74   1HB   ASN   8          HB2       ASN   8  -7.771   3.840  -1.136
   75   2HB   ASN   8          HB1       ASN   8  -9.256   4.789  -1.063
   76   1HD2  ASN   8          HD21      ASN   8  -8.044   6.704  -1.839
   77   2HD2  ASN   8          HD22      ASN   8  -7.020   7.559  -0.775
   78    H    GLY   9           HN       GLY   9  -9.725   1.942   2.248
   79   1HA   GLY   9          HA2       GLY   9 -11.488   0.734   0.251
   80   2HA   GLY   9          HA1       GLY   9 -11.337   0.234   1.941
   81    H    LYS  10           HN       LYS  10 -13.807   0.697   0.400
   82    HA   LYS  10           HA       LYS  10 -15.100   3.136   0.921
   83   1HB   LYS  10          HB2       LYS  10 -16.169   0.298   0.915
   84   2HB   LYS  10          HB1       LYS  10 -17.163   1.745   0.745
   85   1HG   LYS  10          HG2       LYS  10 -15.501   2.319  -1.208
   86   2HG   LYS  10          HG1       LYS  10 -15.166   0.587  -1.177
   87   1HD   LYS  10          HD2       LYS  10 -17.484   0.055  -1.573
   88   2HD   LYS  10          HD1       LYS  10 -17.960   1.741  -1.363
   89   1HE   LYS  10          HE2       LYS  10 -17.825   1.759  -3.664
   90   2HE   LYS  10          HE1       LYS  10 -16.096   1.997  -3.344
   91   1HZ   LYS  10          HZ1       LYS  10 -15.720  -0.333  -3.432
   92   2HZ   LYS  10          HZ2       LYS  10 -16.611   0.067  -4.822
   93   3HZ   LYS  10          HZ3       LYS  10 -17.380  -0.674  -3.501
   94    H    THR  11           HN       THR  11 -14.735   0.298   3.038
   95    HA   THR  11           HA       THR  11 -15.910   1.901   5.288
   96    HB   THR  11           HB       THR  11 -15.734  -1.109   4.973
   97    HG1  THR  11           HG1      THR  11 -17.809  -0.997   4.209
   98   1HG2  THR  11          HG21      THR  11 -16.175  -0.787   7.213
   99   2HG2  THR  11          HG22      THR  11 -17.821  -0.695   6.585
  100   3HG2  THR  11          HG23      THR  11 -16.930   0.784   6.946
  101    H    LEU  12           HN       LEU  12 -13.162   0.005   4.196
  102    HA   LEU  12           HA       LEU  12 -11.916   0.180   6.910
  103   1HB   LEU  12          HB2       LEU  12 -11.317  -1.471   4.435
  104   2HB   LEU  12          HB1       LEU  12 -10.395  -1.559   5.936
  105    HG   LEU  12           HG       LEU  12 -13.354  -1.842   6.149
  106   1HD1  LEU  12          HD11      LEU  12 -12.701  -4.430   5.771
  107   2HD1  LEU  12          HD12      LEU  12 -11.572  -3.688   4.638
  108   3HD1  LEU  12          HD13      LEU  12 -13.304  -3.407   4.468
  109   1HD2  LEU  12          HD21      LEU  12 -11.064  -3.390   7.398
  110   2HD2  LEU  12          HD22      LEU  12 -12.738  -3.334   7.950
  111   3HD2  LEU  12          HD23      LEU  12 -11.720  -1.900   8.078
  112    H    LYS  13           HN       LYS  13  -9.943   1.250   7.169
  113    HA   LYS  13           HA       LYS  13  -8.489   2.320   4.824
  114   1HB   LYS  13          HB2       LYS  13 -10.055   3.948   6.833
  115   2HB   LYS  13          HB1       LYS  13  -8.719   4.652   5.922
  116   1HG   LYS  13          HG2       LYS  13  -9.878   3.817   3.813
  117   2HG   LYS  13          HG1       LYS  13 -11.277   3.464   4.828
  118   1HD   LYS  13          HD2       LYS  13 -11.481   5.781   5.477
  119   2HD   LYS  13          HD1       LYS  13  -9.958   6.187   4.684
  120   1HE   LYS  13          HE2       LYS  13 -10.892   6.150   2.571
  121   2HE   LYS  13          HE1       LYS  13 -12.077   4.902   3.006
  122   1HZ   LYS  13          HZ1       LYS  13 -13.141   7.070   2.804
  123   2HZ   LYS  13          HZ2       LYS  13 -12.090   7.714   3.974
  124   3HZ   LYS  13          HZ3       LYS  13 -13.213   6.513   4.405
  125    H    GLY  14           HN       GLY  14  -6.752   4.016   6.005
  126   1HA   GLY  14          HA2       GLY  14  -5.635   4.061   8.364
  127   2HA   GLY  14          HA1       GLY  14  -5.445   2.332   8.083
  128    H    GLU  15           HN       GLU  15  -3.101   3.244   8.424
  129    HA   GLU  15           HA       GLU  15  -1.953   3.852   5.714
  130   1HB   GLU  15          HB2       GLU  15  -1.050   4.856   8.439
  131   2HB   GLU  15          HB1       GLU  15  -0.329   5.287   6.890
  132   1HG   GLU  15          HG2       GLU  15  -2.884   5.957   6.363
  133   2HG   GLU  15          HG1       GLU  15  -2.889   6.199   8.109
  134    H    THR  16           HN       THR  16   0.305   3.016   5.471
  135    HA   THR  16           HA       THR  16   1.343   1.157   7.496
  136    HB   THR  16           HB       THR  16  -0.488  -0.132   6.487
  137    HG1  THR  16           HG1      THR  16   0.723  -1.898   6.025
  138   1HG2  THR  16          HG21      THR  16  -0.732   0.914   4.344
  139   2HG2  THR  16          HG22      THR  16  -0.256  -0.754   4.035
  140   3HG2  THR  16          HG23      THR  16   0.934   0.542   3.898
  141    H    THR  17           HN       THR  17   3.482   0.471   7.024
  142    HA   THR  17           HA       THR  17   4.708   1.419   4.467
  143    HB   THR  17           HB       THR  17   6.614   2.263   5.948
  144    HG1  THR  17           HG1      THR  17   6.119   1.291   7.860
  145   1HG2  THR  17          HG21      THR  17   3.866   3.515   6.012
  146   2HG2  THR  17          HG22      THR  17   5.213   3.904   4.943
  147   3HG2  THR  17          HG23      THR  17   5.290   4.334   6.651
  148    H    THR  18           HN       THR  18   6.759   0.300   4.011
  149    HA   THR  18           HA       THR  18   7.376  -2.029   5.741
  150    HB   THR  18           HB       THR  18   5.961  -1.996   3.164
  151    HG1  THR  18           HG1      THR  18   5.159  -3.215   4.753
  152   1HG2  THR  18          HG21      THR  18   8.383  -3.816   3.358
  153   2HG2  THR  18          HG22      THR  18   8.206  -2.455   2.249
  154   3HG2  THR  18          HG23      THR  18   7.142  -3.857   2.103
  155    H    GLU  19           HN       GLU  19   9.484  -3.062   4.940
  156    HA   GLU  19           HA       GLU  19  11.299  -1.015   3.707
  157   1HB   GLU  19          HB2       GLU  19  11.538  -1.225   6.169
  158   2HB   GLU  19          HB1       GLU  19  11.819  -2.957   5.985
  159   1HG   GLU  19          HG2       GLU  19  13.953  -2.667   5.215
  160   2HG   GLU  19          HG1       GLU  19  13.543  -1.195   4.333
  161    H    ALA  20           HN       ALA  20  12.029  -1.843   1.782
  162    HA   ALA  20           HA       ALA  20  13.004  -4.638   1.665
  163   1HB   ALA  20          HB1       ALA  20  10.539  -3.547   0.364
  164   2HB   ALA  20          HB2       ALA  20  10.824  -5.146   1.052
  165   3HB   ALA  20          HB3       ALA  20  11.491  -4.734  -0.528
  166    H    VAL  21           HN       VAL  21  13.757  -5.024  -0.757
  167    HA   VAL  21           HA       VAL  21  15.827  -3.186  -1.389
  168    HB   VAL  21           HB       VAL  21  15.954  -4.504  -3.491
  169   1HG1  VAL  21          HG11      VAL  21  15.183  -6.433  -1.316
  170   2HG1  VAL  21          HG12      VAL  21  16.584  -5.383  -1.109
  171   3HG1  VAL  21          HG13      VAL  21  16.527  -6.523  -2.454
  172   1HG2  VAL  21          HG21      VAL  21  14.174  -6.413  -3.609
  173   2HG2  VAL  21          HG22      VAL  21  13.731  -4.814  -4.205
  174   3HG2  VAL  21          HG23      VAL  21  13.188  -5.341  -2.613
  175    H    ASP  22           HN       ASP  22  12.536  -3.471  -2.721
  176    HA   ASP  22           HA       ASP  22  12.690  -0.670  -3.685
  177   1HB   ASP  22          HB2       ASP  22  12.083  -3.077  -5.440
  178   2HB   ASP  22          HB1       ASP  22  11.971  -1.394  -5.953
  179    H    ALA  23           HN       ALA  23  10.490   0.118  -4.289
  180    HA   ALA  23           HA       ALA  23   8.454  -0.691  -2.447
  181   1HB   ALA  23          HB1       ALA  23   7.069   0.681  -4.275
  182   2HB   ALA  23          HB2       ALA  23   8.685   1.050  -4.875
  183   3HB   ALA  23          HB3       ALA  23   8.235   1.489  -3.227
  184    H    ALA  24           HN       ALA  24   9.249  -1.773  -5.695
  185    HA   ALA  24           HA       ALA  24   6.782  -3.016  -6.427
  186   1HB   ALA  24          HB1       ALA  24   8.411  -2.826  -8.109
  187   2HB   ALA  24          HB2       ALA  24   8.518  -4.538  -7.699
  188   3HB   ALA  24          HB3       ALA  24   9.702  -3.401  -7.055
  189    H    THR  25           HN       THR  25   9.620  -4.304  -4.681
  190    HA   THR  25           HA       THR  25   8.529  -6.939  -4.233
  191    HB   THR  25           HB       THR  25  10.697  -5.259  -2.926
  192    HG1  THR  25           HG1      THR  25  11.997  -6.753  -4.098
  193   1HG2  THR  25          HG21      THR  25   9.834  -6.940  -1.303
  194   2HG2  THR  25          HG22      THR  25  11.485  -7.297  -1.819
  195   3HG2  THR  25          HG23      THR  25  10.135  -8.210  -2.493
  196    H    ALA  26           HN       ALA  26   8.758  -4.032  -2.141
  197    HA   ALA  26           HA       ALA  26   7.449  -5.111   0.136
  198   1HB   ALA  26          HB1       ALA  26   7.694  -2.328  -1.034
  199   2HB   ALA  26          HB2       ALA  26   8.614  -3.029   0.297
  200   3HB   ALA  26          HB3       ALA  26   6.911  -2.616   0.524
  201    H    GLU  27           HN       GLU  27   6.038  -2.994  -2.382
  202    HA   GLU  27           HA       GLU  27   3.381  -2.925  -1.707
  203   1HB   GLU  27          HB2       GLU  27   4.488  -1.877  -3.673
  204   2HB   GLU  27          HB1       GLU  27   4.506  -3.446  -4.477
  205   1HG   GLU  27          HG2       GLU  27   1.950  -3.464  -4.054
  206   2HG   GLU  27          HG1       GLU  27   2.131  -1.734  -3.759
  207    H    LYS  28           HN       LYS  28   5.015  -5.749  -3.134
  208    HA   LYS  28           HA       LYS  28   2.650  -7.303  -3.695
  209   1HB   LYS  28          HB2       LYS  28   5.478  -8.114  -2.908
  210   2HB   LYS  28          HB1       LYS  28   4.288  -9.187  -3.645
  211   1HG   LYS  28          HG2       LYS  28   4.390  -8.110  -5.707
  212   2HG   LYS  28          HG1       LYS  28   4.958  -6.596  -5.001
  213   1HD   LYS  28          HD2       LYS  28   6.973  -7.316  -5.829
  214   2HD   LYS  28          HD1       LYS  28   7.013  -8.205  -4.305
  215   1HE   LYS  28          HE2       LYS  28   5.911 -10.146  -5.494
  216   2HE   LYS  28          HE1       LYS  28   6.141  -9.261  -7.015
  217   1HZ   LYS  28          HZ1       LYS  28   8.316  -9.823  -5.072
  218   2HZ   LYS  28          HZ2       LYS  28   8.478  -9.137  -6.618
  219   3HZ   LYS  28          HZ3       LYS  28   8.019 -10.764  -6.451
  220    H    VAL  29           HN       VAL  29   4.811  -7.094  -0.870
  221    HA   VAL  29           HA       VAL  29   3.326  -8.938   0.806
  222    HB   VAL  29           HB       VAL  29   5.376  -6.734   1.197
  223   1HG1  VAL  29          HG11      VAL  29   4.215  -8.478   3.397
  224   2HG1  VAL  29          HG12      VAL  29   3.939  -6.741   3.224
  225   3HG1  VAL  29          HG13      VAL  29   5.561  -7.350   3.571
  226   1HG2  VAL  29          HG21      VAL  29   6.297  -8.734   0.291
  227   2HG2  VAL  29          HG22      VAL  29   5.359  -9.750   1.385
  228   3HG2  VAL  29          HG23      VAL  29   6.690  -8.777   2.010
  229    H    LEU  30           HN       LEU  30   3.204  -5.427   0.220
  230    HA   LEU  30           HA       LEU  30   1.366  -4.800   2.328
  231   1HB   LEU  30          HB2       LEU  30   2.144  -3.564  -0.318
  232   2HB   LEU  30          HB1       LEU  30   0.929  -2.809   0.698
  233    HG   LEU  30           HG       LEU  30   3.454  -2.075   0.888
  234   1HD1  LEU  30          HD11      LEU  30   1.793  -1.115   2.310
  235   2HD1  LEU  30          HD12      LEU  30   3.128  -1.643   3.342
  236   3HD1  LEU  30          HD13      LEU  30   1.648  -2.606   3.245
  237   1HD2  LEU  30          HD21      LEU  30   4.565  -4.121   1.314
  238   2HD2  LEU  30          HD22      LEU  30   3.421  -4.585   2.571
  239   3HD2  LEU  30          HD23      LEU  30   4.536  -3.265   2.841
  240    H    LYS  31           HN       LYS  31   0.991  -6.055  -0.937
  241    HA   LYS  31           HA       LYS  31  -1.859  -5.712  -1.246
  242   1HB   LYS  31          HB2       LYS  31   0.124  -6.546  -2.841
  243   2HB   LYS  31          HB1       LYS  31  -0.342  -8.115  -2.231
  244   1HG   LYS  31          HG2       LYS  31  -2.388  -6.198  -3.350
  245   2HG   LYS  31          HG1       LYS  31  -1.502  -7.310  -4.391
  246   1HD   LYS  31          HD2       LYS  31  -3.232  -8.087  -2.020
  247   2HD   LYS  31          HD1       LYS  31  -3.644  -8.309  -3.718
  248   1HE   LYS  31          HE2       LYS  31  -1.093  -9.488  -3.410
  249   2HE   LYS  31          HE1       LYS  31  -2.049 -10.026  -2.010
  250   1HZ   LYS  31          HZ1       LYS  31  -3.893 -10.491  -3.591
  251   2HZ   LYS  31          HZ2       LYS  31  -2.535 -11.483  -3.830
  252   3HZ   LYS  31          HZ3       LYS  31  -2.832 -10.178  -4.876
  253    H    GLN  32           HN       GLN  32   0.188  -8.305   0.043
  254    HA   GLN  32           HA       GLN  32  -1.781 -10.216   0.742
  255   1HB   GLN  32          HB2       GLN  32   0.968  -9.465   1.547
  256   2HB   GLN  32          HB1       GLN  32   0.073 -10.468   2.690
  257   1HG   GLN  32          HG2       GLN  32  -0.235 -12.204   1.106
  258   2HG   GLN  32          HG1       GLN  32   0.207 -11.156  -0.243
  259   1HE2  GLN  32          HE21      GLN  32   1.856 -11.721   2.916
  260   2HE2  GLN  32          HE22      GLN  32   3.338 -12.199   2.221
  261    H    TYR  33           HN       TYR  33  -0.599  -7.367   2.506
  262    HA   TYR  33           HA       TYR  33  -2.107  -7.747   4.940
  263   1HB   TYR  33          HB2       TYR  33  -0.200  -6.221   4.729
  264   2HB   TYR  33          HB1       TYR  33  -1.051  -5.281   3.502
  265    HD1  TYR  33           HD1      TYR  33  -1.109  -6.329   7.052
  266    HD2  TYR  33           HD2      TYR  33  -2.641  -3.611   4.105
  267    HE1  TYR  33           HE1      TYR  33  -2.176  -5.003   8.839
  268    HE2  TYR  33           HE2      TYR  33  -3.705  -2.272   5.897
  269    HH   TYR  33           HH       TYR  33  -2.931  -2.249   8.888
  270    H    ILE  34           HN       ILE  34  -2.762  -6.084   1.876
  271    HA   ILE  34           HA       ILE  34  -5.336  -4.986   2.564
  272    HB   ILE  34           HB       ILE  34  -4.090  -5.827  -0.072
  273   1HG1  ILE  34          HG12      ILE  34  -2.882  -4.141   1.479
  274   2HG1  ILE  34          HG11      ILE  34  -3.127  -3.674  -0.198
  275   1HG2  ILE  34          HG21      ILE  34  -6.438  -4.001   0.498
  276   2HG2  ILE  34          HG22      ILE  34  -6.477  -5.533  -0.374
  277   3HG2  ILE  34          HG23      ILE  34  -5.646  -4.143  -1.071
  278   1HD1  ILE  34          HD11      ILE  34  -3.699  -1.989   1.746
  279   2HD1  ILE  34          HD12      ILE  34  -5.187  -2.931   1.859
  280   3HD1  ILE  34          HD13      ILE  34  -4.772  -2.115   0.352
  281    H    ASN  35           HN       ASN  35  -4.256  -8.176   1.598
  282    HA   ASN  35           HA       ASN  35  -6.634  -9.301   0.535
  283   1HB   ASN  35          HB2       ASN  35  -4.262 -10.231   0.674
  284   2HB   ASN  35          HB1       ASN  35  -4.628 -10.674   2.341
  285   1HD2  ASN  35          HD21      ASN  35  -4.100 -12.563   0.125
  286   2HD2  ASN  35          HD22      ASN  35  -5.504 -13.501  -0.050
  287    H    ASP  36           HN       ASP  36  -5.696  -8.615   3.860
  288    HA   ASP  36           HA       ASP  36  -7.739 -10.225   5.145
  289   1HB   ASP  36          HB2       ASP  36  -5.731  -8.145   5.836
  290   2HB   ASP  36          HB1       ASP  36  -7.094  -8.296   6.946
  291    H    ASN  37           HN       ASN  37  -7.455  -6.660   4.845
  292    HA   ASN  37           HA       ASN  37 -10.146  -6.082   5.627
  293   1HB   ASN  37          HB2       ASN  37  -8.054  -4.637   3.978
  294   2HB   ASN  37          HB1       ASN  37  -9.592  -3.888   4.422
  295   1HD2  ASN  37          HD21      ASN  37  -6.905  -3.050   5.356
  296   2HD2  ASN  37          HD22      ASN  37  -6.919  -3.214   7.054
  297    H    GLY  38           HN       GLY  38  -8.718  -6.952   2.528
  298   1HA   GLY  38          HA2       GLY  38  -9.799  -7.708   0.571
  299   2HA   GLY  38          HA1       GLY  38 -11.346  -7.505   1.395
  300    H    ILE  39           HN       ILE  39  -8.748  -5.151   0.700
  301    HA   ILE  39           HA       ILE  39 -10.780  -3.516  -0.791
  302    HB   ILE  39           HB       ILE  39  -8.492  -2.649   1.010
  303   1HG1  ILE  39          HG12      ILE  39 -10.376  -3.633   2.265
  304   2HG1  ILE  39          HG11      ILE  39 -10.295  -1.889   2.530
  305   1HG2  ILE  39          HG21      ILE  39 -10.659  -0.995  -0.321
  306   2HG2  ILE  39          HG22      ILE  39  -8.980  -1.072  -0.854
  307   3HG2  ILE  39          HG23      ILE  39  -9.373  -0.387   0.723
  308   1HD1  ILE  39          HD11      ILE  39 -12.609  -2.448   2.135
  309   2HD1  ILE  39          HD12      ILE  39 -12.195  -3.378   0.695
  310   3HD1  ILE  39          HD13      ILE  39 -12.017  -1.624   0.692
  311    H    ASP  40           HN       ASP  40 -10.004  -4.440  -2.820
  312    HA   ASP  40           HA       ASP  40  -7.250  -3.529  -3.599
  313   1HB   ASP  40          HB2       ASP  40  -8.929  -5.938  -4.345
  314   2HB   ASP  40          HB1       ASP  40  -7.481  -5.477  -5.247
  315    H    GLY  41           HN       GLY  41  -7.128  -2.235  -5.422
  316   1HA   GLY  41          HA2       GLY  41  -9.149  -2.207  -7.494
  317   2HA   GLY  41          HA1       GLY  41  -9.300  -0.802  -6.434
  318    H    GLU  42           HN       GLU  42  -7.740   0.833  -6.550
  319    HA   GLU  42           HA       GLU  42  -5.630   0.488  -8.657
  320   1HB   GLU  42          HB2       GLU  42  -7.588   2.683  -8.012
  321   2HB   GLU  42          HB1       GLU  42  -6.085   3.065  -8.853
  322   1HG   GLU  42          HG2       GLU  42  -7.361   2.588 -10.698
  323   2HG   GLU  42          HG1       GLU  42  -6.865   0.939 -10.314
  324    H    TRP  43           HN       TRP  43  -3.608   0.673  -7.805
  325    HA   TRP  43           HA       TRP  43  -3.261   2.022  -5.172
  326   1HB   TRP  43          HB2       TRP  43  -1.626   0.098  -6.841
  327   2HB   TRP  43          HB1       TRP  43  -0.976   0.877  -5.410
  328    HD1  TRP  43           HD1      TRP  43  -4.617  -0.366  -5.571
  329    HE1  TRP  43           HE1      TRP  43  -4.870  -2.295  -3.890
  330    HE3  TRP  43           HE3      TRP  43   0.225  -0.880  -4.130
  331    HZ2  TRP  43           HZ2      TRP  43  -3.230  -3.829  -2.123
  332    HZ3  TRP  43           HZ3      TRP  43   0.865  -2.570  -2.425
  333    HH2  TRP  43           HH2      TRP  43  -0.854  -4.038  -1.423
  334    H    THR  44           HN       THR  44  -3.390   4.231  -6.187
  335    HA   THR  44           HA       THR  44  -1.575   5.123  -8.221
  336    HB   THR  44           HB       THR  44  -2.139   7.365  -7.279
  337    HG1  THR  44           HG1      THR  44  -3.528   7.369  -5.454
  338   1HG2  THR  44          HG21      THR  44  -4.164   5.269  -7.887
  339   2HG2  THR  44          HG22      THR  44  -3.828   6.785  -8.723
  340   3HG2  THR  44          HG23      THR  44  -4.764   6.792  -7.228
  341    H    TYR  45           HN       TYR  45   0.590   5.564  -8.087
  342    HA   TYR  45           HA       TYR  45   1.974   5.167  -5.496
  343   1HB   TYR  45          HB2       TYR  45   2.737   4.036  -7.541
  344   2HB   TYR  45          HB1       TYR  45   2.912   5.587  -8.359
  345    HD1  TYR  45           HD1      TYR  45   3.983   4.022  -5.108
  346    HD2  TYR  45           HD2      TYR  45   5.067   6.431  -8.495
  347    HE1  TYR  45           HE1      TYR  45   6.287   4.242  -4.214
  348    HE2  TYR  45           HE2      TYR  45   7.369   6.652  -7.602
  349    HH   TYR  45           HH       TYR  45   8.479   6.517  -5.332
  350    H    ASP  46           HN       ASP  46   3.759   6.790  -4.947
  351    HA   ASP  46           HA       ASP  46   3.189   9.562  -5.920
  352   1HB   ASP  46          HB2       ASP  46   3.501   8.763  -3.004
  353   2HB   ASP  46          HB1       ASP  46   3.118  10.366  -3.621
  354    H    ASP  47           HN       ASP  47   5.081  10.547  -6.464
  355    HA   ASP  47           HA       ASP  47   7.658   9.294  -5.934
  356   1HB   ASP  47          HB2       ASP  47   6.793  10.702  -7.945
  357   2HB   ASP  47          HB1       ASP  47   7.199  12.098  -6.945
  358    H    ALA  48           HN       ALA  48   5.691  11.251  -3.994
  359    HA   ALA  48           HA       ALA  48   7.420  13.148  -2.810
  360   1HB   ALA  48          HB1       ALA  48   5.198  13.297  -2.150
  361   2HB   ALA  48          HB2       ALA  48   5.856  12.445  -0.753
  362   3HB   ALA  48          HB3       ALA  48   5.015  11.545  -2.019
  363    H    THR  49           HN       THR  49   6.542  10.094  -1.197
  364    HA   THR  49           HA       THR  49   9.404   9.727  -0.383
  365    HB   THR  49           HB       THR  49   8.082  10.814   1.410
  366    HG1  THR  49           HG1      THR  49   9.407   9.559   2.457
  367   1HG2  THR  49          HG21      THR  49   6.287   8.400   1.048
  368   2HG2  THR  49          HG22      THR  49   5.852  10.091   0.798
  369   3HG2  THR  49          HG23      THR  49   6.191   9.499   2.426
  370    H    LYS  50           HN       LYS  50   7.957   8.419  -2.517
  371    HA   LYS  50           HA       LYS  50   7.531   6.268  -3.346
  372   1HB   LYS  50          HB2       LYS  50   9.002   5.451  -0.818
  373   2HB   LYS  50          HB1       LYS  50   8.790   4.461  -2.258
  374   1HG   LYS  50          HG2       LYS  50   9.941   7.075  -2.893
  375   2HG   LYS  50          HG1       LYS  50  10.932   6.178  -1.744
  376   1HD   LYS  50          HD2       LYS  50  10.305   4.205  -3.527
  377   2HD   LYS  50          HD1       LYS  50  10.364   5.609  -4.592
  378   1HE   LYS  50          HE2       LYS  50  12.569   4.895  -2.627
  379   2HE   LYS  50          HE1       LYS  50  12.598   4.482  -4.353
  380   1HZ   LYS  50          HZ1       LYS  50  13.679   6.591  -4.052
  381   2HZ   LYS  50          HZ2       LYS  50  12.355   7.203  -3.181
  382   3HZ   LYS  50          HZ3       LYS  50  12.198   6.855  -4.836
  383    H    THR  51           HN       THR  51   5.469   7.492  -1.816
  384    HA   THR  51           HA       THR  51   4.363   5.538   0.073
  385    HB   THR  51           HB       THR  51   2.810   7.762  -1.235
  386    HG1  THR  51           HG1      THR  51   3.856   9.231   0.129
  387   1HG2  THR  51          HG21      THR  51   2.778   7.750   1.628
  388   2HG2  THR  51          HG22      THR  51   2.528   6.097   1.064
  389   3HG2  THR  51          HG23      THR  51   1.459   7.388   0.517
  390    H    TRP  52           HN       TRP  52   1.791   5.163  -0.521
  391    HA   TRP  52           HA       TRP  52   1.453   4.401  -3.365
  392   1HB   TRP  52          HB2       TRP  52   1.725   2.546  -1.008
  393   2HB   TRP  52          HB1       TRP  52   0.794   2.074  -2.423
  394    HD1  TRP  52           HD1      TRP  52   4.325   2.567  -1.209
  395    HE1  TRP  52           HE1      TRP  52   5.965   1.830  -3.066
  396    HE3  TRP  52           HE3      TRP  52   1.043   1.914  -5.013
  397    HZ2  TRP  52           HZ2      TRP  52   5.869   1.053  -5.831
  398    HZ3  TRP  52           HZ3      TRP  52   1.815   1.172  -7.259
  399    HH2  TRP  52           HH2      TRP  52   4.225   0.740  -7.668
  400    H    THR  53           HN       THR  53  -0.793   2.949  -3.258
  401    HA   THR  53           HA       THR  53  -2.720   4.035  -1.315
  402    HB   THR  53           HB       THR  53  -3.264   4.526  -4.237
  403    HG1  THR  53           HG1      THR  53  -1.439   5.660  -4.075
  404   1HG2  THR  53          HG21      THR  53  -5.177   5.069  -3.101
  405   2HG2  THR  53          HG22      THR  53  -4.324   6.600  -2.896
  406   3HG2  THR  53          HG23      THR  53  -4.314   5.404  -1.599
  407    H    VAL  54           HN       VAL  54  -5.047   3.230  -2.171
  408    HA   VAL  54           HA       VAL  54  -5.207   0.884  -3.829
  409    HB   VAL  54           HB       VAL  54  -3.833  -0.144  -2.108
  410   1HG1  VAL  54          HG11      VAL  54  -5.605   1.422  -0.327
  411   2HG1  VAL  54          HG12      VAL  54  -3.888   1.063  -0.179
  412   3HG1  VAL  54          HG13      VAL  54  -5.083  -0.149   0.279
  413   1HG2  VAL  54          HG21      VAL  54  -6.185  -1.217  -2.872
  414   2HG2  VAL  54          HG22      VAL  54  -6.489  -1.091  -1.140
  415   3HG2  VAL  54          HG23      VAL  54  -5.107  -2.022  -1.726
  416    H    THR  55           HN       THR  55  -6.985   2.542  -4.250
  417    HA   THR  55           HA       THR  55  -9.171   2.708  -2.290
  418    HB   THR  55           HB       THR  55  -9.117   3.556  -5.198
  419    HG1  THR  55           HG1      THR  55  -8.204   5.476  -4.436
  420   1HG2  THR  55          HG21      THR  55 -10.600   4.475  -2.726
  421   2HG2  THR  55          HG22      THR  55 -11.286   3.796  -4.202
  422   3HG2  THR  55          HG23      THR  55 -10.561   5.403  -4.225
  423    H    GLU  56           HN       GLU  56 -11.013   1.447  -2.315
  424    HA   GLU  56           HA       GLU  56 -11.107  -0.945  -3.975
  425   1HB   GLU  56          HB2       GLU  56 -12.037  -0.204  -1.530
  426   2HB   GLU  56          HB1       GLU  56 -13.505  -0.014  -2.489
  427   1HG   GLU  56          HG2       GLU  56 -11.901  -2.499  -2.899
  428   2HG   GLU  56          HG1       GLU  56 -12.841  -2.367  -1.412
  Start of MODEL    7
    1   1H    THR   1          HT1       THR   1  14.468   7.133   3.395
    2   2H    THR   1          HT2       THR   1  14.882   5.594   2.807
    3   3H    THR   1          HT3       THR   1  13.750   5.751   4.065
    4    HA   THR   1           HA       THR   1  12.193   6.853   2.574
    5    HB   THR   1           HB       THR   1  14.324   6.300   0.490
    6    HG1  THR   1           HG1      THR   1  15.258   7.984   1.292
    7   1HG2  THR   1          HG21      THR   1  12.184   6.477  -0.530
    8   2HG2  THR   1          HG22      THR   1  12.921   8.067  -0.723
    9   3HG2  THR   1          HG23      THR   1  11.706   7.804   0.528
   10    H    THR   2           HN       THR   2  11.580   4.647   3.541
   11    HA   THR   2           HA       THR   2  12.026   2.294   1.823
   12    HB   THR   2           HB       THR   2  12.025   2.148   4.282
   13    HG1  THR   2           HG1      THR   2  10.836   0.347   4.342
   14   1HG2  THR   2          HG21      THR   2   9.383   2.302   5.064
   15   2HG2  THR   2          HG22      THR   2   9.528   3.658   3.946
   16   3HG2  THR   2          HG23      THR   2  10.599   3.549   5.343
   17    H    PHE   3           HN       PHE   3   9.672   0.965   1.803
   18    HA   PHE   3           HA       PHE   3   8.111   2.396  -0.212
   19   1HB   PHE   3          HB2       PHE   3   7.683  -0.267   1.188
   20   2HB   PHE   3          HB1       PHE   3   6.902   0.246  -0.306
   21    HD1  PHE   3           HD1      PHE   3   8.937   1.424  -1.926
   22    HD2  PHE   3           HD2      PHE   3   9.277  -1.915   0.754
   23    HE1  PHE   3           HE1      PHE   3  10.874   0.580  -3.224
   24    HE2  PHE   3           HE2      PHE   3  11.213  -2.759  -0.544
   25    HZ   PHE   3           HZ       PHE   3  12.013  -1.512  -2.532
   26    H    LYS   4           HN       LYS   4   5.874   2.988  -0.008
   27    HA   LYS   4           HA       LYS   4   4.710   2.956   2.744
   28   1HB   LYS   4          HB2       LYS   4   5.999   5.079   2.238
   29   2HB   LYS   4          HB1       LYS   4   4.848   5.392   0.948
   30   1HG   LYS   4          HG2       LYS   4   2.995   5.377   2.555
   31   2HG   LYS   4          HG1       LYS   4   4.119   5.022   3.865
   32   1HD   LYS   4          HD2       LYS   4   4.940   7.159   3.927
   33   2HD   LYS   4          HD1       LYS   4   4.770   7.384   2.186
   34   1HE   LYS   4          HE2       LYS   4   2.976   8.692   2.749
   35   2HE   LYS   4          HE1       LYS   4   2.133   7.151   3.006
   36   1HZ   LYS   4          HZ1       LYS   4   3.736   8.612   5.040
   37   2HZ   LYS   4          HZ2       LYS   4   2.959   7.120   5.281
   38   3HZ   LYS   4          HZ3       LYS   4   2.043   8.523   5.000
   39    H    LEU   5           HN       LEU   5   2.402   3.094   2.750
   40    HA   LEU   5           HA       LEU   5   0.996   3.213   0.132
   41   1HB   LEU   5          HB2       LEU   5   1.735   0.813   1.052
   42   2HB   LEU   5          HB1       LEU   5   0.296   1.015   2.044
   43    HG   LEU   5           HG       LEU   5  -0.242   1.781  -0.715
   44   1HD1  LEU   5          HD11      LEU   5   0.158  -0.203  -1.886
   45   2HD1  LEU   5          HD12      LEU   5   0.319  -1.159  -0.403
   46   3HD1  LEU   5          HD13      LEU   5   1.614  -0.060  -0.894
   47   1HD2  LEU   5          HD21      LEU   5  -1.348  -0.349   1.142
   48   2HD2  LEU   5          HD22      LEU   5  -2.075   0.114  -0.397
   49   3HD2  LEU   5          HD23      LEU   5  -1.982   1.282   0.922
   50    H    ILE   6           HN       ILE   6  -1.040   4.131   0.343
   51    HA   ILE   6           HA       ILE   6  -1.871   4.916   3.111
   52    HB   ILE   6           HB       ILE   6  -2.342   6.119   0.367
   53   1HG1  ILE   6          HG12      ILE   6  -0.045   6.353   1.279
   54   2HG1  ILE   6          HG11      ILE   6  -0.869   7.908   1.184
   55   1HG2  ILE   6          HG21      ILE   6  -3.145   8.090   1.908
   56   2HG2  ILE   6          HG22      ILE   6  -3.436   6.807   3.082
   57   3HG2  ILE   6          HG23      ILE   6  -4.263   6.781   1.525
   58   1HD1  ILE   6          HD11      ILE   6   0.206   6.551   3.506
   59   2HD1  ILE   6          HD12      ILE   6  -1.515   6.866   3.724
   60   3HD1  ILE   6          HD13      ILE   6  -0.412   8.197   3.372
   61    H    ILE   7           HN       ILE   7  -3.676   3.915   3.862
   62    HA   ILE   7           HA       ILE   7  -5.312   2.206   2.143
   63    HB   ILE   7           HB       ILE   7  -5.548   3.072   5.047
   64   1HG1  ILE   7          HG12      ILE   7  -4.403   0.525   3.857
   65   2HG1  ILE   7          HG11      ILE   7  -3.422   1.888   4.399
   66   1HG2  ILE   7          HG21      ILE   7  -7.667   2.190   4.408
   67   2HG2  ILE   7          HG22      ILE   7  -6.823   0.842   5.171
   68   3HG2  ILE   7          HG23      ILE   7  -6.930   0.934   3.413
   69   1HD1  ILE   7          HD11      ILE   7  -4.869   1.594   6.614
   70   2HD1  ILE   7          HD12      ILE   7  -3.425   0.620   6.334
   71   3HD1  ILE   7          HD13      ILE   7  -5.022  -0.057   6.012
   72    H    ASN   8           HN       ASN   8  -6.882   3.093   0.866
   73    HA   ASN   8           HA       ASN   8  -8.315   5.542   1.829
   74   1HB   ASN   8          HB2       ASN   8  -7.524   4.399  -0.834
   75   2HB   ASN   8          HB1       ASN   8  -8.915   5.478  -0.750
   76   1HD2  ASN   8          HD21      ASN   8  -7.557   7.042  -2.032
   77   2HD2  ASN   8          HD22      ASN   8  -6.400   7.994  -1.216
   78    H    GLY   9           HN       GLY   9  -9.236   3.283   3.033
   79   1HA   GLY   9          HA2       GLY   9 -11.369   2.030   1.455
   80   2HA   GLY   9          HA1       GLY   9 -11.023   1.723   3.162
   81    H    LYS  10           HN       LYS  10 -13.638   2.251   1.970
   82    HA   LYS  10           HA       LYS  10 -14.618   4.866   2.264
   83   1HB   LYS  10          HB2       LYS  10 -15.878   2.177   2.873
   84   2HB   LYS  10          HB1       LYS  10 -16.789   3.676   2.690
   85   1HG   LYS  10          HG2       LYS  10 -15.652   3.908   0.403
   86   2HG   LYS  10          HG1       LYS  10 -15.154   2.228   0.602
   87   1HD   LYS  10          HD2       LYS  10 -17.193   2.064  -0.575
   88   2HD   LYS  10          HD1       LYS  10 -17.654   1.761   1.100
   89   1HE   LYS  10          HE2       LYS  10 -18.828   3.727   1.267
   90   2HE   LYS  10          HE1       LYS  10 -17.677   4.613   0.246
   91   1HZ   LYS  10          HZ1       LYS  10 -18.525   3.573  -1.690
   92   2HZ   LYS  10          HZ2       LYS  10 -19.875   4.136  -0.826
   93   3HZ   LYS  10          HZ3       LYS  10 -19.468   2.487  -0.791
   94    H    THR  11           HN       THR  11 -13.800   2.502   4.735
   95    HA   THR  11           HA       THR  11 -14.546   4.506   6.842
   96    HB   THR  11           HB       THR  11 -14.652   1.500   7.150
   97    HG1  THR  11           HG1      THR  11 -16.535   1.473   6.208
   98   1HG2  THR  11          HG21      THR  11 -15.660   3.902   8.645
   99   2HG2  THR  11          HG22      THR  11 -14.801   2.489   9.259
  100   3HG2  THR  11          HG23      THR  11 -16.499   2.359   8.802
  101    H    LEU  12           HN       LEU  12 -12.486   1.711   6.011
  102    HA   LEU  12           HA       LEU  12 -10.646   2.220   8.249
  103   1HB   LEU  12          HB2       LEU  12 -10.595   0.349   5.857
  104   2HB   LEU  12          HB1       LEU  12  -9.466   0.278   7.211
  105    HG   LEU  12           HG       LEU  12 -12.368   0.286   7.880
  106   1HD1  LEU  12          HD11      LEU  12 -12.827  -1.870   7.174
  107   2HD1  LEU  12          HD12      LEU  12 -11.128  -2.341   7.167
  108   3HD1  LEU  12          HD13      LEU  12 -11.772  -1.346   5.862
  109   1HD2  LEU  12          HD21      LEU  12 -11.628  -1.043   9.715
  110   2HD2  LEU  12          HD22      LEU  12 -10.367   0.170   9.490
  111   3HD2  LEU  12          HD23      LEU  12 -10.127  -1.473   8.895
  112    H    LYS  13           HN       LYS  13  -8.672   3.276   8.086
  113    HA   LYS  13           HA       LYS  13  -7.494   3.904   5.453
  114   1HB   LYS  13          HB2       LYS  13  -8.945   5.843   7.228
  115   2HB   LYS  13          HB1       LYS  13  -7.564   6.416   6.291
  116   1HG   LYS  13          HG2       LYS  13  -8.845   5.052   4.357
  117   2HG   LYS  13          HG1       LYS  13 -10.233   5.486   5.356
  118   1HD   LYS  13          HD2       LYS  13  -8.154   7.487   4.436
  119   2HD   LYS  13          HD1       LYS  13  -9.661   7.183   3.571
  120   1HE   LYS  13          HE2       LYS  13 -10.977   7.881   5.496
  121   2HE   LYS  13          HE1       LYS  13  -9.511   8.037   6.484
  122   1HZ   LYS  13          HZ1       LYS  13 -10.188   9.574   4.034
  123   2HZ   LYS  13          HZ2       LYS  13  -8.664   9.612   4.783
  124   3HZ   LYS  13          HZ3       LYS  13 -10.034  10.184   5.609
  125    H    GLY  14           HN       GLY  14  -5.591   5.659   6.053
  126   1HA   GLY  14          HA2       GLY  14  -4.131   6.201   8.100
  127   2HA   GLY  14          HA1       GLY  14  -4.155   4.459   8.381
  128    H    GLU  15           HN       GLU  15  -1.694   5.435   8.110
  129    HA   GLU  15           HA       GLU  15  -0.904   4.978   5.252
  130   1HB   GLU  15          HB2       GLU  15   0.528   6.390   7.533
  131   2HB   GLU  15          HB1       GLU  15   1.089   6.306   5.865
  132   1HG   GLU  15          HG2       GLU  15  -0.069   8.201   5.465
  133   2HG   GLU  15          HG1       GLU  15  -1.547   7.264   5.677
  134    H    THR  16           HN       THR  16   1.095   3.702   4.939
  135    HA   THR  16           HA       THR  16   2.124   2.146   7.231
  136    HB   THR  16           HB       THR  16   0.044   0.987   6.619
  137    HG1  THR  16           HG1      THR  16   2.328  -0.381   5.647
  138   1HG2  THR  16          HG21      THR  16   1.265   1.053   3.853
  139   2HG2  THR  16          HG22      THR  16  -0.328   1.617   4.361
  140   3HG2  THR  16          HG23      THR  16   0.014  -0.110   4.295
  141    H    THR  17           HN       THR  17   4.091   1.036   6.706
  142    HA   THR  17           HA       THR  17   5.154   1.417   3.936
  143    HB   THR  17           HB       THR  17   7.308   2.142   5.092
  144    HG1  THR  17           HG1      THR  17   7.254   1.942   7.167
  145   1HG2  THR  17          HG21      THR  17   5.990   3.822   4.008
  146   2HG2  THR  17          HG22      THR  17   6.402   4.460   5.600
  147   3HG2  THR  17          HG23      THR  17   4.791   3.806   5.302
  148    H    THR  18           HN       THR  18   6.954  -0.056   3.466
  149    HA   THR  18           HA       THR  18   7.427  -2.217   5.442
  150    HB   THR  18           HB       THR  18   5.698  -2.295   3.082
  151    HG1  THR  18           HG1      THR  18   5.281  -3.136   5.176
  152   1HG2  THR  18          HG21      THR  18   6.470  -4.361   2.068
  153   2HG2  THR  18          HG22      THR  18   7.842  -4.441   3.174
  154   3HG2  THR  18          HG23      THR  18   7.755  -3.156   1.968
  155    H    GLU  19           HN       GLU  19   9.378  -3.457   4.901
  156    HA   GLU  19           HA       GLU  19  11.244  -1.973   3.079
  157   1HB   GLU  19          HB2       GLU  19  11.413  -2.362   5.776
  158   2HB   GLU  19          HB1       GLU  19  12.288  -3.779   5.192
  159   1HG   GLU  19          HG2       GLU  19  13.412  -1.962   3.591
  160   2HG   GLU  19          HG1       GLU  19  12.967  -0.883   4.915
  161    H    ALA  20           HN       ALA  20  11.863  -3.148   1.306
  162    HA   ALA  20           HA       ALA  20  12.269  -6.067   1.498
  163   1HB   ALA  20          HB1       ALA  20  10.062  -6.357   0.968
  164   2HB   ALA  20          HB2       ALA  20  10.612  -5.991  -0.668
  165   3HB   ALA  20          HB3       ALA  20   9.904  -4.719   0.330
  166    H    VAL  21           HN       VAL  21  12.762  -6.874  -0.889
  167    HA   VAL  21           HA       VAL  21  15.092  -5.568  -1.846
  168    HB   VAL  21           HB       VAL  21  14.809  -7.113  -3.773
  169   1HG1  VAL  21          HG11      VAL  21  15.734  -8.348  -2.075
  170   2HG1  VAL  21          HG12      VAL  21  14.188  -9.190  -2.176
  171   3HG1  VAL  21          HG13      VAL  21  14.441  -7.956  -0.942
  172   1HG2  VAL  21          HG21      VAL  21  12.692  -8.633  -3.548
  173   2HG2  VAL  21          HG22      VAL  21  12.524  -7.063  -4.331
  174   3HG2  VAL  21          HG23      VAL  21  12.008  -7.273  -2.659
  175    H    ASP  22           HN       ASP  22  11.720  -5.337  -2.964
  176    HA   ASP  22           HA       ASP  22  12.355  -2.765  -4.305
  177   1HB   ASP  22          HB2       ASP  22  11.117  -5.184  -5.666
  178   2HB   ASP  22          HB1       ASP  22  11.308  -3.593  -6.402
  179    H    ALA  23           HN       ALA  23  10.330  -1.595  -4.865
  180    HA   ALA  23           HA       ALA  23   8.347  -1.698  -2.810
  181   1HB   ALA  23          HB1       ALA  23   7.594  -0.569  -5.447
  182   2HB   ALA  23          HB2       ALA  23   9.116   0.028  -4.786
  183   3HB   ALA  23          HB3       ALA  23   7.624   0.207  -3.863
  184    H    ALA  24           HN       ALA  24   8.514  -3.224  -5.993
  185    HA   ALA  24           HA       ALA  24   5.790  -4.029  -6.278
  186   1HB   ALA  24          HB1       ALA  24   7.636  -4.128  -7.985
  187   2HB   ALA  24          HB2       ALA  24   6.724  -5.633  -7.864
  188   3HB   ALA  24          HB3       ALA  24   8.313  -5.502  -7.109
  189    H    THR  25           HN       THR  25   8.554  -5.667  -4.724
  190    HA   THR  25           HA       THR  25   7.154  -8.043  -3.931
  191    HB   THR  25           HB       THR  25   9.606  -6.562  -2.920
  192    HG1  THR  25           HG1      THR  25   9.610  -7.568  -5.003
  193   1HG2  THR  25          HG21      THR  25  10.189  -8.569  -1.637
  194   2HG2  THR  25          HG22      THR  25   8.679  -9.340  -2.122
  195   3HG2  THR  25          HG23      THR  25   8.646  -7.921  -1.070
  196    H    ALA  26           HN       ALA  26   7.787  -4.960  -2.240
  197    HA   ALA  26           HA       ALA  26   6.599  -5.638   0.248
  198   1HB   ALA  26          HB1       ALA  26   7.968  -3.675   0.006
  199   2HB   ALA  26          HB2       ALA  26   6.347  -3.100   0.411
  200   3HB   ALA  26          HB3       ALA  26   6.923  -3.027  -1.259
  201    H    GLU  27           HN       GLU  27   5.113  -3.616  -2.329
  202    HA   GLU  27           HA       GLU  27   2.561  -3.332  -1.353
  203   1HB   GLU  27          HB2       GLU  27   1.869  -3.111  -3.708
  204   2HB   GLU  27          HB1       GLU  27   3.442  -2.366  -3.441
  205   1HG   GLU  27          HG2       GLU  27   4.583  -4.055  -4.582
  206   2HG   GLU  27          HG1       GLU  27   3.292  -5.229  -4.349
  207    H    LYS  28           HN       LYS  28   3.876  -6.349  -2.629
  208    HA   LYS  28           HA       LYS  28   1.339  -7.718  -2.962
  209   1HB   LYS  28          HB2       LYS  28   4.147  -8.727  -2.350
  210   2HB   LYS  28          HB1       LYS  28   2.817  -9.726  -2.936
  211   1HG   LYS  28          HG2       LYS  28   2.823  -8.726  -5.052
  212   2HG   LYS  28          HG1       LYS  28   3.629  -7.270  -4.468
  213   1HD   LYS  28          HD2       LYS  28   5.478  -8.239  -5.397
  214   2HD   LYS  28          HD1       LYS  28   5.517  -9.135  -3.878
  215   1HE   LYS  28          HE2       LYS  28   4.873 -11.095  -4.876
  216   2HE   LYS  28          HE1       LYS  28   3.750 -10.274  -5.978
  217   1HZ   LYS  28          HZ1       LYS  28   6.714 -10.335  -6.170
  218   2HZ   LYS  28          HZ2       LYS  28   5.720  -9.348  -7.132
  219   3HZ   LYS  28          HZ3       LYS  28   5.612 -11.040  -7.249
  220    H    VAL  29           HN       VAL  29   3.723  -7.467  -0.332
  221    HA   VAL  29           HA       VAL  29   2.244  -9.093   1.575
  222    HB   VAL  29           HB       VAL  29   4.513  -7.081   1.635
  223   1HG1  VAL  29          HG11      VAL  29   3.268  -6.792   3.765
  224   2HG1  VAL  29          HG12      VAL  29   4.847  -7.537   4.029
  225   3HG1  VAL  29          HG13      VAL  29   3.389  -8.530   4.057
  226   1HG2  VAL  29          HG21      VAL  29   4.389 -10.011   2.399
  227   2HG2  VAL  29          HG22      VAL  29   5.841  -9.029   2.202
  228   3HG2  VAL  29          HG23      VAL  29   4.846  -9.423   0.800
  229    H    LEU  30           HN       LEU  30   2.362  -5.637   0.745
  230    HA   LEU  30           HA       LEU  30   0.781  -4.709   2.954
  231   1HB   LEU  30          HB2       LEU  30   1.400  -3.713   0.166
  232   2HB   LEU  30          HB1       LEU  30   0.376  -2.788   1.248
  233    HG   LEU  30           HG       LEU  30   2.974  -2.307   1.115
  234   1HD1  LEU  30          HD11      LEU  30   1.374  -2.458   3.669
  235   2HD1  LEU  30          HD12      LEU  30   1.566  -1.070   2.594
  236   3HD1  LEU  30          HD13      LEU  30   2.943  -1.652   3.541
  237   1HD2  LEU  30          HD21      LEU  30   4.131  -3.448   3.054
  238   2HD2  LEU  30          HD22      LEU  30   3.912  -4.428   1.620
  239   3HD2  LEU  30          HD23      LEU  30   2.864  -4.657   3.016
  240    H    LYS  31           HN       LYS  31   0.030  -6.071  -0.209
  241    HA   LYS  31           HA       LYS  31  -2.790  -5.518  -0.323
  242   1HB   LYS  31          HB2       LYS  31  -1.018  -6.634  -1.988
  243   2HB   LYS  31          HB1       LYS  31  -1.565  -8.110  -1.232
  244   1HG   LYS  31          HG2       LYS  31  -3.527  -6.101  -2.336
  245   2HG   LYS  31          HG1       LYS  31  -2.816  -7.348  -3.359
  246   1HD   LYS  31          HD2       LYS  31  -4.416  -7.825  -0.823
  247   2HD   LYS  31          HD1       LYS  31  -4.973  -8.117  -2.469
  248   1HE   LYS  31          HE2       LYS  31  -2.507  -9.487  -2.259
  249   2HE   LYS  31          HE1       LYS  31  -3.396  -9.853  -0.762
  250   1HZ   LYS  31          HZ1       LYS  31  -4.091 -11.365  -2.502
  251   2HZ   LYS  31          HZ2       LYS  31  -4.456 -10.068  -3.537
  252   3HZ   LYS  31          HZ3       LYS  31  -5.370 -10.317  -2.126
  253    H    GLN  32           HN       GLN  32  -0.885  -8.196   1.009
  254    HA   GLN  32           HA       GLN  32  -2.961  -9.863   1.979
  255   1HB   GLN  32          HB2       GLN  32  -0.098  -9.341   2.513
  256   2HB   GLN  32          HB1       GLN  32  -0.983 -10.161   3.800
  257   1HG   GLN  32          HG2       GLN  32  -0.216 -11.936   2.450
  258   2HG   GLN  32          HG1       GLN  32  -1.883 -11.701   1.923
  259   1HE2  GLN  32          HE21      GLN  32   1.075 -12.290   0.641
  260   2HE2  GLN  32          HE22      GLN  32   0.938 -11.452  -0.839
  261    H    TYR  33           HN       TYR  33  -1.383  -7.034   3.445
  262    HA   TYR  33           HA       TYR  33  -2.748  -7.112   5.996
  263   1HB   TYR  33          HB2       TYR  33  -0.707  -5.818   5.578
  264   2HB   TYR  33          HB1       TYR  33  -1.527  -4.866   4.343
  265    HD1  TYR  33           HD1      TYR  33  -1.469  -5.684   7.950
  266    HD2  TYR  33           HD2      TYR  33  -2.897  -2.999   4.922
  267    HE1  TYR  33           HE1      TYR  33  -2.273  -4.147   9.703
  268    HE2  TYR  33           HE2      TYR  33  -3.698  -1.447   6.680
  269    HH   TYR  33           HH       TYR  33  -4.440  -1.759   9.210
  270    H    ILE  34           HN       ILE  34  -3.406  -5.557   2.876
  271    HA   ILE  34           HA       ILE  34  -5.806  -4.152   3.626
  272    HB   ILE  34           HB       ILE  34  -4.808  -5.284   0.991
  273   1HG1  ILE  34          HG12      ILE  34  -3.352  -3.638   2.355
  274   2HG1  ILE  34          HG11      ILE  34  -3.652  -3.245   0.668
  275   1HG2  ILE  34          HG21      ILE  34  -7.210  -4.743   0.892
  276   2HG2  ILE  34          HG22      ILE  34  -6.266  -3.620  -0.086
  277   3HG2  ILE  34          HG23      ILE  34  -6.870  -3.120   1.493
  278   1HD1  ILE  34          HD11      ILE  34  -5.169  -2.121   3.045
  279   2HD1  ILE  34          HD12      ILE  34  -5.449  -1.703   1.354
  280   3HD1  ILE  34          HD13      ILE  34  -3.925  -1.269   2.128
  281    H    ASN  35           HN       ASN  35  -5.118  -7.467   2.670
  282    HA   ASN  35           HA       ASN  35  -7.724  -8.359   1.945
  283   1HB   ASN  35          HB2       ASN  35  -5.460  -9.509   1.725
  284   2HB   ASN  35          HB1       ASN  35  -5.595  -9.919   3.435
  285   1HD2  ASN  35          HD21      ASN  35  -6.598 -10.827   0.244
  286   2HD2  ASN  35          HD22      ASN  35  -7.670 -12.061   0.702
  287    H    ASP  36           HN       ASP  36  -6.255  -7.758   5.085
  288    HA   ASP  36           HA       ASP  36  -8.300  -9.166   6.630
  289   1HB   ASP  36          HB2       ASP  36  -5.844  -8.646   7.213
  290   2HB   ASP  36          HB1       ASP  36  -6.397  -7.009   7.568
  291    H    ASN  37           HN       ASN  37  -7.631  -5.778   5.747
  292    HA   ASN  37           HA       ASN  37  -9.865  -4.691   7.274
  293   1HB   ASN  37          HB2       ASN  37  -8.132  -3.610   5.024
  294   2HB   ASN  37          HB1       ASN  37  -9.243  -2.631   5.989
  295   1HD2  ASN  37          HD21      ASN  37  -6.300  -2.331   5.898
  296   2HD2  ASN  37          HD22      ASN  37  -5.741  -2.606   7.487
  297    H    GLY  38           HN       GLY  38  -9.330  -5.695   3.916
  298   1HA   GLY  38          HA2       GLY  38 -11.044  -6.447   2.422
  299   2HA   GLY  38          HA1       GLY  38 -12.254  -5.731   3.487
  300    H    ILE  39           HN       ILE  39  -9.396  -3.984   2.419
  301    HA   ILE  39           HA       ILE  39 -11.189  -2.160   0.851
  302    HB   ILE  39           HB       ILE  39  -8.575  -1.668   2.321
  303   1HG1  ILE  39          HG12      ILE  39 -10.476  -2.070   3.840
  304   2HG1  ILE  39          HG11      ILE  39  -9.993  -0.373   3.889
  305   1HG2  ILE  39          HG21      ILE  39  -8.599  -0.066   0.604
  306   2HG2  ILE  39          HG22      ILE  39  -9.378   0.782   1.939
  307   3HG2  ILE  39          HG23      ILE  39 -10.355   0.090   0.644
  308   1HD1  ILE  39          HD11      ILE  39 -12.396  -0.412   3.761
  309   2HD1  ILE  39          HD12      ILE  39 -12.365  -1.567   2.428
  310   3HD1  ILE  39          HD13      ILE  39 -11.807   0.087   2.175
  311    H    ASP  40           HN       ASP  40 -10.718  -3.847  -0.931
  312    HA   ASP  40           HA       ASP  40  -8.068  -3.294  -2.231
  313   1HB   ASP  40          HB2       ASP  40  -9.941  -5.683  -2.309
  314   2HB   ASP  40          HB1       ASP  40  -8.489  -5.536  -3.306
  315    H    GLY  41           HN       GLY  41  -8.417  -1.792  -3.838
  316   1HA   GLY  41          HA2       GLY  41 -10.608  -2.323  -5.773
  317   2HA   GLY  41          HA1       GLY  41 -10.531  -0.722  -5.030
  318    H    GLU  42           HN       GLU  42  -8.731   0.654  -5.548
  319    HA   GLU  42           HA       GLU  42  -7.111  -0.244  -7.910
  320   1HB   GLU  42          HB2       GLU  42  -9.041   1.942  -7.532
  321   2HB   GLU  42          HB1       GLU  42  -7.501   2.493  -8.191
  322   1HG   GLU  42          HG2       GLU  42  -7.765   1.339 -10.154
  323   2HG   GLU  42          HG1       GLU  42  -8.639   0.015  -9.381
  324    H    TRP  43           HN       TRP  43  -4.981  -0.175  -7.372
  325    HA   TRP  43           HA       TRP  43  -4.056   1.663  -5.212
  326   1HB   TRP  43          HB2       TRP  43  -2.852  -0.715  -6.664
  327   2HB   TRP  43          HB1       TRP  43  -1.963   0.243  -5.495
  328    HD1  TRP  43           HD1      TRP  43  -5.666  -0.634  -4.923
  329    HE1  TRP  43           HE1      TRP  43  -5.810  -2.230  -2.922
  330    HE3  TRP  43           HE3      TRP  43  -0.713  -1.438  -4.108
  331    HZ2  TRP  43           HZ2      TRP  43  -4.057  -3.628  -1.164
  332    HZ3  TRP  43           HZ3      TRP  43   0.033  -2.895  -2.238
  333    HH2  TRP  43           HH2      TRP  43  -1.630  -3.986  -0.771
  334    H    THR  44           HN       THR  44  -1.933   2.781  -5.647
  335    HA   THR  44           HA       THR  44  -1.227   3.227  -8.485
  336    HB   THR  44           HB       THR  44  -1.537   5.678  -8.240
  337    HG1  THR  44           HG1      THR  44  -2.819   6.326  -6.397
  338   1HG2  THR  44          HG21      THR  44  -3.905   5.693  -8.524
  339   2HG2  THR  44          HG22      THR  44  -4.106   4.264  -7.510
  340   3HG2  THR  44          HG23      THR  44  -3.363   4.117  -9.102
  341    H    TYR  45           HN       TYR  45   0.960   3.465  -8.607
  342    HA   TYR  45           HA       TYR  45   2.519   3.646  -6.102
  343   1HB   TYR  45          HB2       TYR  45   3.023   1.977  -7.849
  344   2HB   TYR  45          HB1       TYR  45   3.273   3.266  -9.025
  345    HD1  TYR  45           HD1      TYR  45   4.383   2.615  -5.491
  346    HD2  TYR  45           HD2      TYR  45   5.511   3.645  -9.504
  347    HE1  TYR  45           HE1      TYR  45   6.748   2.815  -4.775
  348    HE2  TYR  45           HE2      TYR  45   7.876   3.847  -8.789
  349    HH   TYR  45           HH       TYR  45   9.199   2.598  -6.445
  350    H    ASP  46           HN       ASP  46   4.309   5.249  -5.938
  351    HA   ASP  46           HA       ASP  46   3.945   7.693  -7.634
  352   1HB   ASP  46          HB2       ASP  46   4.280   7.627  -4.613
  353   2HB   ASP  46          HB1       ASP  46   4.036   9.060  -5.606
  354    H    ASP  47           HN       ASP  47   5.889   8.383  -8.419
  355    HA   ASP  47           HA       ASP  47   8.375   7.071  -7.687
  356   1HB   ASP  47          HB2       ASP  47   9.303   8.679  -9.343
  357   2HB   ASP  47          HB1       ASP  47   7.857   7.875  -9.951
  358    H    ALA  48           HN       ALA  48   6.655   9.597  -6.190
  359    HA   ALA  48           HA       ALA  48   8.630  11.475  -5.423
  360   1HB   ALA  48          HB1       ALA  48   6.434  12.026  -4.869
  361   2HB   ALA  48          HB2       ALA  48   7.026  11.481  -3.299
  362   3HB   ALA  48          HB3       ALA  48   6.062  10.395  -4.304
  363    H    THR  49           HN       THR  49   7.385   9.029  -3.151
  364    HA   THR  49           HA       THR  49  10.195   8.495  -2.244
  365    HB   THR  49           HB       THR  49   8.996  10.067  -0.750
  366    HG1  THR  49           HG1      THR  49  10.073   8.996   0.678
  367   1HG2  THR  49          HG21      THR  49   6.965   7.824  -0.574
  368   2HG2  THR  49          HG22      THR  49   6.701   9.417  -1.284
  369   3HG2  THR  49          HG23      THR  49   6.967   9.259   0.454
  370    H    LYS  50           HN       LYS  50   8.545   6.948  -4.087
  371    HA   LYS  50           HA       LYS  50   7.852   4.733  -4.455
  372   1HB   LYS  50          HB2       LYS  50   9.446   4.329  -1.901
  373   2HB   LYS  50          HB1       LYS  50   9.013   3.065  -3.050
  374   1HG   LYS  50          HG2       LYS  50  10.298   4.197  -4.812
  375   2HG   LYS  50          HG1       LYS  50  10.710   5.495  -3.691
  376   1HD   LYS  50          HD2       LYS  50  12.255   4.228  -2.576
  377   2HD   LYS  50          HD1       LYS  50  11.324   2.742  -2.765
  378   1HE   LYS  50          HE2       LYS  50  12.294   2.233  -4.795
  379   2HE   LYS  50          HE1       LYS  50  12.478   3.940  -5.248
  380   1HZ   LYS  50          HZ1       LYS  50  14.178   4.166  -3.533
  381   2HZ   LYS  50          HZ2       LYS  50  14.621   2.983  -4.669
  382   3HZ   LYS  50          HZ3       LYS  50  14.029   2.522  -3.144
  383    H    THR  51           HN       THR  51   5.900   6.295  -3.280
  384    HA   THR  51           HA       THR  51   4.798   4.875  -0.929
  385    HB   THR  51           HB       THR  51   3.294   6.956  -2.471
  386    HG1  THR  51           HG1      THR  51   4.867   8.313  -2.388
  387   1HG2  THR  51          HG21      THR  51   2.267   7.252  -0.485
  388   2HG2  THR  51          HG22      THR  51   3.802   7.368   0.374
  389   3HG2  THR  51          HG23      THR  51   3.093   5.787   0.047
  390    H    TRP  52           HN       TRP  52   2.117   4.838  -1.401
  391    HA   TRP  52           HA       TRP  52   1.529   3.559  -3.999
  392   1HB   TRP  52          HB2       TRP  52   1.744   2.150  -1.346
  393   2HB   TRP  52          HB1       TRP  52   0.657   1.552  -2.592
  394    HD1  TRP  52           HD1      TRP  52   4.297   1.754  -1.660
  395    HE1  TRP  52           HE1      TRP  52   5.695   0.480  -3.418
  396    HE3  TRP  52           HE3      TRP  52   0.709   0.914  -5.140
  397    HZ2  TRP  52           HZ2      TRP  52   5.314  -0.746  -5.988
  398    HZ3  TRP  52           HZ3      TRP  52   1.225  -0.310  -7.242
  399    HH2  TRP  52           HH2      TRP  52   3.525  -1.142  -7.666
  400    H    THR  53           HN       THR  53  -0.881   2.445  -3.504
  401    HA   THR  53           HA       THR  53  -2.519   4.116  -1.723
  402    HB   THR  53           HB       THR  53  -2.968   4.206  -4.718
  403    HG1  THR  53           HG1      THR  53  -1.139   5.328  -4.489
  404   1HG2  THR  53          HG21      THR  53  -4.198   6.358  -3.878
  405   2HG2  THR  53          HG22      THR  53  -4.166   5.547  -2.313
  406   3HG2  THR  53          HG23      THR  53  -4.978   4.789  -3.683
  407    H    VAL  54           HN       VAL  54  -4.904   3.484  -1.998
  408    HA   VAL  54           HA       VAL  54  -5.624   1.039  -3.370
  409    HB   VAL  54           HB       VAL  54  -4.186  -0.017  -1.747
  410   1HG1  VAL  54          HG11      VAL  54  -4.893   0.449   0.779
  411   2HG1  VAL  54          HG12      VAL  54  -5.385   1.995   0.089
  412   3HG1  VAL  54          HG13      VAL  54  -3.715   1.457  -0.058
  413   1HG2  VAL  54          HG21      VAL  54  -5.637  -1.568  -0.840
  414   2HG2  VAL  54          HG22      VAL  54  -6.747  -0.772  -1.963
  415   3HG2  VAL  54          HG23      VAL  54  -6.755  -0.333  -0.255
  416    H    THR  55           HN       THR  55  -7.394   2.475  -3.902
  417    HA   THR  55           HA       THR  55  -9.163   3.413  -1.719
  418    HB   THR  55           HB       THR  55  -9.586   3.615  -4.707
  419    HG1  THR  55           HG1      THR  55  -8.029   5.026  -4.834
  420   1HG2  THR  55          HG21      THR  55 -10.605   5.790  -4.021
  421   2HG2  THR  55          HG22      THR  55 -10.296   5.365  -2.336
  422   3HG2  THR  55          HG23      THR  55 -11.413   4.398  -3.300
  423    H    GLU  56           HN       GLU  56 -11.107   2.425  -1.214
  424    HA   GLU  56           HA       GLU  56 -11.669  -0.249  -2.191
  425   1HB   GLU  56          HB2       GLU  56 -12.142   0.789   0.098
  426   2HB   GLU  56          HB1       GLU  56 -13.498   1.621  -0.663
  427   1HG   GLU  56          HG2       GLU  56 -13.233  -1.337  -1.055
  428   2HG   GLU  56          HG1       GLU  56 -13.848  -0.740   0.487
  Start of MODEL    8
    1   1H    THR   1          HT1       THR   1  15.169   3.385   5.232
    2   2H    THR   1          HT2       THR   1  14.082   4.625   4.822
    3   3H    THR   1          HT3       THR   1  15.604   4.543   4.071
    4    HA   THR   1           HA       THR   1  14.061   3.704   2.494
    5    HB   THR   1           HB       THR   1  14.942   1.366   2.374
    6    HG1  THR   1           HG1      THR   1  16.094   0.576   4.091
    7   1HG2  THR   1          HG21      THR   1  16.321   3.413   1.788
    8   2HG2  THR   1          HG22      THR   1  17.256   1.981   2.217
    9   3HG2  THR   1          HG23      THR   1  17.051   3.284   3.388
   10    H    THR   2           HN       THR   2  11.947   4.189   3.728
   11    HA   THR   2           HA       THR   2  10.666   1.613   4.588
   12    HB   THR   2           HB       THR   2   9.981   4.393   5.572
   13    HG1  THR   2           HG1      THR   2  11.906   4.248   6.432
   14   1HG2  THR   2          HG21      THR   2   9.628   1.816   7.067
   15   2HG2  THR   2          HG22      THR   2   8.477   2.248   5.803
   16   3HG2  THR   2          HG23      THR   2   8.702   3.312   7.191
   17    H    PHE   3           HN       PHE   3   9.111   1.051   3.129
   18    HA   PHE   3           HA       PHE   3   8.064   2.933   1.158
   19   1HB   PHE   3          HB2       PHE   3   7.318   0.086   1.915
   20   2HB   PHE   3          HB1       PHE   3   6.790   0.913   0.450
   21    HD1  PHE   3           HD1      PHE   3   9.022   2.270  -0.627
   22    HD2  PHE   3           HD2      PHE   3   8.985  -1.485   1.463
   23    HE1  PHE   3           HE1      PHE   3  11.133   1.621  -1.754
   24    HE2  PHE   3           HE2      PHE   3  11.096  -2.131   0.335
   25    HZ   PHE   3           HZ       PHE   3  12.170  -0.579  -1.272
   26    H    LYS   4           HN       LYS   4   5.638   3.202   0.891
   27    HA   LYS   4           HA       LYS   4   4.118   3.087   3.461
   28   1HB   LYS   4          HB2       LYS   4   5.337   5.300   3.089
   29   2HB   LYS   4          HB1       LYS   4   4.294   5.541   1.697
   30   1HG   LYS   4          HG2       LYS   4   2.305   5.404   3.107
   31   2HG   LYS   4          HG1       LYS   4   3.305   5.078   4.521
   32   1HD   LYS   4          HD2       LYS   4   4.106   7.251   4.631
   33   2HD   LYS   4          HD1       LYS   4   3.875   7.531   2.905
   34   1HE   LYS   4          HE2       LYS   4   1.975   8.643   3.491
   35   2HE   LYS   4          HE1       LYS   4   1.282   7.051   3.857
   36   1HZ   LYS   4          HZ1       LYS   4   2.993   8.542   5.769
   37   2HZ   LYS   4          HZ2       LYS   4   2.029   7.177   6.078
   38   3HZ   LYS   4          HZ3       LYS   4   1.303   8.679   5.759
   39    H    LEU   5           HN       LEU   5   1.820   3.139   3.147
   40    HA   LEU   5           HA       LEU   5   0.760   3.213   0.380
   41   1HB   LEU   5          HB2       LEU   5   1.568   0.828   1.297
   42   2HB   LEU   5          HB1       LEU   5   0.000   0.874   2.092
   43    HG   LEU   5           HG       LEU   5  -0.230   1.737  -0.680
   44   1HD1  LEU   5          HD11      LEU   5   0.479  -0.150  -1.867
   45   2HD1  LEU   5          HD12      LEU   5   0.516  -1.166  -0.416
   46   3HD1  LEU   5          HD13      LEU   5   1.774   0.047  -0.679
   47   1HD2  LEU   5          HD21      LEU   5  -1.453  -0.329   1.135
   48   2HD2  LEU   5          HD22      LEU   5  -1.818  -0.343  -0.591
   49   3HD2  LEU   5          HD23      LEU   5  -2.209   1.076   0.382
   50    H    ILE   6           HN       ILE   6  -1.321   4.042   0.393
   51    HA   ILE   6           HA       ILE   6  -2.535   4.600   3.070
   52    HB   ILE   6           HB       ILE   6  -2.737   5.899   0.339
   53   1HG1  ILE   6          HG12      ILE   6  -0.625   6.250   1.602
   54   2HG1  ILE   6          HG11      ILE   6  -1.543   7.746   1.429
   55   1HG2  ILE   6          HG21      ILE   6  -4.000   6.842   2.930
   56   2HG2  ILE   6          HG22      ILE   6  -4.887   6.016   1.649
   57   3HG2  ILE   6          HG23      ILE   6  -4.155   7.590   1.340
   58   1HD1  ILE   6          HD11      ILE   6  -0.668   6.469   3.838
   59   2HD1  ILE   6          HD12      ILE   6  -2.431   6.450   3.817
   60   3HD1  ILE   6          HD13      ILE   6  -1.564   7.978   3.668
   61    H    ILE   7           HN       ILE   7  -4.309   3.405   3.568
   62    HA   ILE   7           HA       ILE   7  -5.615   1.680   1.615
   63    HB   ILE   7           HB       ILE   7  -6.292   2.417   4.483
   64   1HG1  ILE   7          HG12      ILE   7  -4.776   0.026   3.389
   65   2HG1  ILE   7          HG11      ILE   7  -4.007   1.436   4.119
   66   1HG2  ILE   7          HG21      ILE   7  -7.175   0.114   2.714
   67   2HG2  ILE   7          HG22      ILE   7  -8.201   1.394   3.360
   68   3HG2  ILE   7          HG23      ILE   7  -7.479   0.210   4.449
   69   1HD1  ILE   7          HD11      ILE   7  -5.657  -0.704   5.407
   70   2HD1  ILE   7          HD12      ILE   7  -5.712   0.921   6.090
   71   3HD1  ILE   7          HD13      ILE   7  -4.175   0.062   5.978
   72    H    ASN   8           HN       ASN   8  -7.008   2.580   0.143
   73    HA   ASN   8           HA       ASN   8  -8.765   4.842   1.013
   74   1HB   ASN   8          HB2       ASN   8  -7.612   3.867  -1.597
   75   2HB   ASN   8          HB1       ASN   8  -9.023   4.924  -1.595
   76   1HD2  ASN   8          HD21      ASN   8  -7.677   6.654  -2.573
   77   2HD2  ASN   8          HD22      ASN   8  -6.582   7.533  -1.604
   78    H    GLY   9           HN       GLY   9  -9.606   2.432   1.983
   79   1HA   GLY   9          HA2       GLY   9 -11.453   1.148   0.090
   80   2HA   GLY   9          HA1       GLY   9 -11.235   0.709   1.789
   81    H    LYS  10           HN       LYS  10 -13.758   1.185   0.337
   82    HA   LYS  10           HA       LYS  10 -14.965   3.675   0.835
   83   1HB   LYS  10          HB2       LYS  10 -16.094   0.862   0.933
   84   2HB   LYS  10          HB1       LYS  10 -17.071   2.324   0.793
   85   1HG   LYS  10          HG2       LYS  10 -15.614   2.879  -1.264
   86   2HG   LYS  10          HG1       LYS  10 -15.103   1.192  -1.197
   87   1HD   LYS  10          HD2       LYS  10 -17.158   0.398  -1.838
   88   2HD   LYS  10          HD1       LYS  10 -18.029   1.700  -1.027
   89   1HE   LYS  10          HE2       LYS  10 -18.332   2.203  -3.321
   90   2HE   LYS  10          HE1       LYS  10 -16.950   3.225  -2.876
   91   1HZ   LYS  10          HZ1       LYS  10 -15.500   1.314  -3.497
   92   2HZ   LYS  10          HZ2       LYS  10 -16.331   2.005  -4.808
   93   3HZ   LYS  10          HZ3       LYS  10 -16.865   0.538  -4.137
   94    H    THR  11           HN       THR  11 -14.347   0.993   3.047
   95    HA   THR  11           HA       THR  11 -15.521   2.624   5.280
   96    HB   THR  11           HB       THR  11 -15.329  -0.391   4.969
   97    HG1  THR  11           HG1      THR  11 -17.044  -0.128   3.815
   98   1HG2  THR  11          HG21      THR  11 -16.261   1.451   7.121
   99   2HG2  THR  11          HG22      THR  11 -15.492  -0.130   7.251
  100   3HG2  THR  11          HG23      THR  11 -17.203  -0.013   6.840
  101    H    LEU  12           HN       LEU  12 -12.978   0.315   4.331
  102    HA   LEU  12           HA       LEU  12 -11.510   0.767   6.866
  103   1HB   LEU  12          HB2       LEU  12 -11.105  -0.977   4.420
  104   2HB   LEU  12          HB1       LEU  12 -10.001  -0.965   5.796
  105    HG   LEU  12           HG       LEU  12 -12.898  -1.304   6.399
  106   1HD1  LEU  12          HD11      LEU  12 -11.172  -3.396   5.054
  107   2HD1  LEU  12          HD12      LEU  12 -12.762  -2.823   4.550
  108   3HD1  LEU  12          HD13      LEU  12 -12.599  -3.804   6.006
  109   1HD2  LEU  12          HD21      LEU  12 -11.532  -1.371   8.301
  110   2HD2  LEU  12          HD22      LEU  12 -10.235  -2.219   7.459
  111   3HD2  LEU  12          HD23      LEU  12 -11.702  -3.083   7.916
  112    H    LYS  13           HN       LYS  13  -9.773   2.141   7.013
  113    HA   LYS  13           HA       LYS  13  -8.287   2.967   4.586
  114   1HB   LYS  13          HB2       LYS  13  -9.983   4.772   6.330
  115   2HB   LYS  13          HB1       LYS  13  -8.725   5.396   5.261
  116   1HG   LYS  13          HG2       LYS  13  -9.889   4.055   3.396
  117   2HG   LYS  13          HG1       LYS  13 -11.249   3.918   4.511
  118   1HD   LYS  13          HD2       LYS  13 -10.043   6.621   4.033
  119   2HD   LYS  13          HD1       LYS  13 -11.121   5.942   2.813
  120   1HE   LYS  13          HE2       LYS  13 -12.758   6.893   4.117
  121   2HE   LYS  13          HE1       LYS  13 -12.541   5.434   5.105
  122   1HZ   LYS  13          HZ1       LYS  13 -12.241   7.307   6.526
  123   2HZ   LYS  13          HZ2       LYS  13 -11.169   8.047   5.435
  124   3HZ   LYS  13          HZ3       LYS  13 -10.708   6.633   6.256
  125    H    GLY  14           HN       GLY  14  -6.692   4.893   5.526
  126   1HA   GLY  14          HA2       GLY  14  -5.599   5.450   7.790
  127   2HA   GLY  14          HA1       GLY  14  -5.447   3.702   7.966
  128    H    GLU  15           HN       GLU  15  -3.084   4.542   8.144
  129    HA   GLU  15           HA       GLU  15  -1.863   4.601   5.398
  130   1HB   GLU  15          HB2       GLU  15  -0.874   5.834   7.997
  131   2HB   GLU  15          HB1       GLU  15  -0.112   6.004   6.417
  132   1HG   GLU  15          HG2       GLU  15  -2.545   6.879   5.746
  133   2HG   GLU  15          HG1       GLU  15  -2.609   7.269   7.464
  134    H    THR  16           HN       THR  16   0.228   3.458   5.241
  135    HA   THR  16           HA       THR  16   1.075   1.785   7.523
  136    HB   THR  16           HB       THR  16  -0.833   0.557   6.590
  137    HG1  THR  16           HG1      THR  16   0.223  -1.270   6.658
  138   1HG2  THR  16          HG21      THR  16   0.676   0.945   4.003
  139   2HG2  THR  16          HG22      THR  16  -1.016   1.300   4.358
  140   3HG2  THR  16          HG23      THR  16  -0.481  -0.372   4.203
  141    H    THR  17           HN       THR  17   3.174   0.947   7.245
  142    HA   THR  17           HA       THR  17   4.553   1.483   4.643
  143    HB   THR  17           HB       THR  17   6.460   2.363   6.066
  144    HG1  THR  17           HG1      THR  17   6.230   2.219   8.129
  145   1HG2  THR  17          HG21      THR  17   5.270   4.555   6.587
  146   2HG2  THR  17          HG22      THR  17   3.787   3.772   6.045
  147   3HG2  THR  17          HG23      THR  17   5.132   3.985   4.925
  148    H    THR  18           HN       THR  18   6.527   0.166   4.401
  149    HA   THR  18           HA       THR  18   6.866  -2.015   6.385
  150    HB   THR  18           HB       THR  18   5.602  -2.139   3.741
  151    HG1  THR  18           HG1      THR  18   4.662  -3.146   5.415
  152   1HG2  THR  18          HG21      THR  18   7.883  -4.084   4.220
  153   2HG2  THR  18          HG22      THR  18   7.861  -2.813   2.996
  154   3HG2  THR  18          HG23      THR  18   6.711  -4.148   2.901
  155    H    GLU  19           HN       GLU  19   8.941  -3.247   5.876
  156    HA   GLU  19           HA       GLU  19  10.983  -1.448   4.608
  157   1HB   GLU  19          HB2       GLU  19  10.964  -1.624   7.132
  158   2HB   GLU  19          HB1       GLU  19  11.316  -3.343   6.954
  159   1HG   GLU  19          HG2       GLU  19  13.240  -2.330   5.350
  160   2HG   GLU  19          HG1       GLU  19  13.075  -0.992   6.488
  161    H    ALA  20           HN       ALA  20  11.706  -2.442   2.759
  162    HA   ALA  20           HA       ALA  20  12.484  -5.301   2.855
  163   1HB   ALA  20          HB1       ALA  20  11.087  -5.526   0.652
  164   2HB   ALA  20          HB2       ALA  20  10.237  -4.099   1.249
  165   3HB   ALA  20          HB3       ALA  20  10.242  -5.585   2.200
  166    H    VAL  21           HN       VAL  21  13.369  -5.894   0.543
  167    HA   VAL  21           HA       VAL  21  15.575  -4.222  -0.089
  168    HB   VAL  21           HB       VAL  21  15.758  -5.708  -2.070
  169   1HG1  VAL  21          HG11      VAL  21  14.745  -7.409   0.196
  170   2HG1  VAL  21          HG12      VAL  21  16.196  -6.426   0.402
  171   3HG1  VAL  21          HG13      VAL  21  16.143  -7.669  -0.847
  172   1HG2  VAL  21          HG21      VAL  21  13.884  -7.526  -2.160
  173   2HG2  VAL  21          HG22      VAL  21  13.570  -5.960  -2.905
  174   3HG2  VAL  21          HG23      VAL  21  12.900  -6.330  -1.318
  175    H    ASP  22           HN       ASP  22  12.361  -4.443  -1.608
  176    HA   ASP  22           HA       ASP  22  12.741  -1.743  -2.782
  177   1HB   ASP  22          HB2       ASP  22  12.085  -4.253  -4.366
  178   2HB   ASP  22          HB1       ASP  22  12.108  -2.617  -5.022
  179    H    ALA  23           HN       ALA  23  10.636  -0.876  -3.568
  180    HA   ALA  23           HA       ALA  23   8.452  -1.416  -1.797
  181   1HB   ALA  23          HB1       ALA  23   8.238   0.676  -2.703
  182   2HB   ALA  23          HB2       ALA  23   7.335  -0.161  -3.965
  183   3HB   ALA  23          HB3       ALA  23   9.043   0.209  -4.200
  184    H    ALA  24           HN       ALA  24   9.342  -2.764  -4.922
  185    HA   ALA  24           HA       ALA  24   6.846  -3.920  -5.695
  186   1HB   ALA  24          HB1       ALA  24   9.765  -4.465  -6.159
  187   2HB   ALA  24          HB2       ALA  24   8.531  -3.963  -7.316
  188   3HB   ALA  24          HB3       ALA  24   8.579  -5.631  -6.745
  189    H    THR  25           HN       THR  25   9.516  -5.225  -3.716
  190    HA   THR  25           HA       THR  25   8.267  -7.765  -3.152
  191    HB   THR  25           HB       THR  25  10.447  -6.105  -1.842
  192    HG1  THR  25           HG1      THR  25  11.365  -6.886  -3.558
  193   1HG2  THR  25          HG21      THR  25   9.711  -8.989  -1.248
  194   2HG2  THR  25          HG22      THR  25   9.416  -7.627  -0.162
  195   3HG2  THR  25          HG23      THR  25  11.071  -8.099  -0.562
  196    H    ALA  26           HN       ALA  26   8.542  -4.734  -1.244
  197    HA   ALA  26           HA       ALA  26   7.054  -5.596   1.018
  198   1HB   ALA  26          HB1       ALA  26   6.636  -3.052   1.217
  199   2HB   ALA  26          HB2       ALA  26   7.530  -2.912  -0.302
  200   3HB   ALA  26          HB3       ALA  26   8.321  -3.574   1.128
  201    H    GLU  27           HN       GLU  27   5.908  -3.590  -1.719
  202    HA   GLU  27           HA       GLU  27   3.228  -3.319  -1.200
  203   1HB   GLU  27          HB2       GLU  27   4.503  -2.488  -3.172
  204   2HB   GLU  27          HB1       GLU  27   4.460  -4.111  -3.859
  205   1HG   GLU  27          HG2       GLU  27   1.866  -3.894  -3.502
  206   2HG   GLU  27          HG1       GLU  27   2.207  -2.164  -3.471
  207    H    LYS  28           HN       LYS  28   4.755  -6.326  -2.355
  208    HA   LYS  28           HA       LYS  28   2.326  -7.779  -2.916
  209   1HB   LYS  28          HB2       LYS  28   5.057  -8.709  -1.935
  210   2HB   LYS  28          HB1       LYS  28   3.840  -9.744  -2.682
  211   1HG   LYS  28          HG2       LYS  28   4.138  -8.806  -4.790
  212   2HG   LYS  28          HG1       LYS  28   4.748  -7.284  -4.140
  213   1HD   LYS  28          HD2       LYS  28   6.758  -8.175  -4.812
  214   2HD   LYS  28          HD1       LYS  28   6.668  -8.932  -3.222
  215   1HE   LYS  28          HE2       LYS  28   5.265 -10.393  -5.394
  216   2HE   LYS  28          HE1       LYS  28   7.037 -10.360  -5.504
  217   1HZ   LYS  28          HZ1       LYS  28   6.291 -12.179  -4.085
  218   2HZ   LYS  28          HZ2       LYS  28   5.465 -11.082  -3.085
  219   3HZ   LYS  28          HZ3       LYS  28   7.161 -11.034  -3.186
  220    H    VAL  29           HN       VAL  29   4.373  -7.477  -0.020
  221    HA   VAL  29           HA       VAL  29   2.731  -9.120   1.715
  222    HB   VAL  29           HB       VAL  29   4.874  -6.996   2.035
  223   1HG1  VAL  29          HG11      VAL  29   3.538  -8.510   4.305
  224   2HG1  VAL  29          HG12      VAL  29   3.362  -6.780   3.994
  225   3HG1  VAL  29          HG13      VAL  29   4.934  -7.441   4.453
  226   1HG2  VAL  29          HG21      VAL  29   6.051  -9.030   3.045
  227   2HG2  VAL  29          HG22      VAL  29   5.718  -9.105   1.314
  228   3HG2  VAL  29          HG23      VAL  29   4.693  -9.985   2.449
  229    H    LEU  30           HN       LEU  30   2.815  -5.657   0.881
  230    HA   LEU  30           HA       LEU  30   0.923  -4.799   2.858
  231   1HB   LEU  30          HB2       LEU  30   1.894  -3.782   0.181
  232   2HB   LEU  30          HB1       LEU  30   0.668  -2.902   1.077
  233    HG   LEU  30           HG       LEU  30   3.207  -2.272   1.355
  234   1HD1  LEU  30          HD11      LEU  30   1.524  -1.158   2.634
  235   2HD1  LEU  30          HD12      LEU  30   2.786  -1.672   3.760
  236   3HD1  LEU  30          HD13      LEU  30   1.272  -2.579   3.650
  237   1HD2  LEU  30          HD21      LEU  30   4.142  -3.384   3.426
  238   2HD2  LEU  30          HD22      LEU  30   4.202  -4.332   1.956
  239   3HD2  LEU  30          HD23      LEU  30   2.981  -4.672   3.178
  240    H    LYS  31           HN       LYS  31   0.631  -6.177  -0.374
  241    HA   LYS  31           HA       LYS  31  -2.183  -5.732  -0.821
  242   1HB   LYS  31          HB2       LYS  31  -0.170  -6.735  -2.281
  243   2HB   LYS  31          HB1       LYS  31  -0.749  -8.249  -1.627
  244   1HG   LYS  31          HG2       LYS  31  -2.632  -6.279  -2.927
  245   2HG   LYS  31          HG1       LYS  31  -1.763  -7.486  -3.873
  246   1HD   LYS  31          HD2       LYS  31  -3.638  -8.056  -1.554
  247   2HD   LYS  31          HD1       LYS  31  -3.988  -8.332  -3.259
  248   1HE   LYS  31          HE2       LYS  31  -1.522  -9.633  -2.777
  249   2HE   LYS  31          HE1       LYS  31  -2.572 -10.056  -1.406
  250   1HZ   LYS  31          HZ1       LYS  31  -2.895 -11.502  -3.392
  251   2HZ   LYS  31          HZ2       LYS  31  -3.439 -10.141  -4.251
  252   3HZ   LYS  31          HZ3       LYS  31  -4.306 -10.699  -2.900
  253    H    GLN  32           HN       GLN  32  -0.326  -8.361   0.671
  254    HA   GLN  32           HA       GLN  32  -2.422 -10.138   1.363
  255   1HB   GLN  32          HB2       GLN  32   0.316  -9.466   2.322
  256   2HB   GLN  32          HB1       GLN  32  -0.687 -10.472   3.369
  257   1HG   GLN  32          HG2       GLN  32  -1.053 -12.064   1.549
  258   2HG   GLN  32          HG1       GLN  32  -0.129 -11.043   0.447
  259   1HE2  GLN  32          HE21      GLN  32   1.970 -11.789   0.183
  260   2HE2  GLN  32          HE22      GLN  32   2.894 -12.570   1.386
  261    H    TYR  33           HN       TYR  33  -1.141  -7.293   3.063
  262    HA   TYR  33           HA       TYR  33  -2.759  -7.480   5.446
  263   1HB   TYR  33          HB2       TYR  33  -0.753  -6.079   5.233
  264   2HB   TYR  33          HB1       TYR  33  -1.519  -5.135   3.956
  265    HD1  TYR  33           HD1      TYR  33  -1.692  -6.040   7.537
  266    HD2  TYR  33           HD2      TYR  33  -3.061  -3.382   4.457
  267    HE1  TYR  33           HE1      TYR  33  -2.724  -4.597   9.251
  268    HE2  TYR  33           HE2      TYR  33  -4.090  -1.927   6.178
  269    HH   TYR  33           HH       TYR  33  -4.814  -2.812   9.146
  270    H    ILE  34           HN       ILE  34  -3.213  -5.937   2.287
  271    HA   ILE  34           HA       ILE  34  -5.740  -4.657   2.844
  272    HB   ILE  34           HB       ILE  34  -4.447  -5.662   0.289
  273   1HG1  ILE  34          HG12      ILE  34  -3.208  -3.989   1.834
  274   2HG1  ILE  34          HG11      ILE  34  -3.350  -3.578   0.130
  275   1HG2  ILE  34          HG21      ILE  34  -6.854  -5.225  -0.014
  276   2HG2  ILE  34          HG22      ILE  34  -5.877  -4.037  -0.877
  277   3HG2  ILE  34          HG23      ILE  34  -6.644  -3.605   0.652
  278   1HD1  ILE  34          HD11      ILE  34  -3.909  -1.792   1.992
  279   2HD1  ILE  34          HD12      ILE  34  -5.459  -2.634   2.046
  280   3HD1  ILE  34          HD13      ILE  34  -4.907  -1.899   0.541
  281    H    ASN  35           HN       ASN  35  -4.811  -7.933   2.019
  282    HA   ASN  35           HA       ASN  35  -7.187  -8.969   0.888
  283   1HB   ASN  35          HB2       ASN  35  -4.895 -10.031   1.195
  284   2HB   ASN  35          HB1       ASN  35  -5.361 -10.363   2.863
  285   1HD2  ASN  35          HD21      ASN  35  -5.621 -12.646   2.744
  286   2HD2  ASN  35          HD22      ASN  35  -6.742 -13.406   1.721
  287    H    ASP  36           HN       ASP  36  -6.253  -8.843   4.353
  288    HA   ASP  36           HA       ASP  36  -8.714  -9.972   5.332
  289   1HB   ASP  36          HB2       ASP  36  -7.863  -9.100   7.506
  290   2HB   ASP  36          HB1       ASP  36  -6.613  -9.946   6.596
  291    H    ASN  37           HN       ASN  37  -7.834  -6.734   4.330
  292    HA   ASN  37           HA       ASN  37 -10.102  -5.452   5.708
  293   1HB   ASN  37          HB2       ASN  37  -8.050  -4.528   3.667
  294   2HB   ASN  37          HB1       ASN  37  -9.222  -3.461   4.449
  295   1HD2  ASN  37          HD21      ASN  37  -6.194  -3.529   4.704
  296   2HD2  ASN  37          HD22      ASN  37  -5.905  -3.692   6.378
  297    H    GLY  38           HN       GLY  38  -9.315  -6.707   2.510
  298   1HA   GLY  38          HA2       GLY  38 -10.815  -7.289   0.775
  299   2HA   GLY  38          HA1       GLY  38 -12.136  -6.631   1.740
  300    H    ILE  39           HN       ILE  39  -9.210  -4.817   0.991
  301    HA   ILE  39           HA       ILE  39 -10.885  -2.966  -0.676
  302    HB   ILE  39           HB       ILE  39  -8.409  -2.442   1.007
  303   1HG1  ILE  39          HG12      ILE  39 -10.357  -2.988   2.410
  304   2HG1  ILE  39          HG11      ILE  39  -9.984  -1.266   2.530
  305   1HG2  ILE  39          HG21      ILE  39  -8.790  -0.934  -0.987
  306   2HG2  ILE  39          HG22      ILE  39  -8.803  -0.105   0.569
  307   3HG2  ILE  39          HG23      ILE  39 -10.321  -0.460  -0.254
  308   1HD1  ILE  39          HD11      ILE  39 -12.359  -2.606   1.376
  309   2HD1  ILE  39          HD12      ILE  39 -11.727  -1.260   0.428
  310   3HD1  ILE  39          HD13      ILE  39 -12.210  -1.007   2.105
  311    H    ASP  40           HN       ASP  40 -10.211  -4.601  -2.440
  312    HA   ASP  40           HA       ASP  40  -7.453  -3.992  -3.459
  313   1HB   ASP  40          HB2       ASP  40  -9.137  -6.399  -3.221
  314   2HB   ASP  40          HB1       ASP  40  -8.400  -6.212  -4.816
  315    H    GLY  41           HN       GLY  41  -7.840  -2.231  -4.826
  316   1HA   GLY  41          HA2       GLY  41  -9.730  -2.728  -7.082
  317   2HA   GLY  41          HA1       GLY  41  -9.764  -1.179  -6.233
  318    H    GLU  42           HN       GLU  42  -7.941   0.246  -6.454
  319    HA   GLU  42           HA       GLU  42  -6.013  -0.481  -8.633
  320   1HB   GLU  42          HB2       GLU  42  -8.106   1.581  -8.482
  321   2HB   GLU  42          HB1       GLU  42  -6.529   2.231  -8.927
  322   1HG   GLU  42          HG2       GLU  42  -6.488   1.138 -10.933
  323   2HG   GLU  42          HG1       GLU  42  -7.313  -0.284 -10.292
  324    H    TRP  43           HN       TRP  43  -3.967  -0.253  -7.845
  325    HA   TRP  43           HA       TRP  43  -3.475   1.541  -5.515
  326   1HB   TRP  43          HB2       TRP  43  -1.888  -0.636  -6.913
  327   2HB   TRP  43          HB1       TRP  43  -1.241   0.327  -5.598
  328    HD1  TRP  43           HD1      TRP  43  -4.888  -0.899  -5.536
  329    HE1  TRP  43           HE1      TRP  43  -5.122  -2.619  -3.648
  330    HE3  TRP  43           HE3      TRP  43  -0.016  -1.316  -4.143
  331    HZ2  TRP  43           HZ2      TRP  43  -3.471  -3.961  -1.752
  332    HZ3  TRP  43           HZ3      TRP  43   0.631  -2.809  -2.265
  333    HH2  TRP  43           HH2      TRP  43  -1.085  -4.126  -1.073
  334    H    THR  44           HN       THR  44  -1.495   2.917  -5.628
  335    HA   THR  44           HA       THR  44  -0.479   3.561  -8.337
  336    HB   THR  44           HB       THR  44  -1.067   5.942  -8.052
  337    HG1  THR  44           HG1      THR  44  -1.125   6.041  -5.819
  338   1HG2  THR  44          HG21      THR  44  -3.565   4.312  -7.590
  339   2HG2  THR  44          HG22      THR  44  -2.656   4.213  -9.098
  340   3HG2  THR  44          HG23      THR  44  -3.367   5.747  -8.596
  341    H    TYR  45           HN       TYR  45   1.671   3.996  -8.178
  342    HA   TYR  45           HA       TYR  45   2.898   4.187  -5.495
  343   1HB   TYR  45          HB2       TYR  45   3.761   2.644  -7.207
  344   2HB   TYR  45          HB1       TYR  45   4.011   3.989  -8.319
  345    HD1  TYR  45           HD1      TYR  45   4.827   3.216  -4.728
  346    HD2  TYR  45           HD2      TYR  45   6.209   4.704  -8.512
  347    HE1  TYR  45           HE1      TYR  45   7.072   3.611  -3.752
  348    HE2  TYR  45           HE2      TYR  45   8.453   5.102  -7.537
  349    HH   TYR  45           HH       TYR  45   9.551   3.749  -4.843
  350    H    ASP  46           HN       ASP  46   4.611   5.900  -5.150
  351    HA   ASP  46           HA       ASP  46   4.178   8.393  -6.750
  352   1HB   ASP  46          HB2       ASP  46   4.233   8.211  -3.715
  353   2HB   ASP  46          HB1       ASP  46   3.965   9.666  -4.670
  354    H    ASP  47           HN       ASP  47   6.112   9.353  -7.250
  355    HA   ASP  47           HA       ASP  47   8.622   8.171  -6.343
  356   1HB   ASP  47          HB2       ASP  47   8.183   9.044  -8.626
  357   2HB   ASP  47          HB1       ASP  47   8.017  10.669  -7.959
  358    H    ALA  48           HN       ALA  48   6.562  10.398  -4.867
  359    HA   ALA  48           HA       ALA  48   8.267  12.455  -3.903
  360   1HB   ALA  48          HB1       ALA  48   5.742  11.081  -3.060
  361   2HB   ALA  48          HB2       ALA  48   6.008  12.778  -3.468
  362   3HB   ALA  48          HB3       ALA  48   6.518  12.159  -1.897
  363    H    THR  49           HN       THR  49   7.133   9.762  -1.864
  364    HA   THR  49           HA       THR  49   9.911   9.428  -0.792
  365    HB   THR  49           HB       THR  49   8.550  10.900   0.668
  366    HG1  THR  49           HG1      THR  49   9.311   9.903   2.348
  367   1HG2  THR  49          HG21      THR  49   6.325  10.147   0.043
  368   2HG2  THR  49          HG22      THR  49   6.532   9.908   1.779
  369   3HG2  THR  49          HG23      THR  49   6.658   8.535   0.677
  370    H    LYS  50           HN       LYS  50   8.505   7.816  -2.737
  371    HA   LYS  50           HA       LYS  50   7.990   5.575  -3.187
  372   1HB   LYS  50          HB2       LYS  50   9.346   5.200  -0.495
  373   2HB   LYS  50          HB1       LYS  50   9.103   3.946  -1.708
  374   1HG   LYS  50          HG2       LYS  50  10.465   5.260  -3.316
  375   2HG   LYS  50          HG1       LYS  50  10.753   6.466  -2.061
  376   1HD   LYS  50          HD2       LYS  50  11.353   3.637  -1.356
  377   2HD   LYS  50          HD1       LYS  50  12.443   4.416  -2.503
  378   1HE   LYS  50          HE2       LYS  50  11.663   5.817   0.057
  379   2HE   LYS  50          HE1       LYS  50  13.008   4.660   0.021
  380   1HZ   LYS  50          HZ1       LYS  50  12.685   6.972  -1.819
  381   2HZ   LYS  50          HZ2       LYS  50  13.977   5.868  -1.820
  382   3HZ   LYS  50          HZ3       LYS  50  13.754   6.919  -0.504
  383    H    THR  51           HN       THR  51   5.758   6.768  -2.480
  384    HA   THR  51           HA       THR  51   4.529   5.258  -0.208
  385    HB   THR  51           HB       THR  51   3.427   7.591  -1.806
  386    HG1  THR  51           HG1      THR  51   4.865   7.685   0.630
  387   1HG2  THR  51          HG21      THR  51   2.502   7.830   0.742
  388   2HG2  THR  51          HG22      THR  51   2.628   6.076   0.608
  389   3HG2  THR  51          HG23      THR  51   1.636   6.979  -0.537
  390    H    TRP  52           HN       TRP  52   2.098   4.704  -0.736
  391    HA   TRP  52           HA       TRP  52   1.767   3.838  -3.579
  392   1HB   TRP  52          HB2       TRP  52   1.792   2.215  -1.043
  393   2HB   TRP  52          HB1       TRP  52   0.898   1.666  -2.453
  394    HD1  TRP  52           HD1      TRP  52   4.402   2.049  -1.111
  395    HE1  TRP  52           HE1      TRP  52   6.063   1.010  -2.795
  396    HE3  TRP  52           HE3      TRP  52   1.252   1.218  -4.988
  397    HZ2  TRP  52           HZ2      TRP  52   6.032  -0.048  -5.469
  398    HZ3  TRP  52           HZ3      TRP  52   2.064   0.191  -7.104
  399    HH2  TRP  52           HH2      TRP  52   4.452  -0.443  -7.344
  400    H    THR  53           HN       THR  53  -0.584   2.544  -3.448
  401    HA   THR  53           HA       THR  53  -2.528   3.940  -1.736
  402    HB   THR  53           HB       THR  53  -2.721   4.215  -4.743
  403    HG1  THR  53           HG1      THR  53  -1.636   6.030  -2.854
  404   1HG2  THR  53          HG21      THR  53  -4.819   4.661  -3.829
  405   2HG2  THR  53          HG22      THR  53  -4.091   6.267  -3.856
  406   3HG2  THR  53          HG23      THR  53  -4.140   5.346  -2.353
  407    H    VAL  54           HN       VAL  54  -4.826   3.160  -2.387
  408    HA   VAL  54           HA       VAL  54  -5.126   0.742  -3.960
  409    HB   VAL  54           HB       VAL  54  -3.850  -0.277  -2.183
  410   1HG1  VAL  54          HG11      VAL  54  -4.062   1.553  -0.560
  411   2HG1  VAL  54          HG12      VAL  54  -4.428  -0.001   0.186
  412   3HG1  VAL  54          HG13      VAL  54  -5.735   1.094  -0.258
  413   1HG2  VAL  54          HG21      VAL  54  -5.273  -1.988  -1.560
  414   2HG2  VAL  54          HG22      VAL  54  -6.268  -1.235  -2.814
  415   3HG2  VAL  54          HG23      VAL  54  -6.576  -0.881  -1.114
  416    H    THR  55           HN       THR  55  -6.836   2.343  -4.588
  417    HA   THR  55           HA       THR  55  -8.996   2.941  -2.701
  418    HB   THR  55           HB       THR  55  -9.054   3.169  -5.715
  419    HG1  THR  55           HG1      THR  55  -7.271   4.258  -5.465
  420   1HG2  THR  55          HG21      THR  55 -10.286   4.629  -3.381
  421   2HG2  THR  55          HG22      THR  55 -11.097   3.860  -4.746
  422   3HG2  THR  55          HG23      THR  55 -10.203   5.362  -4.983
  423    H    GLU  56           HN       GLU  56 -10.923   1.810  -2.493
  424    HA   GLU  56           HA       GLU  56 -11.153  -0.909  -3.315
  425   1HB   GLU  56          HB2       GLU  56 -12.428   0.801  -1.605
  426   2HB   GLU  56          HB1       GLU  56 -13.646   0.632  -2.869
  427   1HG   GLU  56          HG2       GLU  56 -12.324  -1.877  -1.980
  428   2HG   GLU  56          HG1       GLU  56 -13.412  -1.116  -0.819
  Start of MODEL    9
    1   1H    THR   1          HT1       THR   1  14.792   3.541   5.557
    2   2H    THR   1          HT2       THR   1  16.063   3.369   4.443
    3   3H    THR   1          HT3       THR   1  15.224   2.000   4.998
    4    HA   THR   1           HA       THR   1  14.040   4.177   3.347
    5    HB   THR   1           HB       THR   1  14.701   1.317   2.611
    6    HG1  THR   1           HG1      THR   1  16.690   1.906   2.450
    7   1HG2  THR   1          HG21      THR   1  14.529   3.666   0.752
    8   2HG2  THR   1          HG22      THR   1  13.047   2.907   1.332
    9   3HG2  THR   1          HG23      THR   1  14.225   1.960   0.422
   10    H    THR   2           HN       THR   2  11.918   4.284   3.983
   11    HA   THR   2           HA       THR   2  10.496   1.711   4.597
   12    HB   THR   2           HB       THR   2   9.853   4.461   5.688
   13    HG1  THR   2           HG1      THR   2  11.427   2.435   6.891
   14   1HG2  THR   2          HG21      THR   2   8.532   3.301   7.270
   15   2HG2  THR   2          HG22      THR   2   9.313   1.759   6.916
   16   3HG2  THR   2          HG23      THR   2   8.206   2.477   5.745
   17    H    PHE   3           HN       PHE   3   8.874   1.291   3.161
   18    HA   PHE   3           HA       PHE   3   8.051   3.300   1.186
   19   1HB   PHE   3          HB2       PHE   3   7.199   0.443   1.772
   20   2HB   PHE   3          HB1       PHE   3   6.725   1.356   0.339
   21    HD1  PHE   3           HD1      PHE   3   8.975   2.708  -0.649
   22    HD2  PHE   3           HD2      PHE   3   8.885  -1.111   1.326
   23    HE1  PHE   3           HE1      PHE   3  11.107   2.085  -1.751
   24    HE2  PHE   3           HE2      PHE   3  11.016  -1.729   0.222
   25    HZ   PHE   3           HZ       PHE   3  12.128  -0.132  -1.315
   26    H    LYS   4           HN       LYS   4   5.615   3.597   0.800
   27    HA   LYS   4           HA       LYS   4   4.047   3.564   3.353
   28   1HB   LYS   4          HB2       LYS   4   5.321   5.757   2.670
   29   2HB   LYS   4          HB1       LYS   4   4.035   5.918   1.477
   30   1HG   LYS   4          HG2       LYS   4   2.392   5.590   3.406
   31   2HG   LYS   4          HG1       LYS   4   3.768   5.810   4.483
   32   1HD   LYS   4          HD2       LYS   4   3.301   8.022   4.338
   33   2HD   LYS   4          HD1       LYS   4   4.067   7.928   2.752
   34   1HE   LYS   4          HE2       LYS   4   1.658   7.165   1.965
   35   2HE   LYS   4          HE1       LYS   4   1.144   8.010   3.437
   36   1HZ   LYS   4          HZ1       LYS   4   1.279   9.557   1.588
   37   2HZ   LYS   4          HZ2       LYS   4   2.898   9.124   1.310
   38   3HZ   LYS   4          HZ3       LYS   4   2.464   9.925   2.744
   39    H    LEU   5           HN       LEU   5   1.773   3.444   3.036
   40    HA   LEU   5           HA       LEU   5   0.700   3.423   0.270
   41   1HB   LEU   5          HB2       LEU   5   1.613   1.095   1.207
   42   2HB   LEU   5          HB1       LEU   5   0.068   1.090   2.043
   43    HG   LEU   5           HG       LEU   5  -0.246   1.880  -0.749
   44   1HD1  LEU   5          HD11      LEU   5   0.475  -0.034  -1.883
   45   2HD1  LEU   5          HD12      LEU   5   0.539  -1.004  -0.402
   46   3HD1  LEU   5          HD13      LEU   5   1.783   0.211  -0.718
   47   1HD2  LEU   5          HD21      LEU   5  -1.802  -0.218  -0.553
   48   2HD2  LEU   5          HD22      LEU   5  -2.196   1.234   0.370
   49   3HD2  LEU   5          HD23      LEU   5  -1.407  -0.130   1.164
   50    H    ILE   6           HN       ILE   6  -1.334   4.303   0.290
   51    HA   ILE   6           HA       ILE   6  -2.629   4.780   2.940
   52    HB   ILE   6           HB       ILE   6  -2.838   6.049   0.196
   53   1HG1  ILE   6          HG12      ILE   6  -0.772   6.526   1.471
   54   2HG1  ILE   6          HG11      ILE   6  -1.771   7.970   1.305
   55   1HG2  ILE   6          HG21      ILE   6  -5.014   6.307   1.126
   56   2HG2  ILE   6          HG22      ILE   6  -4.180   7.821   1.480
   57   3HG2  ILE   6          HG23      ILE   6  -4.371   6.603   2.742
   58   1HD1  ILE   6          HD11      ILE   6  -2.743   7.405   3.593
   59   2HD1  ILE   6          HD12      ILE   6  -1.051   7.902   3.592
   60   3HD1  ILE   6          HD13      ILE   6  -1.468   6.196   3.737
   61    H    ILE   7           HN       ILE   7  -4.446   3.627   3.416
   62    HA   ILE   7           HA       ILE   7  -5.617   1.780   1.479
   63    HB   ILE   7           HB       ILE   7  -6.465   2.590   4.281
   64   1HG1  ILE   7          HG12      ILE   7  -4.791   0.211   3.420
   65   2HG1  ILE   7          HG11      ILE   7  -4.095   1.711   4.035
   66   1HG2  ILE   7          HG21      ILE   7  -6.959  -0.119   3.140
   67   2HG2  ILE   7          HG22      ILE   7  -7.961   1.197   2.530
   68   3HG2  ILE   7          HG23      ILE   7  -7.945   0.828   4.254
   69   1HD1  ILE   7          HD11      ILE   7  -5.806  -0.302   5.478
   70   2HD1  ILE   7          HD12      ILE   7  -5.730   1.369   6.038
   71   3HD1  ILE   7          HD13      ILE   7  -4.262   0.393   5.971
   72    H    ASN   8           HN       ASN   8  -6.912   2.672  -0.101
   73    HA   ASN   8           HA       ASN   8  -8.729   4.929   0.610
   74   1HB   ASN   8          HB2       ASN   8  -7.565   3.749  -1.906
   75   2HB   ASN   8          HB1       ASN   8  -8.985   4.789  -2.001
   76   1HD2  ASN   8          HD21      ASN   8  -7.231   6.145  -3.252
   77   2HD2  ASN   8          HD22      ASN   8  -6.322   7.240  -2.311
   78    H    GLY   9           HN       GLY   9  -9.585   2.613   1.772
   79   1HA   GLY   9          HA2       GLY   9 -11.462   1.222  -0.026
   80   2HA   GLY   9          HA1       GLY   9 -11.206   0.863   1.687
   81    H    LYS  10           HN       LYS  10 -13.727   1.408   0.120
   82    HA   LYS  10           HA       LYS  10 -14.866   3.920   0.668
   83   1HB   LYS  10          HB2       LYS  10 -16.104   1.151   0.653
   84   2HB   LYS  10          HB1       LYS  10 -17.010   2.658   0.501
   85   1HG   LYS  10          HG2       LYS  10 -15.394   3.166  -1.475
   86   2HG   LYS  10          HG1       LYS  10 -15.054   1.435  -1.437
   87   1HD   LYS  10          HD2       LYS  10 -17.171   0.861  -2.141
   88   2HD   LYS  10          HD1       LYS  10 -17.918   2.268  -1.384
   89   1HE   LYS  10          HE2       LYS  10 -18.050   2.858  -3.648
   90   2HE   LYS  10          HE1       LYS  10 -16.492   3.587  -3.208
   91   1HZ   LYS  10          HZ1       LYS  10 -16.209   2.210  -5.154
   92   2HZ   LYS  10          HZ2       LYS  10 -16.907   0.878  -4.362
   93   3HZ   LYS  10          HZ3       LYS  10 -15.410   1.492  -3.842
   94    H    THR  11           HN       THR  11 -14.835   0.996   2.731
   95    HA   THR  11           HA       THR  11 -16.008   2.555   4.974
   96    HB   THR  11           HB       THR  11 -15.807   0.030   5.873
   97    HG1  THR  11           HG1      THR  11 -15.569  -1.396   4.343
   98   1HG2  THR  11          HG21      THR  11 -18.061  -0.353   4.658
   99   2HG2  THR  11          HG22      THR  11 -17.818   1.271   4.013
  100   3HG2  THR  11          HG23      THR  11 -17.935   1.022   5.755
  101    H    LEU  12           HN       LEU  12 -13.147   0.578   4.163
  102    HA   LEU  12           HA       LEU  12 -11.867   1.303   6.747
  103   1HB   LEU  12          HB2       LEU  12 -11.159  -0.558   4.459
  104   2HB   LEU  12          HB1       LEU  12 -10.174  -0.368   5.910
  105    HG   LEU  12           HG       LEU  12 -13.082  -0.934   6.282
  106   1HD1  LEU  12          HD11      LEU  12 -12.924  -3.227   5.796
  107   2HD1  LEU  12          HD12      LEU  12 -11.161  -3.203   5.800
  108   3HD1  LEU  12          HD13      LEU  12 -12.050  -2.487   4.456
  109   1HD2  LEU  12          HD21      LEU  12 -12.286  -2.030   8.263
  110   2HD2  LEU  12          HD22      LEU  12 -11.364  -0.534   8.124
  111   3HD2  LEU  12          HD23      LEU  12 -10.631  -2.068   7.655
  112    H    LYS  13           HN       LYS  13 -10.110   2.688   6.866
  113    HA   LYS  13           HA       LYS  13  -8.721   3.569   4.399
  114   1HB   LYS  13          HB2       LYS  13 -10.358   5.354   6.230
  115   2HB   LYS  13          HB1       LYS  13  -9.243   5.963   5.006
  116   1HG   LYS  13          HG2       LYS  13 -10.553   4.526   3.328
  117   2HG   LYS  13          HG1       LYS  13 -11.776   4.371   4.589
  118   1HD   LYS  13          HD2       LYS  13 -11.398   7.045   4.667
  119   2HD   LYS  13          HD1       LYS  13 -11.017   6.746   2.971
  120   1HE   LYS  13          HE2       LYS  13 -13.214   5.374   2.910
  121   2HE   LYS  13          HE1       LYS  13 -13.606   6.199   4.431
  122   1HZ   LYS  13          HZ1       LYS  13 -12.720   7.590   1.960
  123   2HZ   LYS  13          HZ2       LYS  13 -13.263   8.312   3.399
  124   3HZ   LYS  13          HZ3       LYS  13 -14.343   7.434   2.426
  125    H    GLY  14           HN       GLY  14  -6.943   5.231   5.094
  126   1HA   GLY  14          HA2       GLY  14  -5.856   5.975   7.359
  127   2HA   GLY  14          HA1       GLY  14  -5.721   4.236   7.615
  128    H    GLU  15           HN       GLU  15  -3.396   4.433   7.641
  129    HA   GLU  15           HA       GLU  15  -2.215   4.474   4.908
  130   1HB   GLU  15          HB2       GLU  15  -0.448   6.023   5.722
  131   2HB   GLU  15          HB1       GLU  15  -2.046   6.759   5.818
  132   1HG   GLU  15          HG2       GLU  15  -1.376   7.256   7.950
  133   2HG   GLU  15          HG1       GLU  15  -1.922   5.611   8.272
  134    H    THR  16           HN       THR  16   0.057   3.567   4.961
  135    HA   THR  16           HA       THR  16   0.877   2.101   7.380
  136    HB   THR  16           HB       THR  16  -0.911   0.689   6.463
  137    HG1  THR  16           HG1      THR  16   0.318  -1.178   6.256
  138   1HG2  THR  16          HG21      THR  16   0.724   0.886   3.919
  139   2HG2  THR  16          HG22      THR  16  -0.964   1.344   4.161
  140   3HG2  THR  16          HG23      THR  16  -0.502  -0.357   4.180
  141    H    THR  17           HN       THR  17   3.017   1.230   7.177
  142    HA   THR  17           HA       THR  17   4.464   1.802   4.620
  143    HB   THR  17           HB       THR  17   6.240   2.879   5.958
  144    HG1  THR  17           HG1      THR  17   5.989   1.873   7.905
  145   1HG2  THR  17          HG21      THR  17   5.194   4.892   5.900
  146   2HG2  THR  17          HG22      THR  17   3.924   4.365   7.004
  147   3HG2  THR  17          HG23      THR  17   3.813   3.985   5.286
  148    H    THR  18           HN       THR  18   6.493   0.572   4.455
  149    HA   THR  18           HA       THR  18   6.889  -1.563   6.473
  150    HB   THR  18           HB       THR  18   5.636  -1.796   3.832
  151    HG1  THR  18           HG1      THR  18   5.355  -3.983   4.789
  152   1HG2  THR  18          HG21      THR  18   7.914  -2.385   3.087
  153   2HG2  THR  18          HG22      THR  18   6.840  -3.786   3.044
  154   3HG2  THR  18          HG23      THR  18   8.016  -3.614   4.348
  155    H    GLU  19           HN       GLU  19   9.003  -2.751   5.951
  156    HA   GLU  19           HA       GLU  19  10.982  -0.900   4.658
  157   1HB   GLU  19          HB2       GLU  19  11.044  -0.944   7.150
  158   2HB   GLU  19          HB1       GLU  19  11.297  -2.689   7.093
  159   1HG   GLU  19          HG2       GLU  19  13.271  -1.903   5.424
  160   2HG   GLU  19          HG1       GLU  19  13.187  -0.482   6.466
  161    H    ALA  20           HN       ALA  20  11.727  -1.917   2.828
  162    HA   ALA  20           HA       ALA  20  12.588  -4.752   2.997
  163   1HB   ALA  20          HB1       ALA  20  10.340  -3.636   1.324
  164   2HB   ALA  20          HB2       ALA  20  10.341  -5.074   2.347
  165   3HB   ALA  20          HB3       ALA  20  11.209  -5.083   0.811
  166    H    VAL  21           HN       VAL  21  13.518  -5.379   0.725
  167    HA   VAL  21           HA       VAL  21  15.675  -3.658   0.052
  168    HB   VAL  21           HB       VAL  21  15.919  -5.205  -1.878
  169   1HG1  VAL  21          HG11      VAL  21  15.496  -7.381  -0.350
  170   2HG1  VAL  21          HG12      VAL  21  15.364  -6.138   0.894
  171   3HG1  VAL  21          HG13      VAL  21  16.837  -6.272  -0.067
  172   1HG2  VAL  21          HG21      VAL  21  13.749  -5.564  -2.714
  173   2HG2  VAL  21          HG22      VAL  21  13.079  -5.894  -1.118
  174   3HG2  VAL  21          HG23      VAL  21  14.107  -7.089  -1.907
  175    H    ASP  22           HN       ASP  22  12.482  -4.039  -1.474
  176    HA   ASP  22           HA       ASP  22  12.774  -1.371  -2.739
  177   1HB   ASP  22          HB2       ASP  22  12.217  -3.954  -4.241
  178   2HB   ASP  22          HB1       ASP  22  12.186  -2.341  -4.952
  179    H    ALA  23           HN       ALA  23  10.640  -0.619  -3.582
  180    HA   ALA  23           HA       ALA  23   8.471  -1.163  -1.794
  181   1HB   ALA  23          HB1       ALA  23   7.236   0.027  -3.828
  182   2HB   ALA  23          HB2       ALA  23   8.886   0.264  -4.402
  183   3HB   ALA  23          HB3       ALA  23   8.392   0.920  -2.841
  184    H    ALA  24           HN       ALA  24   9.427  -2.618  -4.848
  185    HA   ALA  24           HA       ALA  24   6.978  -3.890  -5.584
  186   1HB   ALA  24          HB1       ALA  24   9.326  -3.649  -6.745
  187   2HB   ALA  24          HB2       ALA  24   8.357  -5.087  -7.069
  188   3HB   ALA  24          HB3       ALA  24   9.690  -5.162  -5.916
  189    H    THR  25           HN       THR  25   9.666  -5.010  -3.517
  190    HA   THR  25           HA       THR  25   8.490  -7.563  -2.854
  191    HB   THR  25           HB       THR  25  10.615  -5.786  -1.609
  192    HG1  THR  25           HG1      THR  25  11.837  -6.776  -2.973
  193   1HG2  THR  25          HG21      THR  25   9.613  -7.259   0.134
  194   2HG2  THR  25          HG22      THR  25  11.285  -7.697  -0.233
  195   3HG2  THR  25          HG23      THR  25   9.958  -8.659  -0.886
  196    H    ALA  26           HN       ALA  26   8.669  -4.449  -1.066
  197    HA   ALA  26           HA       ALA  26   7.181  -5.263   1.215
  198   1HB   ALA  26          HB1       ALA  26   8.401  -3.204   1.244
  199   2HB   ALA  26          HB2       ALA  26   6.701  -2.731   1.326
  200   3HB   ALA  26          HB3       ALA  26   7.582  -2.615  -0.203
  201    H    GLU  27           HN       GLU  27   6.018  -3.409  -1.617
  202    HA   GLU  27           HA       GLU  27   3.326  -3.181  -1.138
  203   1HB   GLU  27          HB2       GLU  27   4.600  -2.400  -3.128
  204   2HB   GLU  27          HB1       GLU  27   4.619  -4.053  -3.744
  205   1HG   GLU  27          HG2       GLU  27   1.992  -3.850  -3.377
  206   2HG   GLU  27          HG1       GLU  27   2.338  -2.129  -3.549
  207    H    LYS  28           HN       LYS  28   4.939  -6.195  -2.161
  208    HA   LYS  28           HA       LYS  28   2.554  -7.732  -2.679
  209   1HB   LYS  28          HB2       LYS  28   5.296  -8.548  -1.632
  210   2HB   LYS  28          HB1       LYS  28   4.114  -9.647  -2.342
  211   1HG   LYS  28          HG2       LYS  28   4.409  -8.799  -4.487
  212   2HG   LYS  28          HG1       LYS  28   4.970  -7.233  -3.901
  213   1HD   LYS  28          HD2       LYS  28   7.009  -8.102  -4.522
  214   2HD   LYS  28          HD1       LYS  28   6.928  -8.774  -2.893
  215   1HE   LYS  28          HE2       LYS  28   6.065 -10.888  -3.747
  216   2HE   LYS  28          HE1       LYS  28   5.967 -10.220  -5.389
  217   1HZ   LYS  28          HZ1       LYS  28   8.055 -11.489  -4.901
  218   2HZ   LYS  28          HZ2       LYS  28   8.471 -10.266  -3.797
  219   3HZ   LYS  28          HZ3       LYS  28   8.300  -9.903  -5.448
  220    H    VAL  29           HN       VAL  29   4.551  -7.239   0.226
  221    HA   VAL  29           HA       VAL  29   2.929  -8.857   2.007
  222    HB   VAL  29           HB       VAL  29   5.003  -6.658   2.284
  223   1HG1  VAL  29          HG11      VAL  29   3.456  -6.466   4.222
  224   2HG1  VAL  29          HG12      VAL  29   5.051  -7.050   4.711
  225   3HG1  VAL  29          HG13      VAL  29   3.704  -8.181   4.570
  226   1HG2  VAL  29          HG21      VAL  29   6.085  -8.632   1.704
  227   2HG2  VAL  29          HG22      VAL  29   4.909  -9.644   2.543
  228   3HG2  VAL  29          HG23      VAL  29   6.113  -8.743   3.464
  229    H    LEU  30           HN       LEU  30   2.955  -5.420   1.055
  230    HA   LEU  30           HA       LEU  30   1.018  -4.536   2.973
  231   1HB   LEU  30          HB2       LEU  30   1.996  -3.592   0.270
  232   2HB   LEU  30          HB1       LEU  30   0.742  -2.708   1.122
  233    HG   LEU  30           HG       LEU  30   3.262  -2.010   1.407
  234   1HD1  LEU  30          HD11      LEU  30   2.806  -1.358   3.795
  235   2HD1  LEU  30          HD12      LEU  30   1.305  -2.288   3.686
  236   3HD1  LEU  30          HD13      LEU  30   1.554  -0.889   2.638
  237   1HD2  LEU  30          HD21      LEU  30   4.204  -3.032   3.514
  238   2HD2  LEU  30          HD22      LEU  30   4.293  -4.029   2.079
  239   3HD2  LEU  30          HD23      LEU  30   3.072  -4.352   3.306
  240    H    LYS  31           HN       LYS  31   0.796  -6.040  -0.204
  241    HA   LYS  31           HA       LYS  31  -2.018  -5.680  -0.709
  242   1HB   LYS  31          HB2       LYS  31   0.039  -6.697  -2.094
  243   2HB   LYS  31          HB1       LYS  31  -0.514  -8.195  -1.385
  244   1HG   LYS  31          HG2       LYS  31  -2.424  -6.330  -2.795
  245   2HG   LYS  31          HG1       LYS  31  -1.510  -7.551  -3.677
  246   1HD   LYS  31          HD2       LYS  31  -3.407  -8.074  -1.365
  247   2HD   LYS  31          HD1       LYS  31  -3.721  -8.431  -3.062
  248   1HE   LYS  31          HE2       LYS  31  -1.231  -9.644  -2.490
  249   2HE   LYS  31          HE1       LYS  31  -2.291 -10.037  -1.116
  250   1HZ   LYS  31          HZ1       LYS  31  -4.031 -10.650  -2.715
  251   2HZ   LYS  31          HZ2       LYS  31  -2.647 -11.617  -2.902
  252   3HZ   LYS  31          HZ3       LYS  31  -2.963 -10.359  -3.999
  253    H    GLN  32           HN       GLN  32  -0.127  -8.198   0.926
  254    HA   GLN  32           HA       GLN  32  -2.194  -9.994   1.656
  255   1HB   GLN  32          HB2       GLN  32   0.517  -9.237   2.596
  256   2HB   GLN  32          HB1       GLN  32  -0.480 -10.160   3.721
  257   1HG   GLN  32          HG2       GLN  32  -0.731 -11.964   2.188
  258   2HG   GLN  32          HG1       GLN  32  -0.108 -11.003   0.847
  259   1HE2  GLN  32          HE21      GLN  32   2.045 -11.415   0.358
  260   2HE2  GLN  32          HE22      GLN  32   3.205 -12.003   1.462
  261    H    TYR  33           HN       TYR  33  -1.018  -7.044   3.261
  262    HA   TYR  33           HA       TYR  33  -2.690  -7.178   5.612
  263   1HB   TYR  33          HB2       TYR  33  -0.721  -5.730   5.402
  264   2HB   TYR  33          HB1       TYR  33  -1.465  -4.866   4.056
  265    HD1  TYR  33           HD1      TYR  33  -1.769  -5.628   7.666
  266    HD2  TYR  33           HD2      TYR  33  -3.035  -3.110   4.430
  267    HE1  TYR  33           HE1      TYR  33  -2.897  -4.137   9.276
  268    HE2  TYR  33           HE2      TYR  33  -4.160  -1.605   6.044
  269    HH   TYR  33           HH       TYR  33  -4.041  -1.026   8.416
  270    H    ILE  34           HN       ILE  34  -3.097  -5.787   2.380
  271    HA   ILE  34           HA       ILE  34  -5.674  -4.556   2.815
  272    HB   ILE  34           HB       ILE  34  -4.276  -5.617   0.338
  273   1HG1  ILE  34          HG12      ILE  34  -3.128  -3.855   1.853
  274   2HG1  ILE  34          HG11      ILE  34  -3.232  -3.509   0.134
  275   1HG2  ILE  34          HG21      ILE  34  -6.671  -5.266  -0.074
  276   2HG2  ILE  34          HG22      ILE  34  -5.712  -4.051  -0.919
  277   3HG2  ILE  34          HG23      ILE  34  -6.552  -3.629   0.573
  278   1HD1  ILE  34          HD11      ILE  34  -4.895  -1.890   0.443
  279   2HD1  ILE  34          HD12      ILE  34  -3.879  -1.653   1.866
  280   3HD1  ILE  34          HD13      ILE  34  -5.391  -2.553   2.000
  281    H    ASN  35           HN       ASN  35  -4.608  -7.813   2.019
  282    HA   ASN  35           HA       ASN  35  -7.001  -8.928   0.962
  283   1HB   ASN  35          HB2       ASN  35  -4.664  -9.911   1.104
  284   2HB   ASN  35          HB1       ASN  35  -4.991 -10.263   2.801
  285   1HD2  ASN  35          HD21      ASN  35  -4.559 -12.256   0.639
  286   2HD2  ASN  35          HD22      ASN  35  -5.977 -13.186   0.563
  287    H    ASP  36           HN       ASP  36  -6.084  -8.139   4.267
  288    HA   ASP  36           HA       ASP  36  -8.244  -9.671   5.518
  289   1HB   ASP  36          HB2       ASP  36  -6.288  -7.543   6.435
  290   2HB   ASP  36          HB1       ASP  36  -7.430  -8.333   7.524
  291    H    ASN  37           HN       ASN  37  -7.578  -6.175   5.074
  292    HA   ASN  37           HA       ASN  37 -10.078  -5.223   6.085
  293   1HB   ASN  37          HB2       ASN  37  -8.144  -4.105   4.026
  294   2HB   ASN  37          HB1       ASN  37  -9.423  -3.167   4.806
  295   1HD2  ASN  37          HD21      ASN  37  -6.346  -3.022   5.016
  296   2HD2  ASN  37          HD22      ASN  37  -6.050  -3.074   6.695
  297    H    GLY  38           HN       GLY  38  -9.132  -6.466   2.929
  298   1HA   GLY  38          HA2       GLY  38 -10.564  -7.268   1.217
  299   2HA   GLY  38          HA1       GLY  38 -11.947  -6.667   2.132
  300    H    ILE  39           HN       ILE  39  -9.169  -4.652   1.380
  301    HA   ILE  39           HA       ILE  39 -10.933  -3.013  -0.409
  302    HB   ILE  39           HB       ILE  39  -8.558  -2.264   1.333
  303   1HG1  ILE  39          HG12      ILE  39 -10.560  -2.862   2.646
  304   2HG1  ILE  39          HG11      ILE  39 -10.255  -1.125   2.734
  305   1HG2  ILE  39          HG21      ILE  39 -10.406  -0.618  -0.411
  306   2HG2  ILE  39          HG22      ILE  39  -8.651  -0.746  -0.524
  307   3HG2  ILE  39          HG23      ILE  39  -9.389   0.086   0.845
  308   1HD1  ILE  39          HD11      ILE  39 -11.907  -0.877   0.795
  309   2HD1  ILE  39          HD12      ILE  39 -12.603  -1.352   2.345
  310   3HD1  ILE  39          HD13      ILE  39 -12.350  -2.560   1.085
  311    H    ASP  40           HN       ASP  40 -10.119  -4.620  -2.122
  312    HA   ASP  40           HA       ASP  40  -7.397  -3.827  -3.112
  313   1HB   ASP  40          HB2       ASP  40  -8.919  -6.390  -2.924
  314   2HB   ASP  40          HB1       ASP  40  -7.874  -6.176  -4.333
  315    H    GLY  41           HN       GLY  41  -7.714  -2.374  -4.767
  316   1HA   GLY  41          HA2       GLY  41  -9.599  -3.138  -6.934
  317   2HA   GLY  41          HA1       GLY  41  -9.769  -1.533  -6.216
  318    H    GLU  42           HN       GLU  42  -7.986  -0.022  -6.466
  319    HA   GLU  42           HA       GLU  42  -6.051  -0.748  -8.641
  320   1HB   GLU  42          HB2       GLU  42  -8.251   1.156  -8.589
  321   2HB   GLU  42          HB1       GLU  42  -6.725   1.988  -8.882
  322   1HG   GLU  42          HG2       GLU  42  -7.050   1.379 -11.045
  323   2HG   GLU  42          HG1       GLU  42  -6.459  -0.196 -10.517
  324    H    TRP  43           HN       TRP  43  -4.001  -0.443  -7.887
  325    HA   TRP  43           HA       TRP  43  -3.530   1.423  -5.608
  326   1HB   TRP  43          HB2       TRP  43  -1.896  -0.744  -6.967
  327   2HB   TRP  43          HB1       TRP  43  -1.268   0.267  -5.680
  328    HD1  TRP  43           HD1      TRP  43  -4.877  -1.066  -5.557
  329    HE1  TRP  43           HE1      TRP  43  -5.041  -2.749  -3.629
  330    HE3  TRP  43           HE3      TRP  43   0.019  -1.304  -4.201
  331    HZ2  TRP  43           HZ2      TRP  43  -3.332  -4.000  -1.722
  332    HZ3  TRP  43           HZ3      TRP  43   0.726  -2.736  -2.297
  333    HH2  TRP  43           HH2      TRP  43  -0.937  -4.079  -1.062
  334    H    THR  44           HN       THR  44  -1.569   2.832  -5.785
  335    HA   THR  44           HA       THR  44  -0.617   3.431  -8.527
  336    HB   THR  44           HB       THR  44  -1.242   5.804  -8.298
  337    HG1  THR  44           HG1      THR  44  -2.704   6.290  -6.535
  338   1HG2  THR  44          HG21      THR  44  -3.701   4.151  -7.714
  339   2HG2  THR  44          HG22      THR  44  -2.837   4.028  -9.247
  340   3HG2  THR  44          HG23      THR  44  -3.558   5.563  -8.761
  341    H    TYR  45           HN       TYR  45   1.529   3.901  -8.419
  342    HA   TYR  45           HA       TYR  45   2.777   4.242  -5.748
  343   1HB   TYR  45          HB2       TYR  45   3.582   2.544  -7.360
  344   2HB   TYR  45          HB1       TYR  45   3.908   3.814  -8.538
  345    HD1  TYR  45           HD1      TYR  45   6.170   4.295  -8.741
  346    HD2  TYR  45           HD2      TYR  45   4.571   3.361  -4.866
  347    HE1  TYR  45           HE1      TYR  45   8.403   4.667  -7.730
  348    HE2  TYR  45           HE2      TYR  45   6.804   3.730  -3.855
  349    HH   TYR  45           HH       TYR  45   9.576   3.732  -5.472
  350    H    ASP  46           HN       ASP  46   4.479   5.962  -5.518
  351    HA   ASP  46           HA       ASP  46   4.149   8.291  -7.366
  352   1HB   ASP  46          HB2       ASP  46   4.049   8.411  -4.330
  353   2HB   ASP  46          HB1       ASP  46   3.857   9.768  -5.435
  354    H    ASP  47           HN       ASP  47   6.144   9.016  -7.954
  355    HA   ASP  47           HA       ASP  47   8.580   7.972  -6.788
  356   1HB   ASP  47          HB2       ASP  47   9.621   9.558  -8.401
  357   2HB   ASP  47          HB1       ASP  47   8.340   8.605  -9.150
  358    H    ALA  48           HN       ALA  48   6.503  10.492  -5.775
  359    HA   ALA  48           HA       ALA  48   8.206  12.538  -4.845
  360   1HB   ALA  48          HB1       ALA  48   6.320  12.548  -2.975
  361   2HB   ALA  48          HB2       ALA  48   5.592  11.317  -4.010
  362   3HB   ALA  48          HB3       ALA  48   5.914  12.931  -4.649
  363    H    THR  49           HN       THR  49   6.848  10.055  -2.675
  364    HA   THR  49           HA       THR  49   9.510   9.832  -1.316
  365    HB   THR  49           HB       THR  49   8.040  11.382  -0.091
  366    HG1  THR  49           HG1      THR  49   8.172  10.346   1.847
  367   1HG2  THR  49          HG21      THR  49   5.812  11.086  -0.084
  368   2HG2  THR  49          HG22      THR  49   6.009   9.586   0.821
  369   3HG2  THR  49          HG23      THR  49   6.012   9.558  -0.943
  370    H    LYS  50           HN       LYS  50   8.227   8.067  -3.262
  371    HA   LYS  50           HA       LYS  50   7.759   5.788  -3.580
  372   1HB   LYS  50          HB2       LYS  50   9.066   5.658  -0.841
  373   2HB   LYS  50          HB1       LYS  50   8.881   4.302  -1.953
  374   1HG   LYS  50          HG2       LYS  50  10.235   5.516  -3.640
  375   2HG   LYS  50          HG1       LYS  50  10.459   6.836  -2.491
  376   1HD   LYS  50          HD2       LYS  50  11.147   4.077  -1.579
  377   2HD   LYS  50          HD1       LYS  50  12.248   4.865  -2.710
  378   1HE   LYS  50          HE2       LYS  50  11.304   6.510  -0.405
  379   2HE   LYS  50          HE1       LYS  50  12.476   5.223  -0.055
  380   1HZ   LYS  50          HZ1       LYS  50  13.682   7.170  -0.705
  381   2HZ   LYS  50          HZ2       LYS  50  12.733   7.363  -2.101
  382   3HZ   LYS  50          HZ3       LYS  50  13.794   6.042  -1.966
  383    H    THR  51           HN       THR  51   5.534   7.211  -2.704
  384    HA   THR  51           HA       THR  51   4.308   5.661  -0.482
  385    HB   THR  51           HB       THR  51   3.368   8.018  -2.159
  386    HG1  THR  51           HG1      THR  51   3.963   9.205  -0.389
  387   1HG2  THR  51          HG21      THR  51   2.140   6.519   0.146
  388   2HG2  THR  51          HG22      THR  51   1.382   7.059  -1.351
  389   3HG2  THR  51          HG23      THR  51   1.786   8.230  -0.096
  390    H    TRP  52           HN       TRP  52   2.014   4.853  -0.918
  391    HA   TRP  52           HA       TRP  52   1.669   3.912  -3.743
  392   1HB   TRP  52          HB2       TRP  52   1.742   2.424  -1.126
  393   2HB   TRP  52          HB1       TRP  52   0.866   1.775  -2.508
  394    HD1  TRP  52           HD1      TRP  52   4.343   2.305  -1.169
  395    HE1  TRP  52           HE1      TRP  52   6.047   1.255  -2.804
  396    HE3  TRP  52           HE3      TRP  52   1.251   1.256  -5.040
  397    HZ2  TRP  52           HZ2      TRP  52   6.068   0.106  -5.440
  398    HZ3  TRP  52           HZ3      TRP  52   2.109   0.181  -7.113
  399    HH2  TRP  52           HH2      TRP  52   4.515  -0.396  -7.313
  400    H    THR  53           HN       THR  53  -0.641   2.560  -3.557
  401    HA   THR  53           HA       THR  53  -2.636   3.960  -1.910
  402    HB   THR  53           HB       THR  53  -2.805   4.140  -4.927
  403    HG1  THR  53           HG1      THR  53  -1.654   5.907  -4.865
  404   1HG2  THR  53          HG21      THR  53  -4.930   4.546  -4.075
  405   2HG2  THR  53          HG22      THR  53  -4.253   6.175  -4.097
  406   3HG2  THR  53          HG23      THR  53  -4.307   5.263  -2.589
  407    H    VAL  54           HN       VAL  54  -4.902   3.095  -2.536
  408    HA   VAL  54           HA       VAL  54  -5.129   0.630  -4.047
  409    HB   VAL  54           HB       VAL  54  -3.840  -0.305  -2.234
  410   1HG1  VAL  54          HG11      VAL  54  -4.424   0.019   0.119
  411   2HG1  VAL  54          HG12      VAL  54  -5.781   1.042  -0.348
  412   3HG1  VAL  54          HG13      VAL  54  -4.130   1.570  -0.663
  413   1HG2  VAL  54          HG21      VAL  54  -5.224  -2.033  -1.568
  414   2HG2  VAL  54          HG22      VAL  54  -6.215  -1.350  -2.863
  415   3HG2  VAL  54          HG23      VAL  54  -6.563  -0.949  -1.182
  416    H    THR  55           HN       THR  55  -6.876   2.146  -4.742
  417    HA   THR  55           HA       THR  55  -9.061   2.758  -2.886
  418    HB   THR  55           HB       THR  55  -9.130   2.904  -5.902
  419    HG1  THR  55           HG1      THR  55  -8.105   4.986  -5.570
  420   1HG2  THR  55          HG21      THR  55 -11.154   3.551  -4.707
  421   2HG2  THR  55          HG22      THR  55 -10.389   4.992  -5.378
  422   3HG2  THR  55          HG23      THR  55 -10.225   4.625  -3.660
  423    H    GLU  56           HN       GLU  56 -10.967   1.599  -2.664
  424    HA   GLU  56           HA       GLU  56 -11.097  -1.135  -3.642
  425   1HB   GLU  56          HB2       GLU  56 -12.000  -0.045  -1.469
  426   2HB   GLU  56          HB1       GLU  56 -13.361   0.481  -2.461
  427   1HG   GLU  56          HG2       GLU  56 -12.537  -2.389  -2.625
  428   2HG   GLU  56          HG1       GLU  56 -13.410  -1.859  -1.186
  Start of MODEL   10
    1   1H    THR   1          HT1       THR   1  13.541   7.609   3.892
    2   2H    THR   1          HT2       THR   1  12.552   6.765   2.798
    3   3H    THR   1          HT3       THR   1  14.041   6.107   3.284
    4    HA   THR   1           HA       THR   1  13.264   5.726   5.492
    5    HB   THR   1           HB       THR   1  12.076   7.875   5.630
    6    HG1  THR   1           HG1      THR   1  10.429   7.135   6.869
    7   1HG2  THR   1          HG21      THR   1  11.082   7.997   3.431
    8   2HG2  THR   1          HG22      THR   1   9.774   8.026   4.614
    9   3HG2  THR   1          HG23      THR   1  10.130   6.542   3.729
   10    H    THR   2           HN       THR   2  11.232   4.262   6.080
   11    HA   THR   2           HA       THR   2  11.166   2.054   4.266
   12    HB   THR   2           HB       THR   2  10.769   1.918   6.693
   13    HG1  THR   2           HG1      THR   2   9.597   0.252   6.282
   14   1HG2  THR   2          HG21      THR   2   9.168   3.099   7.800
   15   2HG2  THR   2          HG22      THR   2   7.988   2.903   6.505
   16   3HG2  THR   2          HG23      THR   2   9.233   4.147   6.383
   17    H    PHE   3           HN       PHE   3   8.998   1.172   3.383
   18    HA   PHE   3           HA       PHE   3   7.841   3.175   1.586
   19   1HB   PHE   3          HB2       PHE   3   7.273   0.232   2.084
   20   2HB   PHE   3          HB1       PHE   3   6.653   1.161   0.719
   21    HD1  PHE   3           HD1      PHE   3   8.755   2.740  -0.293
   22    HD2  PHE   3           HD2      PHE   3   9.027  -1.174   1.460
   23    HE1  PHE   3           HE1      PHE   3  10.866   2.332  -1.528
   24    HE2  PHE   3           HE2      PHE   3  11.137  -1.580   0.223
   25    HZ   PHE   3           HZ       PHE   3  12.057   0.173  -1.270
   26    H    LYS   4           HN       LYS   4   5.429   3.405   1.391
   27    HA   LYS   4           HA       LYS   4   3.922   2.913   3.923
   28   1HB   LYS   4          HB2       LYS   4   5.076   5.189   3.852
   29   2HB   LYS   4          HB1       LYS   4   4.024   5.583   2.502
   30   1HG   LYS   4          HG2       LYS   4   2.042   5.148   3.896
   31   2HG   LYS   4          HG1       LYS   4   3.086   4.750   5.259
   32   1HD   LYS   4          HD2       LYS   4   3.581   6.932   5.688
   33   2HD   LYS   4          HD1       LYS   4   3.652   7.355   3.978
   34   1HE   LYS   4          HE2       LYS   4   1.477   8.039   3.950
   35   2HE   LYS   4          HE1       LYS   4   0.939   6.646   4.910
   36   1HZ   LYS   4          HZ1       LYS   4   1.884   7.663   6.878
   37   2HZ   LYS   4          HZ2       LYS   4   0.761   8.722   6.169
   38   3HZ   LYS   4          HZ3       LYS   4   2.427   8.990   5.973
   39    H    LEU   5           HN       LEU   5   1.623   2.920   3.608
   40    HA   LEU   5           HA       LEU   5   0.542   3.359   0.887
   41   1HB   LEU   5          HB2       LEU   5   1.492   0.912   1.385
   42   2HB   LEU   5          HB1       LEU   5  -0.048   0.732   2.212
   43    HG   LEU   5           HG       LEU   5  -0.376   2.007  -0.399
   44   1HD1  LEU   5          HD11      LEU   5   0.411  -0.891  -0.564
   45   2HD1  LEU   5          HD12      LEU   5   1.658   0.360  -0.654
   46   3HD1  LEU   5          HD13      LEU   5   0.354   0.327  -1.848
   47   1HD2  LEU   5          HD21      LEU   5  -1.479  -0.481   0.939
   48   2HD2  LEU   5          HD22      LEU   5  -2.043   0.131  -0.616
   49   3HD2  LEU   5          HD23      LEU   5  -2.249   1.103   0.841
   50    H    ILE   6           HN       ILE   6  -1.536   4.147   1.064
   51    HA   ILE   6           HA       ILE   6  -2.794   4.126   3.775
   52    HB   ILE   6           HB       ILE   6  -3.103   5.871   1.315
   53   1HG1  ILE   6          HG12      ILE   6  -0.985   6.138   2.575
   54   2HG1  ILE   6          HG11      ILE   6  -2.001   7.572   2.709
   55   1HG2  ILE   6          HG21      ILE   6  -4.574   5.835   3.944
   56   2HG2  ILE   6          HG22      ILE   6  -5.227   6.005   2.314
   57   3HG2  ILE   6          HG23      ILE   6  -4.360   7.347   3.062
   58   1HD1  ILE   6          HD11      ILE   6  -1.802   7.381   4.949
   59   2HD1  ILE   6          HD12      ILE   6  -1.041   5.797   4.802
   60   3HD1  ILE   6          HD13      ILE   6  -2.799   5.930   4.842
   61    H    ILE   7           HN       ILE   7  -4.815   3.211   4.051
   62    HA   ILE   7           HA       ILE   7  -5.912   1.595   1.829
   63    HB   ILE   7           HB       ILE   7  -6.652   1.882   4.763
   64   1HG1  ILE   7          HG12      ILE   7  -5.156  -0.386   3.430
   65   2HG1  ILE   7          HG11      ILE   7  -4.320   0.994   4.142
   66   1HG2  ILE   7          HG21      ILE   7  -7.884  -0.207   4.452
   67   2HG2  ILE   7          HG22      ILE   7  -7.400  -0.269   2.757
   68   3HG2  ILE   7          HG23      ILE   7  -8.486   1.002   3.318
   69   1HD1  ILE   7          HD11      ILE   7  -5.859   0.451   6.224
   70   2HD1  ILE   7          HD12      ILE   7  -4.370  -0.455   5.958
   71   3HD1  ILE   7          HD13      ILE   7  -5.921  -1.151   5.490
   72    H    ASN   8           HN       ASN   8  -7.339   2.624   0.486
   73    HA   ASN   8           HA       ASN   8  -9.136   4.730   1.625
   74   1HB   ASN   8          HB2       ASN   8  -7.889   4.133  -1.040
   75   2HB   ASN   8          HB1       ASN   8  -9.390   5.056  -0.998
   76   1HD2  ASN   8          HD21      ASN   8  -7.230   6.450  -1.942
   77   2HD2  ASN   8          HD22      ASN   8  -6.647   7.549  -0.775
   78    H    GLY   9           HN       GLY   9  -9.938   2.204   2.283
   79   1HA   GLY   9          HA2       GLY   9 -11.748   1.117   0.244
   80   2HA   GLY   9          HA1       GLY   9 -11.551   0.505   1.891
   81    H    LYS  10           HN       LYS  10 -14.006   1.270   0.290
   82    HA   LYS  10           HA       LYS  10 -15.224   3.638   1.198
   83   1HB   LYS  10          HB2       LYS  10 -16.402   0.902   0.631
   84   2HB   LYS  10          HB1       LYS  10 -17.328   2.403   0.687
   85   1HG   LYS  10          HG2       LYS  10 -15.562   3.241  -1.064
   86   2HG   LYS  10          HG1       LYS  10 -15.282   1.520  -1.331
   87   1HD   LYS  10          HD2       LYS  10 -17.366   1.180  -2.244
   88   2HD   LYS  10          HD1       LYS  10 -18.118   2.436  -1.261
   89   1HE   LYS  10          HE2       LYS  10 -16.616   4.065  -2.696
   90   2HE   LYS  10          HE1       LYS  10 -16.611   2.714  -3.847
   91   1HZ   LYS  10          HZ1       LYS  10 -18.532   4.157  -4.199
   92   2HZ   LYS  10          HZ2       LYS  10 -19.031   3.905  -2.595
   93   3HZ   LYS  10          HZ3       LYS  10 -19.017   2.612  -3.697
   94    H    THR  11           HN       THR  11 -14.855   0.523   2.829
   95    HA   THR  11           HA       THR  11 -16.274   1.642   5.225
   96    HB   THR  11           HB       THR  11 -15.735  -1.263   4.576
   97    HG1  THR  11           HG1      THR  11 -17.380  -1.255   3.260
   98   1HG2  THR  11          HG21      THR  11 -17.275  -1.736   6.242
   99   2HG2  THR  11          HG22      THR  11 -18.110  -0.194   6.051
  100   3HG2  THR  11          HG23      THR  11 -16.557  -0.258   6.883
  101    H    LEU  12           HN       LEU  12 -13.359   0.032   4.049
  102    HA   LEU  12           HA       LEU  12 -12.190   0.115   6.805
  103   1HB   LEU  12          HB2       LEU  12 -11.475  -1.398   4.273
  104   2HB   LEU  12          HB1       LEU  12 -10.566  -1.507   5.781
  105    HG   LEU  12           HG       LEU  12 -13.525  -1.964   5.862
  106   1HD1  LEU  12          HD11      LEU  12 -12.653  -3.325   3.951
  107   2HD1  LEU  12          HD12      LEU  12 -13.237  -4.315   5.289
  108   3HD1  LEU  12          HD13      LEU  12 -11.505  -4.079   5.057
  109   1HD2  LEU  12          HD21      LEU  12 -12.970  -3.284   7.765
  110   2HD2  LEU  12          HD22      LEU  12 -11.916  -1.874   7.868
  111   3HD2  LEU  12          HD23      LEU  12 -11.279  -3.410   7.280
  112    H    LYS  13           HN       LYS  13 -10.221   1.214   7.138
  113    HA   LYS  13           HA       LYS  13  -8.826   2.483   4.860
  114   1HB   LYS  13          HB2       LYS  13 -10.474   3.912   6.946
  115   2HB   LYS  13          HB1       LYS  13  -9.139   4.731   6.134
  116   1HG   LYS  13          HG2       LYS  13 -10.213   3.982   3.932
  117   2HG   LYS  13          HG1       LYS  13 -11.634   3.563   4.890
  118   1HD   LYS  13          HD2       LYS  13 -10.354   6.295   5.049
  119   2HD   LYS  13          HD1       LYS  13 -11.599   5.916   3.858
  120   1HE   LYS  13          HE2       LYS  13 -13.218   5.434   5.568
  121   2HE   LYS  13          HE1       LYS  13 -11.975   5.458   6.835
  122   1HZ   LYS  13          HZ1       LYS  13 -12.644   7.758   5.075
  123   2HZ   LYS  13          HZ2       LYS  13 -11.529   7.759   6.356
  124   3HZ   LYS  13          HZ3       LYS  13 -13.189   7.581   6.671
  125    H    GLY  14           HN       GLY  14  -7.122   4.139   6.070
  126   1HA   GLY  14          HA2       GLY  14  -5.889   4.240   8.317
  127   2HA   GLY  14          HA1       GLY  14  -5.832   2.481   8.197
  128    H    GLU  15           HN       GLU  15  -3.412   3.302   8.406
  129    HA   GLU  15           HA       GLU  15  -2.318   3.534   5.620
  130   1HB   GLU  15          HB2       GLU  15  -0.527   4.931   6.649
  131   2HB   GLU  15          HB1       GLU  15  -2.124   5.641   6.875
  132   1HG   GLU  15          HG2       GLU  15  -2.237   4.749   9.150
  133   2HG   GLU  15          HG1       GLU  15  -0.687   3.937   8.932
  134    H    THR  16           HN       THR  16   0.040   2.735   5.565
  135    HA   THR  16           HA       THR  16   0.885   0.857   7.652
  136    HB   THR  16           HB       THR  16  -0.918  -0.393   6.544
  137    HG1  THR  16           HG1      THR  16   0.392  -2.167   5.830
  138   1HG2  THR  16          HG21      THR  16   0.657   0.269   4.043
  139   2HG2  THR  16          HG22      THR  16  -1.040   0.614   4.385
  140   3HG2  THR  16          HG23      THR  16  -0.519  -1.046   4.103
  141    H    THR  17           HN       THR  17   3.058   0.194   7.340
  142    HA   THR  17           HA       THR  17   4.413   1.144   4.840
  143    HB   THR  17           HB       THR  17   6.275   1.872   6.393
  144    HG1  THR  17           HG1      THR  17   5.919   0.941   8.282
  145   1HG2  THR  17          HG21      THR  17   4.872   3.864   7.312
  146   2HG2  THR  17          HG22      THR  17   3.538   3.121   6.431
  147   3HG2  THR  17          HG23      THR  17   4.982   3.646   5.566
  148    H    THR  18           HN       THR  18   6.406  -0.033   4.378
  149    HA   THR  18           HA       THR  18   6.917  -2.459   6.001
  150    HB   THR  18           HB       THR  18   5.524  -2.262   3.420
  151    HG1  THR  18           HG1      THR  18   6.121  -4.348   5.248
  152   1HG2  THR  18          HG21      THR  18   7.792  -2.768   2.533
  153   2HG2  THR  18          HG22      THR  18   6.639  -4.073   2.249
  154   3HG2  THR  18          HG23      THR  18   7.839  -4.219   3.535
  155    H    GLU  19           HN       GLU  19   9.074  -3.311   5.606
  156    HA   GLU  19           HA       GLU  19  10.913  -1.347   4.280
  157   1HB   GLU  19          HB2       GLU  19  10.816  -2.208   6.886
  158   2HB   GLU  19          HB1       GLU  19  11.982  -3.336   6.193
  159   1HG   GLU  19          HG2       GLU  19  12.931  -1.083   5.103
  160   2HG   GLU  19          HG1       GLU  19  12.180  -0.378   6.536
  161    H    ALA  20           HN       ALA  20  11.913  -2.119   2.464
  162    HA   ALA  20           HA       ALA  20  12.702  -4.951   2.245
  163   1HB   ALA  20          HB1       ALA  20  10.603  -5.414   1.438
  164   2HB   ALA  20          HB2       ALA  20  11.280  -4.774  -0.060
  165   3HB   ALA  20          HB3       ALA  20  10.302  -3.737   0.981
  166    H    VAL  21           HN       VAL  21  13.536  -5.269  -0.167
  167    HA   VAL  21           HA       VAL  21  15.723  -3.512  -0.613
  168    HB   VAL  21           HB       VAL  21  15.897  -4.746  -2.761
  169   1HG1  VAL  21          HG11      VAL  21  15.365  -6.088  -0.157
  170   2HG1  VAL  21          HG12      VAL  21  16.820  -6.097  -1.154
  171   3HG1  VAL  21          HG13      VAL  21  15.451  -7.124  -1.582
  172   1HG2  VAL  21          HG21      VAL  21  14.042  -6.565  -3.045
  173   2HG2  VAL  21          HG22      VAL  21  13.705  -4.926  -3.599
  174   3HG2  VAL  21          HG23      VAL  21  13.056  -5.486  -2.059
  175    H    ASP  22           HN       ASP  22  12.496  -3.585  -2.135
  176    HA   ASP  22           HA       ASP  22  12.838  -0.754  -2.958
  177   1HB   ASP  22          HB2       ASP  22  12.231  -3.049  -4.856
  178   2HB   ASP  22          HB1       ASP  22  12.228  -1.342  -5.296
  179    H    ALA  23           HN       ALA  23  10.702   0.099  -3.815
  180    HA   ALA  23           HA       ALA  23   8.519  -0.593  -2.083
  181   1HB   ALA  23          HB1       ALA  23   7.276   0.904  -3.770
  182   2HB   ALA  23          HB2       ALA  23   8.810   1.014  -4.632
  183   3HB   ALA  23          HB3       ALA  23   8.682   1.618  -2.980
  184    H    ALA  24           HN       ALA  24   9.454  -1.680  -5.297
  185    HA   ALA  24           HA       ALA  24   6.995  -2.830  -6.176
  186   1HB   ALA  24          HB1       ALA  24   8.508  -4.193  -7.605
  187   2HB   ALA  24          HB2       ALA  24   9.875  -3.699  -6.605
  188   3HB   ALA  24          HB3       ALA  24   9.007  -2.502  -7.567
  189    H    THR  25           HN       THR  25   9.646  -4.211  -4.226
  190    HA   THR  25           HA       THR  25   8.434  -6.821  -3.922
  191    HB   THR  25           HB       THR  25  10.591  -5.262  -2.482
  192    HG1  THR  25           HG1      THR  25  11.409  -5.892  -4.335
  193   1HG2  THR  25          HG21      THR  25   9.574  -6.899  -0.908
  194   2HG2  THR  25          HG22      THR  25  11.229  -7.338  -1.344
  195   3HG2  THR  25          HG23      THR  25   9.869  -8.181  -2.087
  196    H    ALA  26           HN       ALA  26   8.594  -3.923  -1.836
  197    HA   ALA  26           HA       ALA  26   7.174  -4.983   0.386
  198   1HB   ALA  26          HB1       ALA  26   7.473  -2.188  -0.750
  199   2HB   ALA  26          HB2       ALA  26   8.405  -2.923   0.555
  200   3HB   ALA  26          HB3       ALA  26   6.706  -2.508   0.811
  201    H    GLU  27           HN       GLU  27   5.852  -2.695  -2.045
  202    HA   GLU  27           HA       GLU  27   3.182  -2.740  -1.406
  203   1HB   GLU  27          HB2       GLU  27   2.786  -2.171  -3.762
  204   2HB   GLU  27          HB1       GLU  27   4.261  -1.404  -3.182
  205   1HG   GLU  27          HG2       GLU  27   5.288  -2.323  -4.972
  206   2HG   GLU  27          HG1       GLU  27   5.151  -3.860  -4.123
  207    H    LYS  28           HN       LYS  28   4.912  -5.425  -2.933
  208    HA   LYS  28           HA       LYS  28   2.596  -6.902  -3.844
  209   1HB   LYS  28          HB2       LYS  28   5.388  -7.693  -2.936
  210   2HB   LYS  28          HB1       LYS  28   4.247  -8.835  -3.643
  211   1HG   LYS  28          HG2       LYS  28   4.294  -7.780  -5.739
  212   2HG   LYS  28          HG1       LYS  28   4.916  -6.272  -5.070
  213   1HD   LYS  28          HD2       LYS  28   6.905  -7.076  -5.892
  214   2HD   LYS  28          HD1       LYS  28   6.922  -7.938  -4.353
  215   1HE   LYS  28          HE2       LYS  28   6.539  -9.965  -5.346
  216   2HE   LYS  28          HE1       LYS  28   5.418  -9.276  -6.538
  217   1HZ   LYS  28          HZ1       LYS  28   7.435  -9.888  -7.658
  218   2HZ   LYS  28          HZ2       LYS  28   8.381  -9.034  -6.535
  219   3HZ   LYS  28          HZ3       LYS  28   7.353  -8.195  -7.597
  220    H    VAL  29           HN       VAL  29   4.543  -7.008  -0.854
  221    HA   VAL  29           HA       VAL  29   2.898  -8.930   0.545
  222    HB   VAL  29           HB       VAL  29   4.942  -6.811   1.271
  223   1HG1  VAL  29          HG11      VAL  29   3.580  -8.688   3.233
  224   2HG1  VAL  29          HG12      VAL  29   3.357  -6.936   3.177
  225   3HG1  VAL  29          HG13      VAL  29   4.933  -7.615   3.597
  226   1HG2  VAL  29          HG21      VAL  29   5.861  -8.780   0.263
  227   2HG2  VAL  29          HG22      VAL  29   4.866  -9.835   1.267
  228   3HG2  VAL  29          HG23      VAL  29   6.181  -8.911   1.993
  229    H    LEU  30           HN       LEU  30   2.835  -5.399   0.206
  230    HA   LEU  30           HA       LEU  30   0.867  -4.901   2.237
  231   1HB   LEU  30          HB2       LEU  30   1.792  -3.471  -0.266
  232   2HB   LEU  30          HB1       LEU  30   0.563  -2.779   0.774
  233    HG   LEU  30           HG       LEU  30   3.138  -2.158   1.070
  234   1HD1  LEU  30          HD11      LEU  30   1.177  -2.655   3.310
  235   2HD1  LEU  30          HD12      LEU  30   1.445  -1.153   2.422
  236   3HD1  LEU  30          HD13      LEU  30   2.696  -1.771   3.510
  237   1HD2  LEU  30          HD21      LEU  30   2.875  -4.715   2.668
  238   2HD2  LEU  30          HD22      LEU  30   4.028  -3.459   3.065
  239   3HD2  LEU  30          HD23      LEU  30   4.126  -4.269   1.513
  240    H    LYS  31           HN       LYS  31   0.724  -5.842  -1.156
  241    HA   LYS  31           HA       LYS  31  -2.090  -5.471  -1.644
  242   1HB   LYS  31          HB2       LYS  31   0.006  -6.194  -3.144
  243   2HB   LYS  31          HB1       LYS  31  -0.509  -7.803  -2.697
  244   1HG   LYS  31          HG2       LYS  31  -2.462  -5.789  -3.811
  245   2HG   LYS  31          HG1       LYS  31  -1.498  -6.818  -4.869
  246   1HD   LYS  31          HD2       LYS  31  -3.403  -7.777  -2.708
  247   2HD   LYS  31          HD1       LYS  31  -3.685  -7.856  -4.446
  248   1HE   LYS  31          HE2       LYS  31  -1.163  -9.071  -4.040
  249   2HE   LYS  31          HE1       LYS  31  -2.226  -9.718  -2.769
  250   1HZ   LYS  31          HZ1       LYS  31  -3.909 -10.170  -4.441
  251   2HZ   LYS  31          HZ2       LYS  31  -2.465 -10.966  -4.849
  252   3HZ   LYS  31          HZ3       LYS  31  -2.913  -9.542  -5.661
  253    H    GLN  32           HN       GLN  32  -0.161  -8.183  -0.417
  254    HA   GLN  32           HA       GLN  32  -2.194 -10.118  -0.026
  255   1HB   GLN  32          HB2       GLN  32   0.489  -9.469   1.072
  256   2HB   GLN  32          HB1       GLN  32  -0.501 -10.594   2.004
  257   1HG   GLN  32          HG2       GLN  32  -0.341 -11.024  -0.941
  258   2HG   GLN  32          HG1       GLN  32   1.077 -11.443   0.021
  259   1HE2  GLN  32          HE21      GLN  32   0.679 -13.762  -0.373
  260   2HE2  GLN  32          HE22      GLN  32  -0.580 -14.575   0.441
  261    H    TYR  33           HN       TYR  33  -1.121  -7.432   2.035
  262    HA   TYR  33           HA       TYR  33  -2.832  -7.991   4.304
  263   1HB   TYR  33          HB2       TYR  33  -0.874  -6.526   4.418
  264   2HB   TYR  33          HB1       TYR  33  -1.564  -5.452   3.202
  265    HD1  TYR  33           HD1      TYR  33  -2.053  -6.815   6.611
  266    HD2  TYR  33           HD2      TYR  33  -3.108  -3.748   3.803
  267    HE1  TYR  33           HE1      TYR  33  -3.248  -5.601   8.397
  268    HE2  TYR  33           HE2      TYR  33  -4.301  -2.520   5.594
  269    HH   TYR  33           HH       TYR  33  -5.455  -3.294   7.900
  270    H    ILE  34           HN       ILE  34  -3.144  -5.983   1.388
  271    HA   ILE  34           HA       ILE  34  -5.741  -4.878   1.918
  272    HB   ILE  34           HB       ILE  34  -4.272  -5.569  -0.648
  273   1HG1  ILE  34          HG12      ILE  34  -3.206  -4.011   1.123
  274   2HG1  ILE  34          HG11      ILE  34  -3.279  -3.425  -0.536
  275   1HG2  ILE  34          HG21      ILE  34  -6.213  -5.025  -1.665
  276   2HG2  ILE  34          HG22      ILE  34  -5.853  -3.368  -1.184
  277   3HG2  ILE  34          HG23      ILE  34  -6.905  -4.366  -0.182
  278   1HD1  ILE  34          HD11      ILE  34  -4.145  -2.023   1.657
  279   2HD1  ILE  34          HD12      ILE  34  -5.646  -2.769   1.107
  280   3HD1  ILE  34          HD13      ILE  34  -4.716  -1.747   0.011
  281    H    ASN  35           HN       ASN  35  -4.645  -7.975   0.652
  282    HA   ASN  35           HA       ASN  35  -7.026  -8.933  -0.571
  283   1HB   ASN  35          HB2       ASN  35  -4.650  -9.881  -0.536
  284   2HB   ASN  35          HB1       ASN  35  -5.048 -10.559   1.043
  285   1HD2  ASN  35          HD21      ASN  35  -6.179 -12.529   1.057
  286   2HD2  ASN  35          HD22      ASN  35  -6.877 -13.242  -0.316
  287    H    ASP  36           HN       ASP  36  -6.102  -8.676   2.815
  288    HA   ASP  36           HA       ASP  36  -8.237 -10.403   3.822
  289   1HB   ASP  36          HB2       ASP  36  -6.043  -8.677   4.844
  290   2HB   ASP  36          HB1       ASP  36  -7.404  -8.919   5.939
  291    H    ASN  37           HN       ASN  37  -7.655  -6.868   3.797
  292    HA   ASN  37           HA       ASN  37 -10.182  -6.137   4.964
  293   1HB   ASN  37          HB2       ASN  37  -8.239  -4.672   3.146
  294   2HB   ASN  37          HB1       ASN  37  -9.553  -3.891   4.034
  295   1HD2  ASN  37          HD21      ASN  37  -9.210  -3.426   6.250
  296   2HD2  ASN  37          HD22      ASN  37  -7.794  -3.859   7.096
  297    H    GLY  38           HN       GLY  38  -9.171  -6.856   1.669
  298   1HA   GLY  38          HA2       GLY  38 -10.551  -7.377  -0.184
  299   2HA   GLY  38          HA1       GLY  38 -11.964  -6.986   0.799
  300    H    ILE  39           HN       ILE  39  -9.198  -4.842   0.338
  301    HA   ILE  39           HA       ILE  39 -11.012  -2.946  -1.120
  302    HB   ILE  39           HB       ILE  39  -8.673  -2.449   0.755
  303   1HG1  ILE  39          HG12      ILE  39 -10.673  -3.312   1.917
  304   2HG1  ILE  39          HG11      ILE  39 -10.412  -1.610   2.308
  305   1HG2  ILE  39          HG21      ILE  39  -9.742  -0.070   0.661
  306   2HG2  ILE  39          HG22      ILE  39 -10.452  -0.629  -0.853
  307   3HG2  ILE  39          HG23      ILE  39  -8.699  -0.582  -0.666
  308   1HD1  ILE  39          HD11      ILE  39 -12.410  -2.732   0.319
  309   2HD1  ILE  39          HD12      ILE  39 -12.070  -1.013   0.510
  310   3HD1  ILE  39          HD13      ILE  39 -12.773  -1.926   1.845
  311    H    ASP  40           HN       ASP  40 -10.036  -4.395  -2.988
  312    HA   ASP  40           HA       ASP  40  -7.361  -3.324  -3.820
  313   1HB   ASP  40          HB2       ASP  40  -7.623  -5.783  -3.508
  314   2HB   ASP  40          HB1       ASP  40  -8.913  -5.778  -4.715
  315    H    GLY  41           HN       GLY  41  -8.075  -1.396  -4.856
  316   1HA   GLY  41          HA2       GLY  41  -9.805  -1.831  -7.260
  317   2HA   GLY  41          HA1       GLY  41  -9.936  -0.376  -6.268
  318    H    GLU  42           HN       GLU  42  -8.213   1.176  -6.343
  319    HA   GLU  42           HA       GLU  42  -6.256   0.781  -8.583
  320   1HB   GLU  42          HB2       GLU  42  -8.430   2.707  -8.189
  321   2HB   GLU  42          HB1       GLU  42  -6.884   3.504  -8.481
  322   1HG   GLU  42          HG2       GLU  42  -6.675   2.637 -10.610
  323   2HG   GLU  42          HG1       GLU  42  -7.603   1.186 -10.225
  324    H    TRP  43           HN       TRP  43  -4.206   0.995  -7.814
  325    HA   TRP  43           HA       TRP  43  -3.732   2.443  -5.252
  326   1HB   TRP  43          HB2       TRP  43  -2.090   0.583  -6.999
  327   2HB   TRP  43          HB1       TRP  43  -1.456   1.352  -5.556
  328    HD1  TRP  43           HD1      TRP  43  -5.058   0.021  -5.569
  329    HE1  TRP  43           HE1      TRP  43  -5.172  -2.014  -4.009
  330    HE3  TRP  43           HE3      TRP  43  -0.112  -0.526  -4.490
  331    HZ2  TRP  43           HZ2      TRP  43  -3.407  -3.636  -2.464
  332    HZ3  TRP  43           HZ3      TRP  43   0.642  -2.316  -2.942
  333    HH2  TRP  43           HH2      TRP  43  -0.992  -3.862  -1.934
  334    H    THR  44           HN       THR  44  -1.770   3.867  -5.193
  335    HA   THR  44           HA       THR  44  -0.852   4.971  -7.782
  336    HB   THR  44           HB       THR  44  -1.491   7.258  -7.123
  337    HG1  THR  44           HG1      THR  44  -1.630   7.343  -5.003
  338   1HG2  THR  44          HG21      THR  44  -3.813   7.088  -7.601
  339   2HG2  THR  44          HG22      THR  44  -3.930   5.500  -6.844
  340   3HG2  THR  44          HG23      THR  44  -3.079   5.685  -8.377
  341    H    TYR  45           HN       TYR  45   1.294   5.427  -7.596
  342    HA   TYR  45           HA       TYR  45   2.572   5.222  -4.937
  343   1HB   TYR  45          HB2       TYR  45   3.408   3.985  -6.906
  344   2HB   TYR  45          HB1       TYR  45   3.656   5.506  -7.764
  345    HD1  TYR  45           HD1      TYR  45   4.466   4.120  -4.363
  346    HD2  TYR  45           HD2      TYR  45   5.856   6.240  -7.829
  347    HE1  TYR  45           HE1      TYR  45   6.709   4.341  -3.328
  348    HE2  TYR  45           HE2      TYR  45   8.098   6.464  -6.795
  349    HH   TYR  45           HH       TYR  45   9.378   4.897  -4.829
  350    H    ASP  46           HN       ASP  46   4.295   6.879  -4.390
  351    HA   ASP  46           HA       ASP  46   3.815   9.583  -5.572
  352   1HB   ASP  46          HB2       ASP  46   3.858   8.951  -2.598
  353   2HB   ASP  46          HB1       ASP  46   3.570  10.526  -3.329
  354    H    ASP  47           HN       ASP  47   5.748  10.587  -5.948
  355    HA   ASP  47           HA       ASP  47   8.263   9.325  -5.188
  356   1HB   ASP  47          HB2       ASP  47   7.824  10.515  -7.326
  357   2HB   ASP  47          HB1       ASP  47   7.648  12.025  -6.431
  358    H    ALA  48           HN       ALA  48   6.169  11.331  -3.446
  359    HA   ALA  48           HA       ALA  48   7.840  13.238  -2.179
  360   1HB   ALA  48          HB1       ALA  48   5.334  11.720  -1.555
  361   2HB   ALA  48          HB2       ALA  48   5.577  13.462  -1.712
  362   3HB   ALA  48          HB3       ALA  48   6.089  12.630  -0.244
  363    H    THR  49           HN       THR  49   6.739  10.284  -0.519
  364    HA   THR  49           HA       THR  49   9.521   9.861   0.516
  365    HB   THR  49           HB       THR  49   8.082  11.055   2.152
  366    HG1  THR  49           HG1      THR  49   8.565   8.325   2.744
  367   1HG2  THR  49          HG21      THR  49   6.070   9.946   3.038
  368   2HG2  THR  49          HG22      THR  49   6.307   8.611   1.907
  369   3HG2  THR  49          HG23      THR  49   5.913  10.220   1.301
  370    H    LYS  50           HN       LYS  50   8.162   8.523  -1.672
  371    HA   LYS  50           HA       LYS  50   7.721   6.360  -2.460
  372   1HB   LYS  50          HB2       LYS  50   9.110   5.633   0.142
  373   2HB   LYS  50          HB1       LYS  50   8.900   4.564  -1.244
  374   1HG   LYS  50          HG2       LYS  50  10.050   6.676  -2.480
  375   2HG   LYS  50          HG1       LYS  50  10.772   6.843  -0.880
  376   1HD   LYS  50          HD2       LYS  50  10.718   4.175  -2.282
  377   2HD   LYS  50          HD1       LYS  50  11.996   5.346  -2.608
  378   1HE   LYS  50          HE2       LYS  50  12.016   5.406   0.104
  379   2HE   LYS  50          HE1       LYS  50  11.508   3.727  -0.165
  380   1HZ   LYS  50          HZ1       LYS  50  13.827   5.065  -1.458
  381   2HZ   LYS  50          HZ2       LYS  50  13.324   3.467  -1.743
  382   3HZ   LYS  50          HZ3       LYS  50  13.923   3.914  -0.217
  383    H    THR  51           HN       THR  51   5.496   7.467  -1.404
  384    HA   THR  51           HA       THR  51   4.319   5.562   0.564
  385    HB   THR  51           HB       THR  51   3.058   8.002  -0.715
  386    HG1  THR  51           HG1      THR  51   3.955   9.154   1.041
  387   1HG2  THR  51          HG21      THR  51   2.421   6.170   1.489
  388   2HG2  THR  51          HG22      THR  51   1.373   7.283   0.612
  389   3HG2  THR  51          HG23      THR  51   2.353   7.870   1.955
  390    H    TRP  52           HN       TRP  52   1.880   5.049  -0.049
  391    HA   TRP  52           HA       TRP  52   1.577   4.534  -2.975
  392   1HB   TRP  52          HB2       TRP  52   1.621   2.589  -0.672
  393   2HB   TRP  52          HB1       TRP  52   0.756   2.216  -2.157
  394    HD1  TRP  52           HD1      TRP  52   4.232   2.479  -0.720
  395    HE1  TRP  52           HE1      TRP  52   5.939   1.708  -2.498
  396    HE3  TRP  52           HE3      TRP  52   1.158   2.119  -4.731
  397    HZ2  TRP  52           HZ2      TRP  52   5.972   1.021  -5.286
  398    HZ3  TRP  52           HZ3      TRP  52   2.026   1.402  -6.950
  399    HH2  TRP  52           HH2      TRP  52   4.431   0.851  -7.227
  400    H    THR  53           HN       THR  53  -0.750   3.204  -3.022
  401    HA   THR  53           HA       THR  53  -2.711   4.311  -1.130
  402    HB   THR  53           HB       THR  53  -2.953   5.003  -4.063
  403    HG1  THR  53           HG1      THR  53  -1.138   6.062  -3.462
  404   1HG2  THR  53          HG21      THR  53  -4.292   5.826  -1.502
  405   2HG2  THR  53          HG22      THR  53  -5.025   5.297  -3.016
  406   3HG2  THR  53          HG23      THR  53  -4.308   6.904  -2.897
  407    H    VAL  54           HN       VAL  54  -5.004   3.605  -1.919
  408    HA   VAL  54           HA       VAL  54  -5.241   1.410  -3.801
  409    HB   VAL  54           HB       VAL  54  -3.940   0.243  -2.111
  410   1HG1  VAL  54          HG11      VAL  54  -5.336   0.134   0.226
  411   2HG1  VAL  54          HG12      VAL  54  -5.676   1.784  -0.291
  412   3HG1  VAL  54          HG13      VAL  54  -4.010   1.252  -0.084
  413   1HG2  VAL  54          HG21      VAL  54  -5.270  -1.617  -1.905
  414   2HG2  VAL  54          HG22      VAL  54  -6.296  -0.705  -3.016
  415   3HG2  VAL  54          HG23      VAL  54  -6.645  -0.697  -1.288
  416    H    THR  55           HN       THR  55  -7.003   2.997  -4.260
  417    HA   THR  55           HA       THR  55  -9.189   3.273  -2.309
  418    HB   THR  55           HB       THR  55  -9.195   4.016  -5.239
  419    HG1  THR  55           HG1      THR  55  -7.777   5.524  -4.867
  420   1HG2  THR  55          HG21      THR  55 -10.723   5.692  -4.583
  421   2HG2  THR  55          HG22      THR  55 -10.262   5.569  -2.885
  422   3HG2  THR  55          HG23      THR  55 -11.206   4.283  -3.638
  423    H    GLU  56           HN       GLU  56 -10.953   1.933  -2.216
  424    HA   GLU  56           HA       GLU  56 -11.140  -0.514  -3.677
  425   1HB   GLU  56          HB2       GLU  56 -12.184   0.165  -1.451
  426   2HB   GLU  56          HB1       GLU  56 -13.408   1.027  -2.384
  427   1HG   GLU  56          HG2       GLU  56 -13.522  -1.334  -3.655
  428   2HG   GLU  56          HG1       GLU  56 -12.972  -1.906  -2.078
  Start of MODEL   11
    1   1H    THR   1          HT1       THR   1  14.613   4.553   4.309
    2   2H    THR   1          HT2       THR   1  15.873   4.194   3.226
    3   3H    THR   1          HT3       THR   1  15.141   2.951   4.124
    4    HA   THR   1           HA       THR   1  13.766   4.585   2.048
    5    HB   THR   1           HB       THR   1  13.929   2.316   0.860
    6    HG1  THR   1           HG1      THR   1  14.504   1.088   2.655
    7   1HG2  THR   1          HG21      THR   1  16.628   3.534   1.433
    8   2HG2  THR   1          HG22      THR   1  15.405   4.401   0.504
    9   3HG2  THR   1          HG23      THR   1  16.029   2.859  -0.082
   10    H    THR   2           HN       THR   2  12.043   4.792   3.742
   11    HA   THR   2           HA       THR   2  10.667   2.243   4.454
   12    HB   THR   2           HB       THR   2   9.963   5.040   5.350
   13    HG1  THR   2           HG1      THR   2  11.667   5.095   6.582
   14   1HG2  THR   2          HG21      THR   2   8.442   3.210   5.959
   15   2HG2  THR   2          HG22      THR   2   9.269   3.826   7.389
   16   3HG2  THR   2          HG23      THR   2   9.790   2.310   6.654
   17    H    PHE   3           HN       PHE   3   9.085   1.614   3.049
   18    HA   PHE   3           HA       PHE   3   7.874   3.472   1.135
   19   1HB   PHE   3          HB2       PHE   3   7.369   0.562   1.849
   20   2HB   PHE   3          HB1       PHE   3   6.693   1.382   0.440
   21    HD1  PHE   3           HD1      PHE   3   8.726   2.928  -0.739
   22    HD2  PHE   3           HD2      PHE   3   9.146  -0.845   1.279
   23    HE1  PHE   3           HE1      PHE   3  10.814   2.485  -1.999
   24    HE2  PHE   3           HE2      PHE   3  11.234  -1.284   0.018
   25    HZ   PHE   3           HZ       PHE   3  12.069   0.381  -1.619
   26    H    LYS   4           HN       LYS   4   5.482   3.730   0.988
   27    HA   LYS   4           HA       LYS   4   4.038   3.403   3.591
   28   1HB   LYS   4          HB2       LYS   4   5.122   5.688   3.258
   29   2HB   LYS   4          HB1       LYS   4   4.035   5.913   1.897
   30   1HG   LYS   4          HG2       LYS   4   2.093   5.569   3.380
   31   2HG   LYS   4          HG1       LYS   4   3.182   5.371   4.752
   32   1HD   LYS   4          HD2       LYS   4   3.629   7.602   4.894
   33   2HD   LYS   4          HD1       LYS   4   3.613   7.819   3.144
   34   1HE   LYS   4          HE2       LYS   4   1.401   8.390   3.121
   35   2HE   LYS   4          HE1       LYS   4   0.977   7.143   4.312
   36   1HZ   LYS   4          HZ1       LYS   4   0.765   9.326   5.303
   37   2HZ   LYS   4          HZ2       LYS   4   2.364   9.712   4.879
   38   3HZ   LYS   4          HZ3       LYS   4   2.055   8.496   6.025
   39    H    LEU   5           HN       LEU   5   1.727   3.341   3.344
   40    HA   LEU   5           HA       LEU   5   0.548   3.491   0.641
   41   1HB   LEU   5          HB2       LEU   5   1.611   1.121   1.306
   42   2HB   LEU   5          HB1       LEU   5   0.085   0.952   2.161
   43    HG   LEU   5           HG       LEU   5  -0.306   2.023  -0.531
   44   1HD1  LEU   5          HD11      LEU   5   0.583  -0.852  -0.487
   45   2HD1  LEU   5          HD12      LEU   5   1.776   0.435  -0.703
   46   3HD1  LEU   5          HD13      LEU   5   0.453   0.255  -1.863
   47   1HD2  LEU   5          HD21      LEU   5  -1.312  -0.425   0.950
   48   2HD2  LEU   5          HD22      LEU   5  -1.940   0.138  -0.599
   49   3HD2  LEU   5          HD23      LEU   5  -2.117   1.140   0.841
   50    H    ILE   6           HN       ILE   6  -1.541   4.233   0.840
   51    HA   ILE   6           HA       ILE   6  -2.695   4.385   3.592
   52    HB   ILE   6           HB       ILE   6  -3.173   5.903   1.014
   53   1HG1  ILE   6          HG12      ILE   6  -1.002   6.330   2.127
   54   2HG1  ILE   6          HG11      ILE   6  -2.050   7.746   2.194
   55   1HG2  ILE   6          HG21      ILE   6  -4.795   5.709   3.418
   56   2HG2  ILE   6          HG22      ILE   6  -5.140   6.552   1.908
   57   3HG2  ILE   6          HG23      ILE   6  -4.223   7.360   3.179
   58   1HD1  ILE   6          HD11      ILE   6  -1.097   7.481   4.385
   59   2HD1  ILE   6          HD12      ILE   6  -1.486   5.762   4.408
   60   3HD1  ILE   6          HD13      ILE   6  -2.778   6.958   4.497
   61    H    ILE   7           HN       ILE   7  -4.707   3.494   4.023
   62    HA   ILE   7           HA       ILE   7  -5.819   1.614   2.031
   63    HB   ILE   7           HB       ILE   7  -6.561   2.266   4.907
   64   1HG1  ILE   7          HG12      ILE   7  -4.954  -0.071   3.833
   65   2HG1  ILE   7          HG11      ILE   7  -4.217   1.384   4.506
   66   1HG2  ILE   7          HG21      ILE   7  -7.226  -0.180   3.243
   67   2HG2  ILE   7          HG22      ILE   7  -8.346   1.153   3.524
   68   3HG2  ILE   7          HG23      ILE   7  -7.784   0.174   4.879
   69   1HD1  ILE   7          HD11      ILE   7  -4.312   0.048   6.402
   70   2HD1  ILE   7          HD12      ILE   7  -5.798  -0.753   5.889
   71   3HD1  ILE   7          HD13      ILE   7  -5.856   0.891   6.526
   72    H    ASN   8           HN       ASN   8  -7.284   2.444   0.593
   73    HA   ASN   8           HA       ASN   8  -9.081   4.666   1.490
   74   1HB   ASN   8          HB2       ASN   8  -7.943   3.745  -1.152
   75   2HB   ASN   8          HB1       ASN   8  -9.325   4.841  -1.093
   76   1HD2  ASN   8          HD21      ASN   8  -7.953   6.574  -2.024
   77   2HD2  ASN   8          HD22      ASN   8  -6.813   7.383  -1.046
   78    H    GLY   9           HN       GLY   9  -9.914   2.263   2.439
   79   1HA   GLY   9          HA2       GLY   9 -11.743   0.997   0.501
   80   2HA   GLY   9          HA1       GLY   9 -11.483   0.479   2.171
   81    H    LYS  10           HN       LYS  10 -14.023   1.061   0.704
   82    HA   LYS  10           HA       LYS  10 -15.229   3.495   1.446
   83   1HB   LYS  10          HB2       LYS  10 -16.382   0.700   1.212
   84   2HB   LYS  10          HB1       LYS  10 -17.336   2.184   1.188
   85   1HG   LYS  10          HG2       LYS  10 -15.812   2.922  -0.755
   86   2HG   LYS  10          HG1       LYS  10 -15.309   1.234  -0.839
   87   1HD   LYS  10          HD2       LYS  10 -17.527   0.494  -1.319
   88   2HD   LYS  10          HD1       LYS  10 -18.218   2.059  -0.889
   89   1HE   LYS  10          HE2       LYS  10 -17.638   3.021  -2.905
   90   2HE   LYS  10          HE1       LYS  10 -16.170   2.036  -3.067
   91   1HZ   LYS  10          HZ1       LYS  10 -18.970   1.077  -3.353
   92   2HZ   LYS  10          HZ2       LYS  10 -17.592   0.084  -3.401
   93   3HZ   LYS  10          HZ3       LYS  10 -17.842   1.254  -4.607
   94    H    THR  11           HN       THR  11 -14.705   0.559   3.347
   95    HA   THR  11           HA       THR  11 -15.991   1.898   5.706
   96    HB   THR  11           HB       THR  11 -15.477  -1.055   5.267
   97    HG1  THR  11           HG1      THR  11 -16.814  -0.421   3.627
   98   1HG2  THR  11          HG21      THR  11 -15.946  -0.244   7.582
   99   2HG2  THR  11          HG22      THR  11 -17.197  -1.325   6.968
  100   3HG2  THR  11          HG23      THR  11 -17.476   0.416   7.005
  101    H    LEU  12           HN       LEU  12 -13.135   0.197   4.512
  102    HA   LEU  12           HA       LEU  12 -11.815   0.479   7.180
  103   1HB   LEU  12          HB2       LEU  12 -11.197  -1.105   4.667
  104   2HB   LEU  12          HB1       LEU  12 -10.169  -1.101   6.101
  105    HG   LEU  12           HG       LEU  12 -13.076  -1.672   6.480
  106   1HD1  LEU  12          HD11      LEU  12 -12.835  -3.992   5.871
  107   2HD1  LEU  12          HD12      LEU  12 -11.113  -3.785   5.550
  108   3HD1  LEU  12          HD13      LEU  12 -12.305  -3.033   4.489
  109   1HD2  LEU  12          HD21      LEU  12 -10.446  -2.508   7.715
  110   2HD2  LEU  12          HD22      LEU  12 -11.955  -3.334   8.105
  111   3HD2  LEU  12          HD23      LEU  12 -11.771  -1.617   8.466
  112    H    LYS  13           HN       LYS  13  -9.955   1.743   7.395
  113    HA   LYS  13           HA       LYS  13  -8.668   2.936   5.012
  114   1HB   LYS  13          HB2       LYS  13 -10.512   4.318   6.917
  115   2HB   LYS  13          HB1       LYS  13  -9.102   5.217   6.356
  116   1HG   LYS  13          HG2       LYS  13  -9.777   4.553   3.989
  117   2HG   LYS  13          HG1       LYS  13 -11.302   3.994   4.678
  118   1HD   LYS  13          HD2       LYS  13 -12.003   6.134   5.221
  119   2HD   LYS  13          HD1       LYS  13 -10.356   6.745   5.379
  120   1HE   LYS  13          HE2       LYS  13 -10.115   6.469   2.862
  121   2HE   LYS  13          HE1       LYS  13 -11.862   6.160   2.812
  122   1HZ   LYS  13          HZ1       LYS  13 -11.254   8.548   2.553
  123   2HZ   LYS  13          HZ2       LYS  13 -10.639   8.520   4.136
  124   3HZ   LYS  13          HZ3       LYS  13 -12.291   8.240   3.859
  125    H    GLY  14           HN       GLY  14  -6.872   4.533   5.883
  126   1HA   GLY  14          HA2       GLY  14  -5.659   4.942   8.153
  127   2HA   GLY  14          HA1       GLY  14  -5.550   3.183   8.186
  128    H    GLU  15           HN       GLU  15  -3.155   3.905   8.267
  129    HA   GLU  15           HA       GLU  15  -2.112   4.017   5.457
  130   1HB   GLU  15          HB2       GLU  15  -0.329   5.510   6.351
  131   2HB   GLU  15          HB1       GLU  15  -1.934   6.209   6.560
  132   1HG   GLU  15          HG2       GLU  15  -1.982   5.420   8.897
  133   2HG   GLU  15          HG1       GLU  15  -0.382   4.706   8.691
  134    H    THR  16           HN       THR  16   0.137   3.124   5.299
  135    HA   THR  16           HA       THR  16   1.112   1.469   7.536
  136    HB   THR  16           HB       THR  16  -0.701   0.114   6.576
  137    HG1  THR  16           HG1      THR  16   0.676  -1.384   7.043
  138   1HG2  THR  16          HG21      THR  16  -0.366  -0.715   4.184
  139   2HG2  THR  16          HG22      THR  16   0.797   0.598   3.989
  140   3HG2  THR  16          HG23      THR  16  -0.892   0.959   4.353
  141    H    THR  17           HN       THR  17   3.292   0.883   7.247
  142    HA   THR  17           HA       THR  17   4.570   1.598   4.632
  143    HB   THR  17           HB       THR  17   6.426   2.563   6.080
  144    HG1  THR  17           HG1      THR  17   6.037   2.843   8.192
  145   1HG2  THR  17          HG21      THR  17   5.312   4.353   5.233
  146   2HG2  THR  17          HG22      THR  17   4.660   4.502   6.865
  147   3HG2  THR  17          HG23      THR  17   3.731   3.672   5.618
  148    H    THR  18           HN       THR  18   6.619   0.462   4.284
  149    HA   THR  18           HA       THR  18   7.222  -1.751   6.163
  150    HB   THR  18           HB       THR  18   5.850  -1.881   3.565
  151    HG1  THR  18           HG1      THR  18   5.619  -4.098   4.423
  152   1HG2  THR  18          HG21      THR  18   7.058  -3.797   2.636
  153   2HG2  THR  18          HG22      THR  18   8.270  -3.683   3.913
  154   3HG2  THR  18          HG23      THR  18   8.116  -2.388   2.724
  155    H    GLU  19           HN       GLU  19   9.380  -2.707   5.663
  156    HA   GLU  19           HA       GLU  19  11.188  -0.758   4.266
  157   1HB   GLU  19          HB2       GLU  19  11.329  -0.957   6.786
  158   2HB   GLU  19          HB1       GLU  19  11.808  -2.640   6.566
  159   1HG   GLU  19          HG2       GLU  19  13.324  -0.667   4.953
  160   2HG   GLU  19          HG1       GLU  19  13.584  -0.582   6.696
  161    H    ALA  20           HN       ALA  20  12.056  -1.648   2.429
  162    HA   ALA  20           HA       ALA  20  12.967  -4.459   2.421
  163   1HB   ALA  20          HB1       ALA  20  10.772  -4.942   1.812
  164   2HB   ALA  20          HB2       ALA  20  11.489  -4.656   0.226
  165   3HB   ALA  20          HB3       ALA  20  10.547  -3.386   1.011
  166    H    VAL  21           HN       VAL  21  13.747  -4.953   0.030
  167    HA   VAL  21           HA       VAL  21  15.849  -3.163  -0.657
  168    HB   VAL  21           HB       VAL  21  15.724  -5.562  -1.240
  169   1HG1  VAL  21          HG11      VAL  21  13.208  -5.377  -1.828
  170   2HG1  VAL  21          HG12      VAL  21  14.203  -6.454  -2.808
  171   3HG1  VAL  21          HG13      VAL  21  13.768  -4.858  -3.418
  172   1HG2  VAL  21          HG21      VAL  21  15.841  -3.825  -3.717
  173   2HG2  VAL  21          HG22      VAL  21  16.601  -5.403  -3.509
  174   3HG2  VAL  21          HG23      VAL  21  17.166  -4.022  -2.570
  175    H    ASP  22           HN       ASP  22  12.565  -3.491  -1.953
  176    HA   ASP  22           HA       ASP  22  12.725  -0.769  -3.100
  177   1HB   ASP  22          HB2       ASP  22  13.735  -2.339  -4.741
  178   2HB   ASP  22          HB1       ASP  22  12.253  -3.293  -4.718
  179    H    ALA  23           HN       ALA  23  10.553  -0.039  -3.791
  180    HA   ALA  23           HA       ALA  23   8.435  -0.838  -2.046
  181   1HB   ALA  23          HB1       ALA  23   7.253   0.395  -4.241
  182   2HB   ALA  23          HB2       ALA  23   8.914   0.981  -4.301
  183   3HB   ALA  23          HB3       ALA  23   7.942   1.232  -2.851
  184    H    ALA  24           HN       ALA  24   9.430  -2.031  -5.195
  185    HA   ALA  24           HA       ALA  24   7.023  -3.322  -6.034
  186   1HB   ALA  24          HB1       ALA  24   9.805  -4.438  -6.416
  187   2HB   ALA  24          HB2       ALA  24   9.321  -2.934  -7.200
  188   3HB   ALA  24          HB3       ALA  24   8.461  -4.431  -7.558
  189    H    THR  25           HN       THR  25   9.750  -4.527  -4.067
  190    HA   THR  25           HA       THR  25   8.616  -7.136  -3.561
  191    HB   THR  25           HB       THR  25  10.735  -5.419  -2.229
  192    HG1  THR  25           HG1      THR  25  11.789  -6.150  -3.866
  193   1HG2  THR  25          HG21      THR  25  11.463  -7.417  -1.014
  194   2HG2  THR  25          HG22      THR  25  10.141  -8.350  -1.717
  195   3HG2  THR  25          HG23      THR  25   9.791  -7.037  -0.588
  196    H    ALA  26           HN       ALA  26   8.808  -4.156  -1.560
  197    HA   ALA  26           HA       ALA  26   7.369  -5.140   0.683
  198   1HB   ALA  26          HB1       ALA  26   6.880  -2.626   0.985
  199   2HB   ALA  26          HB2       ALA  26   7.731  -2.396  -0.547
  200   3HB   ALA  26          HB3       ALA  26   8.581  -3.082   0.837
  201    H    GLU  27           HN       GLU  27   6.140  -3.095  -1.987
  202    HA   GLU  27           HA       GLU  27   3.455  -2.926  -1.435
  203   1HB   GLU  27          HB2       GLU  27   4.677  -1.984  -3.387
  204   2HB   GLU  27          HB1       GLU  27   4.703  -3.586  -4.124
  205   1HG   GLU  27          HG2       GLU  27   2.111  -3.508  -3.787
  206   2HG   GLU  27          HG1       GLU  27   2.356  -1.766  -3.650
  207    H    LYS  28           HN       LYS  28   5.074  -5.842  -2.699
  208    HA   LYS  28           HA       LYS  28   2.691  -7.359  -3.287
  209   1HB   LYS  28          HB2       LYS  28   5.463  -8.213  -2.354
  210   2HB   LYS  28          HB1       LYS  28   4.274  -9.282  -3.099
  211   1HG   LYS  28          HG2       LYS  28   4.502  -8.300  -5.195
  212   2HG   LYS  28          HG1       LYS  28   5.066  -6.767  -4.529
  213   1HD   LYS  28          HD2       LYS  28   7.095  -7.579  -5.256
  214   2HD   LYS  28          HD1       LYS  28   7.063  -8.348  -3.669
  215   1HE   LYS  28          HE2       LYS  28   7.451 -10.238  -4.944
  216   2HE   LYS  28          HE1       LYS  28   5.682 -10.200  -5.095
  217   1HZ   LYS  28          HZ1       LYS  28   7.547  -8.781  -6.922
  218   2HZ   LYS  28          HZ2       LYS  28   5.861  -8.913  -7.087
  219   3HZ   LYS  28          HZ3       LYS  28   6.845 -10.286  -7.267
  220    H    VAL  29           HN       VAL  29   4.735  -7.053  -0.392
  221    HA   VAL  29           HA       VAL  29   3.166  -8.810   1.301
  222    HB   VAL  29           HB       VAL  29   5.215  -6.605   1.698
  223   1HG1  VAL  29          HG11      VAL  29   3.985  -8.317   3.885
  224   2HG1  VAL  29          HG12      VAL  29   3.703  -6.586   3.673
  225   3HG1  VAL  29          HG13      VAL  29   5.316  -7.176   4.087
  226   1HG2  VAL  29          HG21      VAL  29   6.389  -8.745   2.689
  227   2HG2  VAL  29          HG22      VAL  29   6.305  -8.519   0.942
  228   3HG2  VAL  29          HG23      VAL  29   5.172  -9.605   1.747
  229    H    LEU  30           HN       LEU  30   3.141  -5.312   0.601
  230    HA   LEU  30           HA       LEU  30   1.226  -4.596   2.608
  231   1HB   LEU  30          HB2       LEU  30   2.152  -3.437  -0.029
  232   2HB   LEU  30          HB1       LEU  30   0.909  -2.631   0.914
  233    HG   LEU  30           HG       LEU  30   3.430  -1.939   1.202
  234   1HD1  LEU  30          HD11      LEU  30   1.738  -0.932   2.548
  235   2HD1  LEU  30          HD12      LEU  30   3.019  -1.474   3.640
  236   3HD1  LEU  30          HD13      LEU  30   1.524  -2.409   3.493
  237   1HD2  LEU  30          HD21      LEU  30   4.432  -3.115   3.197
  238   2HD2  LEU  30          HD22      LEU  30   4.478  -4.007   1.691
  239   3HD2  LEU  30          HD23      LEU  30   3.291  -4.418   2.926
  240    H    LYS  31           HN       LYS  31   0.972  -5.883  -0.658
  241    HA   LYS  31           HA       LYS  31  -1.856  -5.502  -1.092
  242   1HB   LYS  31          HB2       LYS  31   0.185  -6.380  -2.592
  243   2HB   LYS  31          HB1       LYS  31  -0.336  -7.936  -1.993
  244   1HG   LYS  31          HG2       LYS  31  -2.295  -5.992  -3.217
  245   2HG   LYS  31          HG1       LYS  31  -1.384  -7.130  -4.208
  246   1HD   LYS  31          HD2       LYS  31  -3.230  -7.854  -1.909
  247   2HD   LYS  31          HD1       LYS  31  -3.572  -8.083  -3.622
  248   1HE   LYS  31          HE2       LYS  31  -1.058  -9.305  -3.190
  249   2HE   LYS  31          HE1       LYS  31  -2.087  -9.816  -1.833
  250   1HZ   LYS  31          HZ1       LYS  31  -3.845 -10.345  -3.429
  251   2HZ   LYS  31          HZ2       LYS  31  -2.444 -11.252  -3.747
  252   3HZ   LYS  31          HZ3       LYS  31  -2.828  -9.911  -4.716
  253    H    GLN  32           HN       GLN  32   0.096  -8.116   0.303
  254    HA   GLN  32           HA       GLN  32  -1.932  -9.992   0.928
  255   1HB   GLN  32          HB2       GLN  32   0.780  -9.262   1.897
  256   2HB   GLN  32          HB1       GLN  32  -0.187 -10.302   2.943
  257   1HG   GLN  32          HG2       GLN  32  -0.319 -12.013   1.352
  258   2HG   GLN  32          HG1       GLN  32   0.035 -10.921   0.013
  259   1HE2  GLN  32          HE21      GLN  32   1.943 -11.933  -0.789
  260   2HE2  GLN  32          HE22      GLN  32   3.366 -12.104   0.137
  261    H    TYR  33           HN       TYR  33  -0.777  -7.148   2.725
  262    HA   TYR  33           HA       TYR  33  -2.408  -7.485   5.086
  263   1HB   TYR  33          HB2       TYR  33  -0.463  -5.995   4.958
  264   2HB   TYR  33          HB1       TYR  33  -1.239  -5.045   3.690
  265    HD1  TYR  33           HD1      TYR  33  -1.507  -6.096   7.233
  266    HD2  TYR  33           HD2      TYR  33  -2.797  -3.327   4.222
  267    HE1  TYR  33           HE1      TYR  33  -2.629  -4.745   8.966
  268    HE2  TYR  33           HE2      TYR  33  -3.918  -1.962   5.958
  269    HH   TYR  33           HH       TYR  33  -4.651  -3.045   8.959
  270    H    ILE  34           HN       ILE  34  -2.877  -5.822   1.986
  271    HA   ILE  34           HA       ILE  34  -5.467  -4.685   2.539
  272    HB   ILE  34           HB       ILE  34  -4.091  -5.551  -0.025
  273   1HG1  ILE  34          HG12      ILE  34  -2.966  -3.863   1.595
  274   2HG1  ILE  34          HG11      ILE  34  -3.091  -3.417  -0.101
  275   1HG2  ILE  34          HG21      ILE  34  -6.400  -3.626   0.363
  276   2HG2  ILE  34          HG22      ILE  34  -6.505  -5.226  -0.371
  277   3HG2  ILE  34          HG23      ILE  34  -5.580  -3.952  -1.164
  278   1HD1  ILE  34          HD11      ILE  34  -5.409  -2.621   1.546
  279   2HD1  ILE  34          HD12      ILE  34  -4.508  -1.696   0.345
  280   3HD1  ILE  34          HD13      ILE  34  -3.893  -1.836   1.992
  281    H    ASN  35           HN       ASN  35  -4.363  -7.848   1.449
  282    HA   ASN  35           HA       ASN  35  -6.779  -8.922   0.399
  283   1HB   ASN  35          HB2       ASN  35  -4.413  -9.852   0.362
  284   2HB   ASN  35          HB1       ASN  35  -4.675 -10.375   2.026
  285   1HD2  ASN  35          HD21      ASN  35  -5.539 -11.004  -1.333
  286   2HD2  ASN  35          HD22      ASN  35  -6.412 -12.429  -1.035
  287    H    ASP  36           HN       ASP  36  -5.722  -8.413   3.716
  288    HA   ASP  36           HA       ASP  36  -7.765 -10.106   4.938
  289   1HB   ASP  36          HB2       ASP  36  -5.445  -9.327   5.807
  290   2HB   ASP  36          HB1       ASP  36  -6.268  -7.827   6.235
  291    H    ASN  37           HN       ASN  37  -7.296  -6.557   4.712
  292    HA   ASN  37           HA       ASN  37  -9.807  -5.822   5.876
  293   1HB   ASN  37          HB2       ASN  37  -7.976  -4.452   3.877
  294   2HB   ASN  37          HB1       ASN  37  -9.300  -3.642   4.722
  295   1HD2  ASN  37          HD21      ASN  37  -6.229  -3.348   4.927
  296   2HD2  ASN  37          HD22      ASN  37  -5.921  -3.488   6.599
  297    H    GLY  38           HN       GLY  38  -8.900  -6.767   2.608
  298   1HA   GLY  38          HA2       GLY  38 -10.357  -7.522   0.890
  299   2HA   GLY  38          HA1       GLY  38 -11.733  -7.020   1.874
  300    H    ILE  39           HN       ILE  39  -9.008  -4.917   1.127
  301    HA   ILE  39           HA       ILE  39 -10.867  -3.211  -0.498
  302    HB   ILE  39           HB       ILE  39  -8.480  -2.498   1.243
  303   1HG1  ILE  39          HG12      ILE  39 -10.441  -3.236   2.549
  304   2HG1  ILE  39          HG11      ILE  39 -10.178  -1.501   2.744
  305   1HG2  ILE  39          HG21      ILE  39  -8.506  -0.738  -0.250
  306   2HG2  ILE  39          HG22      ILE  39  -9.719  -0.160   0.892
  307   3HG2  ILE  39          HG23      ILE  39 -10.220  -0.931  -0.613
  308   1HD1  ILE  39          HD11      ILE  39 -12.217  -2.826   0.925
  309   2HD1  ILE  39          HD12      ILE  39 -11.897  -1.092   0.966
  310   3HD1  ILE  39          HD13      ILE  39 -12.555  -1.900   2.388
  311    H    ASP  40           HN       ASP  40  -9.989  -4.775  -2.268
  312    HA   ASP  40           HA       ASP  40  -7.317  -3.841  -3.264
  313   1HB   ASP  40          HB2       ASP  40  -8.041  -6.339  -2.654
  314   2HB   ASP  40          HB1       ASP  40  -8.721  -6.283  -4.284
  315    H    GLY  41           HN       GLY  41  -8.013  -2.037  -4.495
  316   1HA   GLY  41          HA2       GLY  41  -9.782  -2.704  -6.812
  317   2HA   GLY  41          HA1       GLY  41  -9.974  -1.186  -5.929
  318    H    GLU  42           HN       GLU  42  -8.364   0.447  -6.167
  319    HA   GLU  42           HA       GLU  42  -6.372  -0.035  -8.357
  320   1HB   GLU  42          HB2       GLU  42  -8.668   1.757  -8.165
  321   2HB   GLU  42          HB1       GLU  42  -7.182   2.657  -8.461
  322   1HG   GLU  42          HG2       GLU  42  -6.860   1.721 -10.532
  323   2HG   GLU  42          HG1       GLU  42  -7.590   0.183 -10.068
  324    H    TRP  43           HN       TRP  43  -4.343   0.366  -7.621
  325    HA   TRP  43           HA       TRP  43  -3.952   2.046  -5.191
  326   1HB   TRP  43          HB2       TRP  43  -2.200   0.165  -6.805
  327   2HB   TRP  43          HB1       TRP  43  -1.617   1.076  -5.423
  328    HD1  TRP  43           HD1      TRP  43  -5.133  -0.441  -5.282
  329    HE1  TRP  43           HE1      TRP  43  -5.118  -2.375  -3.595
  330    HE3  TRP  43           HE3      TRP  43  -0.143  -0.691  -4.287
  331    HZ2  TRP  43           HZ2      TRP  43  -3.248  -3.812  -1.996
  332    HZ3  TRP  43           HZ3      TRP  43   0.725  -2.345  -2.652
  333    HH2  TRP  43           HH2      TRP  43  -0.814  -3.899  -1.512
  334    H    THR  44           HN       THR  44  -2.006   3.537  -5.282
  335    HA   THR  44           HA       THR  44  -1.251   4.518  -7.972
  336    HB   THR  44           HB       THR  44  -1.942   6.815  -7.409
  337    HG1  THR  44           HG1      THR  44  -3.095   7.183  -5.528
  338   1HG2  THR  44          HG21      THR  44  -3.529   5.114  -8.490
  339   2HG2  THR  44          HG22      THR  44  -4.275   6.538  -7.763
  340   3HG2  THR  44          HG23      THR  44  -4.299   4.996  -6.908
  341    H    TYR  45           HN       TYR  45   0.881   5.053  -7.922
  342    HA   TYR  45           HA       TYR  45   2.308   5.023  -5.335
  343   1HB   TYR  45          HB2       TYR  45   3.098   3.752  -7.296
  344   2HB   TYR  45          HB1       TYR  45   3.209   5.242  -8.232
  345    HD1  TYR  45           HD1      TYR  45   5.348   6.111  -8.460
  346    HD2  TYR  45           HD2      TYR  45   4.315   4.033  -4.847
  347    HE1  TYR  45           HE1      TYR  45   7.635   6.498  -7.585
  348    HE2  TYR  45           HE2      TYR  45   6.603   4.416  -3.972
  349    HH   TYR  45           HH       TYR  45   9.127   5.059  -5.648
  350    H    ASP  46           HN       ASP  46   3.991   6.781  -4.959
  351    HA   ASP  46           HA       ASP  46   3.288   9.414  -6.189
  352   1HB   ASP  46          HB2       ASP  46   3.608   8.895  -3.210
  353   2HB   ASP  46          HB1       ASP  46   3.175  10.424  -3.967
  354    H    ASP  47           HN       ASP  47   5.125  10.515  -6.739
  355    HA   ASP  47           HA       ASP  47   7.758   9.400  -6.160
  356   1HB   ASP  47          HB2       ASP  47   7.084  10.497  -8.287
  357   2HB   ASP  47          HB1       ASP  47   6.900  12.024  -7.422
  358    H    ALA  48           HN       ALA  48   5.711  11.339  -4.298
  359    HA   ALA  48           HA       ALA  48   7.389  13.367  -3.232
  360   1HB   ALA  48          HB1       ALA  48   5.154  13.515  -2.611
  361   2HB   ALA  48          HB2       ALA  48   5.812  12.770  -1.154
  362   3HB   ALA  48          HB3       ALA  48   5.002  11.773  -2.366
  363    H    THR  49           HN       THR  49   6.535  10.422  -1.418
  364    HA   THR  49           HA       THR  49   9.399  10.127  -0.586
  365    HB   THR  49           HB       THR  49   8.068  11.363   1.109
  366    HG1  THR  49           HG1      THR  49   8.580  10.008   2.809
  367   1HG2  THR  49          HG21      THR  49   6.194  10.156   2.241
  368   2HG2  THR  49          HG22      THR  49   6.328   8.884   1.023
  369   3HG2  THR  49          HG23      THR  49   5.851  10.514   0.547
  370    H    LYS  50           HN       LYS  50   7.966   8.641  -2.598
  371    HA   LYS  50           HA       LYS  50   7.533   6.431  -3.244
  372   1HB   LYS  50          HB2       LYS  50   9.043   5.855  -0.672
  373   2HB   LYS  50          HB1       LYS  50   8.802   4.724  -2.000
  374   1HG   LYS  50          HG2       LYS  50  10.742   5.499  -2.857
  375   2HG   LYS  50          HG1       LYS  50   9.866   6.976  -3.254
  376   1HD   LYS  50          HD2       LYS  50  11.447   7.971  -1.945
  377   2HD   LYS  50          HD1       LYS  50  10.422   7.418  -0.621
  378   1HE   LYS  50          HE2       LYS  50  11.794   5.220  -0.723
  379   2HE   LYS  50          HE1       LYS  50  12.962   6.161  -1.672
  380   1HZ   LYS  50          HZ1       LYS  50  11.849   7.036   0.940
  381   2HZ   LYS  50          HZ2       LYS  50  13.086   7.790   0.052
  382   3HZ   LYS  50          HZ3       LYS  50  13.353   6.271   0.764
  383    H    THR  51           HN       THR  51   5.337   7.556  -2.152
  384    HA   THR  51           HA       THR  51   4.293   5.748  -0.026
  385    HB   THR  51           HB       THR  51   3.028   8.155  -1.378
  386    HG1  THR  51           HG1      THR  51   4.507   8.069   1.034
  387   1HG2  THR  51          HG21      THR  51   1.294   7.279  -0.165
  388   2HG2  THR  51          HG22      THR  51   2.096   8.133   1.153
  389   3HG2  THR  51          HG23      THR  51   2.363   6.404   0.931
  390    H    TRP  52           HN       TRP  52   1.916   5.041  -0.441
  391    HA   TRP  52           HA       TRP  52   1.424   4.413  -3.325
  392   1HB   TRP  52          HB2       TRP  52   1.647   2.588  -0.934
  393   2HB   TRP  52          HB1       TRP  52   0.759   2.110  -2.375
  394    HD1  TRP  52           HD1      TRP  52   4.265   2.639  -1.068
  395    HE1  TRP  52           HE1      TRP  52   5.952   1.846  -2.857
  396    HE3  TRP  52           HE3      TRP  52   1.080   1.849  -4.922
  397    HZ2  TRP  52           HZ2      TRP  52   5.924   0.978  -5.599
  398    HZ3  TRP  52           HZ3      TRP  52   1.906   1.035  -7.124
  399    HH2  TRP  52           HH2      TRP  52   4.326   0.598  -7.462
  400    H    THR  53           HN       THR  53  -0.860   3.014  -3.170
  401    HA   THR  53           HA       THR  53  -2.743   4.155  -1.215
  402    HB   THR  53           HB       THR  53  -3.184   4.695  -4.156
  403    HG1  THR  53           HG1      THR  53  -2.408   6.830  -3.627
  404   1HG2  THR  53          HG21      THR  53  -5.193   5.106  -3.111
  405   2HG2  THR  53          HG22      THR  53  -4.427   6.675  -2.865
  406   3HG2  THR  53          HG23      THR  53  -4.432   5.483  -1.565
  407    H    VAL  54           HN       VAL  54  -5.068   3.364  -1.862
  408    HA   VAL  54           HA       VAL  54  -5.321   1.059  -3.609
  409    HB   VAL  54           HB       VAL  54  -3.955   0.024  -1.886
  410   1HG1  VAL  54          HG11      VAL  54  -5.569   1.717  -0.137
  411   2HG1  VAL  54          HG12      VAL  54  -3.975   1.021   0.129
  412   3HG1  VAL  54          HG13      VAL  54  -5.417   0.071   0.474
  413   1HG2  VAL  54          HG21      VAL  54  -6.643  -0.900  -0.972
  414   2HG2  VAL  54          HG22      VAL  54  -5.250  -1.845  -1.505
  415   3HG2  VAL  54          HG23      VAL  54  -6.281  -1.039  -2.694
  416    H    THR  55           HN       THR  55  -7.214   2.235  -4.249
  417    HA   THR  55           HA       THR  55  -9.311   2.814  -2.243
  418    HB   THR  55           HB       THR  55  -9.501   3.095  -5.243
  419    HG1  THR  55           HG1      THR  55  -8.190   4.831  -3.422
  420   1HG2  THR  55          HG21      THR  55 -11.458   3.589  -3.754
  421   2HG2  THR  55          HG22      THR  55 -10.907   4.987  -4.677
  422   3HG2  THR  55          HG23      THR  55 -10.489   4.837  -2.970
  423    H    GLU  56           HN       GLU  56 -11.245   1.664  -2.084
  424    HA   GLU  56           HA       GLU  56 -11.313  -1.054  -3.158
  425   1HB   GLU  56          HB2       GLU  56 -12.110  -0.361  -0.899
  426   2HB   GLU  56          HB1       GLU  56 -13.384   0.591  -1.662
  427   1HG   GLU  56          HG2       GLU  56 -13.890  -1.719  -2.884
  428   2HG   GLU  56          HG1       GLU  56 -13.104  -2.378  -1.448
  Start of MODEL   12
    1   1H    THR   1          HT1       THR   1  15.041   2.876   5.469
    2   2H    THR   1          HT2       THR   1  14.547   4.433   5.001
    3   3H    THR   1          HT3       THR   1  15.979   3.768   4.373
    4    HA   THR   1           HA       THR   1  14.124   3.695   2.758
    5    HB   THR   1           HB       THR   1  15.070   1.007   3.795
    6    HG1  THR   1           HG1      THR   1  17.005   1.639   3.350
    7   1HG2  THR   1          HG21      THR   1  14.372   2.091   1.058
    8   2HG2  THR   1          HG22      THR   1  13.577   0.778   1.926
    9   3HG2  THR   1          HG23      THR   1  15.215   0.562   1.308
   10    H    THR   2           HN       THR   2  12.108   4.314   3.941
   11    HA   THR   2           HA       THR   2  10.524   1.910   4.797
   12    HB   THR   2           HB       THR   2  10.135   4.758   5.737
   13    HG1  THR   2           HG1      THR   2  11.688   2.725   6.958
   14   1HG2  THR   2          HG21      THR   2   8.267   3.436   6.301
   15   2HG2  THR   2          HG22      THR   2   9.264   3.390   7.755
   16   3HG2  THR   2          HG23      THR   2   9.262   2.021   6.643
   17    H    PHE   3           HN       PHE   3   8.893   1.516   3.365
   18    HA   PHE   3           HA       PHE   3   8.058   3.547   1.410
   19   1HB   PHE   3          HB2       PHE   3   7.221   0.688   2.000
   20   2HB   PHE   3          HB1       PHE   3   6.679   1.613   0.599
   21    HD1  PHE   3           HD1      PHE   3   8.858   2.979  -0.492
   22    HD2  PHE   3           HD2      PHE   3   8.910  -0.841   1.479
   23    HE1  PHE   3           HE1      PHE   3  10.941   2.383  -1.697
   24    HE2  PHE   3           HE2      PHE   3  10.993  -1.433   0.273
   25    HZ   PHE   3           HZ       PHE   3  12.008   0.179  -1.315
   26    H    LYS   4           HN       LYS   4   5.619   3.860   1.079
   27    HA   LYS   4           HA       LYS   4   4.076   3.791   3.641
   28   1HB   LYS   4          HB2       LYS   4   5.236   5.963   3.421
   29   2HB   LYS   4          HB1       LYS   4   4.537   6.187   1.836
   30   1HG   LYS   4          HG2       LYS   4   3.223   7.451   3.433
   31   2HG   LYS   4          HG1       LYS   4   2.261   6.092   2.855
   32   1HD   LYS   4          HD2       LYS   4   2.852   4.803   4.866
   33   2HD   LYS   4          HD1       LYS   4   3.835   6.150   5.445
   34   1HE   LYS   4          HE2       LYS   4   1.864   7.590   5.583
   35   2HE   LYS   4          HE1       LYS   4   0.849   6.309   4.887
   36   1HZ   LYS   4          HZ1       LYS   4   0.856   6.383   7.374
   37   2HZ   LYS   4          HZ2       LYS   4   2.500   5.953   7.331
   38   3HZ   LYS   4          HZ3       LYS   4   1.324   4.891   6.716
   39    H    LEU   5           HN       LEU   5   1.854   3.515   3.324
   40    HA   LEU   5           HA       LEU   5   0.727   3.766   0.587
   41   1HB   LEU   5          HB2       LEU   5   1.724   1.388   1.265
   42   2HB   LEU   5          HB1       LEU   5   0.197   1.248   2.126
   43    HG   LEU   5           HG       LEU   5  -0.173   2.308  -0.578
   44   1HD1  LEU   5          HD11      LEU   5   1.865   0.666  -0.728
   45   2HD1  LEU   5          HD12      LEU   5   0.540   0.508  -1.887
   46   3HD1  LEU   5          HD13      LEU   5   0.640  -0.587  -0.499
   47   1HD2  LEU   5          HD21      LEU   5  -1.264   0.003   1.052
   48   2HD2  LEU   5          HD22      LEU   5  -1.787   0.325  -0.601
   49   3HD2  LEU   5          HD23      LEU   5  -2.060   1.528   0.660
   50    H    ILE   6           HN       ILE   6  -1.314   4.602   0.727
   51    HA   ILE   6           HA       ILE   6  -2.598   4.742   3.421
   52    HB   ILE   6           HB       ILE   6  -2.765   6.336   0.853
   53   1HG1  ILE   6          HG12      ILE   6  -0.800   6.679   2.346
   54   2HG1  ILE   6          HG11      ILE   6  -1.812   8.119   2.235
   55   1HG2  ILE   6          HG21      ILE   6  -5.024   6.201   1.887
   56   2HG2  ILE   6          HG22      ILE   6  -4.356   7.831   1.974
   57   3HG2  ILE   6          HG23      ILE   6  -4.348   6.797   3.403
   58   1HD1  ILE   6          HD11      ILE   6  -2.848   6.582   4.379
   59   2HD1  ILE   6          HD12      ILE   6  -1.976   8.110   4.480
   60   3HD1  ILE   6          HD13      ILE   6  -1.096   6.586   4.570
   61    H    ILE   7           HN       ILE   7  -4.587   3.786   3.749
   62    HA   ILE   7           HA       ILE   7  -5.656   2.012   1.651
   63    HB   ILE   7           HB       ILE   7  -6.503   2.590   4.512
   64   1HG1  ILE   7          HG12      ILE   7  -4.940   0.218   3.465
   65   2HG1  ILE   7          HG11      ILE   7  -4.150   1.661   4.102
   66   1HG2  ILE   7          HG21      ILE   7  -7.153   0.217   2.737
   67   2HG2  ILE   7          HG22      ILE   7  -8.262   1.553   3.050
   68   3HG2  ILE   7          HG23      ILE   7  -7.747   0.506   4.373
   69   1HD1  ILE   7          HD11      ILE   7  -5.792  -0.391   5.535
   70   2HD1  ILE   7          HD12      ILE   7  -5.820   1.270   6.128
   71   3HD1  ILE   7          HD13      ILE   7  -4.293   0.392   6.036
   72    H    ASN   8           HN       ASN   8  -7.212   2.707   0.255
   73    HA   ASN   8           HA       ASN   8  -8.980   4.983   1.093
   74   1HB   ASN   8          HB2       ASN   8  -7.764   4.106  -1.532
   75   2HB   ASN   8          HB1       ASN   8  -9.129   5.223  -1.483
   76   1HD2  ASN   8          HD21      ASN   8  -7.670   6.929  -2.357
   77   2HD2  ASN   8          HD22      ASN   8  -6.560   7.707  -1.321
   78    H    GLY   9           HN       GLY   9  -9.823   2.546   1.959
   79   1HA   GLY   9          HA2       GLY   9 -11.543   1.266  -0.053
   80   2HA   GLY   9          HA1       GLY   9 -11.398   0.790   1.643
   81    H    LYS  10           HN       LYS  10 -13.840   1.293   0.023
   82    HA   LYS  10           HA       LYS  10 -15.119   3.737   0.576
   83   1HB   LYS  10          HB2       LYS  10 -16.203   0.909   0.428
   84   2HB   LYS  10          HB1       LYS  10 -17.194   2.363   0.307
   85   1HG   LYS  10          HG2       LYS  10 -15.709   3.080  -1.627
   86   2HG   LYS  10          HG1       LYS  10 -15.010   1.461  -1.585
   87   1HD   LYS  10          HD2       LYS  10 -16.968   0.446  -2.308
   88   2HD   LYS  10          HD1       LYS  10 -17.992   1.732  -1.670
   89   1HE   LYS  10          HE2       LYS  10 -17.818   2.982  -3.579
   90   2HE   LYS  10          HE1       LYS  10 -16.105   2.573  -3.801
   91   1HZ   LYS  10          HZ1       LYS  10 -18.379   0.709  -4.243
   92   2HZ   LYS  10          HZ2       LYS  10 -16.734   0.359  -4.489
   93   3HZ   LYS  10          HZ3       LYS  10 -17.520   1.499  -5.474
   94    H    THR  11           HN       THR  11 -14.630   0.924   2.653
   95    HA   THR  11           HA       THR  11 -16.011   2.377   4.889
   96    HB   THR  11           HB       THR  11 -15.581  -0.602   4.502
   97    HG1  THR  11           HG1      THR  11 -17.820   1.051   3.961
   98   1HG2  THR  11          HG21      THR  11 -15.919   0.129   6.835
   99   2HG2  THR  11          HG22      THR  11 -17.307  -0.788   6.249
  100   3HG2  THR  11          HG23      THR  11 -17.392   0.971   6.356
  101    H    LEU  12           HN       LEU  12 -13.223   0.383   3.954
  102    HA   LEU  12           HA       LEU  12 -11.975   0.746   6.626
  103   1HB   LEU  12          HB2       LEU  12 -11.241  -0.802   4.122
  104   2HB   LEU  12          HB1       LEU  12 -10.299  -0.834   5.613
  105    HG   LEU  12           HG       LEU  12 -13.231  -1.397   5.788
  106   1HD1  LEU  12          HD11      LEU  12 -11.903  -2.742   3.876
  107   2HD1  LEU  12          HD12      LEU  12 -13.126  -3.511   4.888
  108   3HD1  LEU  12          HD13      LEU  12 -11.415  -3.704   5.272
  109   1HD2  LEU  12          HD21      LEU  12 -10.702  -2.032   7.265
  110   2HD2  LEU  12          HD22      LEU  12 -12.056  -3.153   7.406
  111   3HD2  LEU  12          HD23      LEU  12 -12.252  -1.469   7.892
  112    H    LYS  13           HN       LYS  13  -9.945   1.813   6.867
  113    HA   LYS  13           HA       LYS  13  -8.627   3.096   4.576
  114   1HB   LYS  13          HB2       LYS  13 -10.685   4.402   6.197
  115   2HB   LYS  13          HB1       LYS  13  -9.164   5.293   6.230
  116   1HG   LYS  13          HG2       LYS  13  -9.218   5.747   3.967
  117   2HG   LYS  13          HG1       LYS  13 -10.130   4.286   3.587
  118   1HD   LYS  13          HD2       LYS  13 -12.172   5.248   4.148
  119   2HD   LYS  13          HD1       LYS  13 -11.434   6.420   5.240
  120   1HE   LYS  13          HE2       LYS  13 -10.570   7.715   3.378
  121   2HE   LYS  13          HE1       LYS  13 -11.095   6.475   2.221
  122   1HZ   LYS  13          HZ1       LYS  13 -13.357   6.814   2.844
  123   2HZ   LYS  13          HZ2       LYS  13 -12.700   8.339   2.485
  124   3HZ   LYS  13          HZ3       LYS  13 -12.924   7.866   4.102
  125    H    GLY  14           HN       GLY  14  -7.021   4.883   5.756
  126   1HA   GLY  14          HA2       GLY  14  -5.854   5.101   8.038
  127   2HA   GLY  14          HA1       GLY  14  -5.690   3.347   7.946
  128    H    GLU  15           HN       GLU  15  -3.448   3.232   7.794
  129    HA   GLU  15           HA       GLU  15  -2.271   3.855   5.182
  130   1HB   GLU  15          HB2       GLU  15  -0.593   5.416   6.133
  131   2HB   GLU  15          HB1       GLU  15  -2.229   6.031   6.350
  132   1HG   GLU  15          HG2       GLU  15  -2.019   4.677   8.653
  133   2HG   GLU  15          HG1       GLU  15  -0.306   5.004   8.387
  134    H    THR  16           HN       THR  16   0.184   3.242   5.275
  135    HA   THR  16           HA       THR  16   1.065   1.514   7.455
  136    HB   THR  16           HB       THR  16  -0.666   0.110   6.419
  137    HG1  THR  16           HG1      THR  16   0.973  -1.112   7.121
  138   1HG2  THR  16          HG21      THR  16   0.909   0.677   3.899
  139   2HG2  THR  16          HG22      THR  16  -0.809   0.946   4.195
  140   3HG2  THR  16          HG23      THR  16  -0.191  -0.697   4.034
  141    H    THR  17           HN       THR  17   3.255   0.929   7.222
  142    HA   THR  17           HA       THR  17   4.633   1.766   4.693
  143    HB   THR  17           HB       THR  17   6.420   2.682   6.187
  144    HG1  THR  17           HG1      THR  17   6.049   1.546   8.043
  145   1HG2  THR  17          HG21      THR  17   4.925   4.320   5.367
  146   2HG2  THR  17          HG22      THR  17   4.965   4.602   7.107
  147   3HG2  THR  17          HG23      THR  17   3.605   3.745   6.384
  148    H    THR  18           HN       THR  18   6.692   0.616   4.364
  149    HA   THR  18           HA       THR  18   7.204  -1.696   6.140
  150    HB   THR  18           HB       THR  18   5.843  -1.698   3.535
  151    HG1  THR  18           HG1      THR  18   5.135  -2.788   5.376
  152   1HG2  THR  18          HG21      THR  18   8.235  -3.542   3.821
  153   2HG2  THR  18          HG22      THR  18   8.079  -2.221   2.662
  154   3HG2  THR  18          HG23      THR  18   7.007  -3.621   2.555
  155    H    GLU  19           HN       GLU  19   9.341  -2.683   5.627
  156    HA   GLU  19           HA       GLU  19  11.208  -0.744   4.297
  157   1HB   GLU  19          HB2       GLU  19  11.263  -1.073   6.842
  158   2HB   GLU  19          HB1       GLU  19  11.839  -2.709   6.515
  159   1HG   GLU  19          HG2       GLU  19  13.522  -1.322   4.920
  160   2HG   GLU  19          HG1       GLU  19  13.233  -0.106   6.166
  161    H    ALA  20           HN       ALA  20  11.916  -1.631   2.388
  162    HA   ALA  20           HA       ALA  20  12.812  -4.462   2.349
  163   1HB   ALA  20          HB1       ALA  20  11.349  -4.469   0.092
  164   2HB   ALA  20          HB2       ALA  20  10.410  -3.296   1.019
  165   3HB   ALA  20          HB3       ALA  20  10.661  -4.924   1.652
  166    H    VAL  21           HN       VAL  21  13.620  -4.921  -0.034
  167    HA   VAL  21           HA       VAL  21  15.773  -3.167  -0.641
  168    HB   VAL  21           HB       VAL  21  15.934  -4.553  -2.695
  169   1HG1  VAL  21          HG11      VAL  21  16.484  -5.385  -0.297
  170   2HG1  VAL  21          HG12      VAL  21  16.366  -6.583  -1.586
  171   3HG1  VAL  21          HG13      VAL  21  15.025  -6.361  -0.463
  172   1HG2  VAL  21          HG21      VAL  21  13.113  -5.286  -1.899
  173   2HG2  VAL  21          HG22      VAL  21  14.102  -6.408  -2.831
  174   3HG2  VAL  21          HG23      VAL  21  13.728  -4.813  -3.482
  175    H    ASP  22           HN       ASP  22  12.523  -3.403  -2.081
  176    HA   ASP  22           HA       ASP  22  12.781  -0.634  -3.109
  177   1HB   ASP  22          HB2       ASP  22  12.197  -3.069  -4.833
  178   2HB   ASP  22          HB1       ASP  22  12.142  -1.397  -5.389
  179    H    ALA  23           HN       ALA  23  10.647   0.228  -3.731
  180    HA   ALA  23           HA       ALA  23   8.511  -0.537  -1.996
  181   1HB   ALA  23          HB1       ALA  23   9.005   1.293  -4.270
  182   2HB   ALA  23          HB2       ALA  23   8.216   1.613  -2.726
  183   3HB   ALA  23          HB3       ALA  23   7.315   0.850  -4.035
  184    H    ALA  24           HN       ALA  24   9.398  -1.619  -5.221
  185    HA   ALA  24           HA       ALA  24   6.921  -2.781  -6.052
  186   1HB   ALA  24          HB1       ALA  24   9.747  -3.773  -6.555
  187   2HB   ALA  24          HB2       ALA  24   9.025  -2.404  -7.399
  188   3HB   ALA  24          HB3       ALA  24   8.343  -4.018  -7.593
  189    H    THR  25           HN       THR  25   9.651  -4.142  -4.198
  190    HA   THR  25           HA       THR  25   8.489  -6.760  -3.828
  191    HB   THR  25           HB       THR  25  10.640  -5.142  -2.421
  192    HG1  THR  25           HG1      THR  25  11.673  -5.820  -4.093
  193   1HG2  THR  25          HG21      THR  25   9.673  -6.813  -0.846
  194   2HG2  THR  25          HG22      THR  25  11.336  -7.203  -1.296
  195   3HG2  THR  25          HG23      THR  25   9.995  -8.082  -2.031
  196    H    ALA  26           HN       ALA  26   8.699  -3.882  -1.687
  197    HA   ALA  26           HA       ALA  26   7.257  -4.965   0.511
  198   1HB   ALA  26          HB1       ALA  26   6.780  -2.463   0.927
  199   2HB   ALA  26          HB2       ALA  26   7.636  -2.169  -0.592
  200   3HB   ALA  26          HB3       ALA  26   8.478  -2.922   0.762
  201    H    GLU  27           HN       GLU  27   6.049  -2.811  -2.079
  202    HA   GLU  27           HA       GLU  27   3.365  -2.629  -1.526
  203   1HB   GLU  27          HB2       GLU  27   4.602  -1.636  -3.441
  204   2HB   GLU  27          HB1       GLU  27   4.614  -3.212  -4.232
  205   1HG   GLU  27          HG2       GLU  27   2.000  -3.075  -3.835
  206   2HG   GLU  27          HG1       GLU  27   2.320  -1.342  -3.770
  207    H    LYS  28           HN       LYS  28   4.948  -5.510  -2.912
  208    HA   LYS  28           HA       LYS  28   2.547  -6.980  -3.538
  209   1HB   LYS  28          HB2       LYS  28   5.310  -7.919  -2.664
  210   2HB   LYS  28          HB1       LYS  28   4.110  -8.915  -3.485
  211   1HG   LYS  28          HG2       LYS  28   4.379  -7.811  -5.512
  212   2HG   LYS  28          HG1       LYS  28   4.947  -6.327  -4.748
  213   1HD   LYS  28          HD2       LYS  28   6.976  -7.107  -5.503
  214   2HD   LYS  28          HD1       LYS  28   6.923  -7.968  -3.964
  215   1HE   LYS  28          HE2       LYS  28   7.363  -9.742  -5.416
  216   2HE   LYS  28          HE1       LYS  28   5.589  -9.766  -5.435
  217   1HZ   LYS  28          HZ1       LYS  28   5.575  -8.358  -7.356
  218   2HZ   LYS  28          HZ2       LYS  28   6.582  -9.686  -7.687
  219   3HZ   LYS  28          HZ3       LYS  28   7.261  -8.176  -7.307
  220    H    VAL  29           HN       VAL  29   4.619  -6.801  -0.657
  221    HA   VAL  29           HA       VAL  29   3.063  -8.622   0.982
  222    HB   VAL  29           HB       VAL  29   5.151  -6.462   1.406
  223   1HG1  VAL  29          HG11      VAL  29   3.677  -6.415   3.404
  224   2HG1  VAL  29          HG12      VAL  29   5.276  -7.058   3.787
  225   3HG1  VAL  29          HG13      VAL  29   3.906  -8.155   3.599
  226   1HG2  VAL  29          HG21      VAL  29   6.620  -8.259   1.775
  227   2HG2  VAL  29          HG22      VAL  29   5.570  -8.858   0.491
  228   3HG2  VAL  29          HG23      VAL  29   5.308  -9.374   2.157
  229    H    LEU  30           HN       LEU  30   3.154  -5.060   0.591
  230    HA   LEU  30           HA       LEU  30   1.228  -4.368   2.560
  231   1HB   LEU  30          HB2       LEU  30   2.144  -3.203  -0.071
  232   2HB   LEU  30          HB1       LEU  30   0.898  -2.396   0.869
  233    HG   LEU  30           HG       LEU  30   3.381  -1.676   1.203
  234   1HD1  LEU  30          HD11      LEU  30   1.691  -0.792   2.637
  235   2HD1  LEU  30          HD12      LEU  30   3.003  -1.366   3.674
  236   3HD1  LEU  30          HD13      LEU  30   1.529  -2.327   3.494
  237   1HD2  LEU  30          HD21      LEU  30   4.460  -2.936   3.097
  238   2HD2  LEU  30          HD22      LEU  30   4.482  -3.751   1.549
  239   3HD2  LEU  30          HD23      LEU  30   3.339  -4.245   2.795
  240    H    LYS  31           HN       LYS  31   0.889  -5.656  -0.695
  241    HA   LYS  31           HA       LYS  31  -1.942  -5.228  -1.082
  242   1HB   LYS  31          HB2       LYS  31   0.055  -6.145  -2.616
  243   2HB   LYS  31          HB1       LYS  31  -0.464  -7.689  -1.987
  244   1HG   LYS  31          HG2       LYS  31  -2.435  -5.747  -3.196
  245   2HG   LYS  31          HG1       LYS  31  -1.552  -6.904  -4.191
  246   1HD   LYS  31          HD2       LYS  31  -3.369  -7.580  -1.855
  247   2HD   LYS  31          HD1       LYS  31  -3.729  -7.840  -3.560
  248   1HE   LYS  31          HE2       LYS  31  -1.225  -9.073  -3.148
  249   2HE   LYS  31          HE1       LYS  31  -2.219  -9.537  -1.747
  250   1HZ   LYS  31          HZ1       LYS  31  -3.182  -9.628  -4.560
  251   2HZ   LYS  31          HZ2       LYS  31  -3.973 -10.234  -3.183
  252   3HZ   LYS  31          HZ3       LYS  31  -2.551 -10.975  -3.745
  253    H    GLN  32           HN       GLN  32   0.024  -7.802   0.338
  254    HA   GLN  32           HA       GLN  32  -1.958  -9.701   1.013
  255   1HB   GLN  32          HB2       GLN  32   0.684  -9.517   1.262
  256   2HB   GLN  32          HB1       GLN  32   0.253  -9.072   2.911
  257   1HG   GLN  32          HG2       GLN  32  -1.124 -11.143   3.078
  258   2HG   GLN  32          HG1       GLN  32  -0.579 -11.602   1.464
  259   1HE2  GLN  32          HE21      GLN  32  -0.022 -12.670   4.377
  260   2HE2  GLN  32          HE22      GLN  32   1.674 -12.860   4.384
  261    H    TYR  33           HN       TYR  33  -0.824  -6.823   2.778
  262    HA   TYR  33           HA       TYR  33  -2.482  -7.103   5.123
  263   1HB   TYR  33          HB2       TYR  33  -0.532  -5.611   4.960
  264   2HB   TYR  33          HB1       TYR  33  -1.321  -4.684   3.683
  265    HD1  TYR  33           HD1      TYR  33  -1.548  -5.677   7.244
  266    HD2  TYR  33           HD2      TYR  33  -2.904  -2.982   4.194
  267    HE1  TYR  33           HE1      TYR  33  -2.672  -4.308   8.964
  268    HE2  TYR  33           HE2      TYR  33  -4.027  -1.600   5.917
  269    HH   TYR  33           HH       TYR  33  -4.489  -2.685   9.131
  270    H    ILE  34           HN       ILE  34  -2.913  -5.512   1.985
  271    HA   ILE  34           HA       ILE  34  -5.541  -4.409   2.480
  272    HB   ILE  34           HB       ILE  34  -4.095  -5.242  -0.057
  273   1HG1  ILE  34          HG12      ILE  34  -2.990  -3.559   1.570
  274   2HG1  ILE  34          HG11      ILE  34  -3.124  -3.091  -0.119
  275   1HG2  ILE  34          HG21      ILE  34  -6.444  -3.367   0.326
  276   2HG2  ILE  34          HG22      ILE  34  -6.483  -4.939  -0.472
  277   3HG2  ILE  34          HG23      ILE  34  -5.575  -3.609  -1.190
  278   1HD1  ILE  34          HD11      ILE  34  -4.823  -1.547   0.315
  279   2HD1  ILE  34          HD12      ILE  34  -3.815  -1.390   1.754
  280   3HD1  ILE  34          HD13      ILE  34  -5.300  -2.341   1.816
  281    H    ASN  35           HN       ASN  35  -4.308  -7.535   1.440
  282    HA   ASN  35           HA       ASN  35  -6.600  -8.714   0.275
  283   1HB   ASN  35          HB2       ASN  35  -4.159  -9.517   0.546
  284   2HB   ASN  35          HB1       ASN  35  -4.676 -10.138   2.113
  285   1HD2  ASN  35          HD21      ASN  35  -6.088 -11.991   2.145
  286   2HD2  ASN  35          HD22      ASN  35  -6.486 -12.856   0.740
  287    H    ASP  36           HN       ASP  36  -5.855  -8.047   3.643
  288    HA   ASP  36           HA       ASP  36  -7.917  -9.793   4.757
  289   1HB   ASP  36          HB2       ASP  36  -5.736  -8.948   5.818
  290   2HB   ASP  36          HB1       ASP  36  -6.566  -7.407   6.040
  291    H    ASN  37           HN       ASN  37  -7.571  -6.225   4.579
  292    HA   ASN  37           HA       ASN  37 -10.226  -5.599   5.432
  293   1HB   ASN  37          HB2       ASN  37  -8.166  -4.180   3.720
  294   2HB   ASN  37          HB1       ASN  37  -9.668  -3.407   4.239
  295   1HD2  ASN  37          HD21      ASN  37  -6.751  -2.889   5.044
  296   2HD2  ASN  37          HD22      ASN  37  -6.769  -2.969   6.748
  297    H    GLY  38           HN       GLY  38  -8.912  -6.479   2.286
  298   1HA   GLY  38          HA2       GLY  38 -10.116  -7.276   0.404
  299   2HA   GLY  38          HA1       GLY  38 -11.620  -6.884   1.237
  300    H    ILE  39           HN       ILE  39  -8.915  -4.661   0.693
  301    HA   ILE  39           HA       ILE  39 -10.743  -3.004  -1.018
  302    HB   ILE  39           HB       ILE  39  -8.495  -2.191   0.858
  303   1HG1  ILE  39          HG12      ILE  39 -10.467  -3.048   2.071
  304   2HG1  ILE  39          HG11      ILE  39 -10.320  -1.301   2.281
  305   1HG2  ILE  39          HG21      ILE  39 -10.561  -0.422  -0.468
  306   2HG2  ILE  39          HG22      ILE  39  -8.965  -0.705  -1.161
  307   3HG2  ILE  39          HG23      ILE  39  -9.117   0.076   0.413
  308   1HD1  ILE  39          HD11      ILE  39 -11.956  -1.031   0.364
  309   2HD1  ILE  39          HD12      ILE  39 -12.639  -1.769   1.813
  310   3HD1  ILE  39          HD13      ILE  39 -12.214  -2.774   0.427
  311    H    ASP  40           HN       ASP  40  -9.742  -4.431  -2.788
  312    HA   ASP  40           HA       ASP  40  -7.036  -3.405  -3.589
  313   1HB   ASP  40          HB2       ASP  40  -8.490  -6.006  -4.183
  314   2HB   ASP  40          HB1       ASP  40  -6.900  -5.577  -4.825
  315    H    GLY  41           HN       GLY  41  -7.757  -1.619  -4.842
  316   1HA   GLY  41          HA2       GLY  41  -9.405  -2.341  -7.235
  317   2HA   GLY  41          HA1       GLY  41  -9.601  -0.798  -6.398
  318    H    GLU  42           HN       GLU  42  -7.891   0.775  -6.559
  319    HA   GLU  42           HA       GLU  42  -5.884   0.221  -8.720
  320   1HB   GLU  42          HB2       GLU  42  -8.090   2.148  -8.522
  321   2HB   GLU  42          HB1       GLU  42  -6.549   2.923  -8.889
  322   1HG   GLU  42          HG2       GLU  42  -6.373   1.922 -10.940
  323   2HG   GLU  42          HG1       GLU  42  -7.161   0.438 -10.400
  324    H    TRP  43           HN       TRP  43  -3.864   0.501  -7.900
  325    HA   TRP  43           HA       TRP  43  -3.464   2.224  -5.500
  326   1HB   TRP  43          HB2       TRP  43  -1.774   0.181  -6.978
  327   2HB   TRP  43          HB1       TRP  43  -1.181   1.110  -5.614
  328    HD1  TRP  43           HD1      TRP  43  -4.779  -0.241  -5.606
  329    HE1  TRP  43           HE1      TRP  43  -4.947  -2.071  -3.816
  330    HE3  TRP  43           HE3      TRP  43   0.119  -0.600  -4.273
  331    HZ2  TRP  43           HZ2      TRP  43  -3.241  -3.472  -2.013
  332    HZ3  TRP  43           HZ3      TRP  43   0.822  -2.181  -2.490
  333    HH2  TRP  43           HH2      TRP  43  -0.847  -3.612  -1.364
  334    H    THR  44           HN       THR  44  -1.523   3.675  -5.547
  335    HA   THR  44           HA       THR  44  -0.552   4.479  -8.231
  336    HB   THR  44           HB       THR  44  -1.206   6.820  -7.834
  337    HG1  THR  44           HG1      THR  44  -2.553   7.264  -6.051
  338   1HG2  THR  44          HG21      THR  44  -3.525   6.587  -8.310
  339   2HG2  THR  44          HG22      THR  44  -3.642   5.090  -7.385
  340   3HG2  THR  44          HG23      THR  44  -2.777   5.112  -8.922
  341    H    TYR  45           HN       TYR  45   1.588   4.962  -8.075
  342    HA   TYR  45           HA       TYR  45   2.858   5.016  -5.411
  343   1HB   TYR  45          HB2       TYR  45   3.731   3.662  -7.286
  344   2HB   TYR  45          HB1       TYR  45   3.940   5.121  -8.252
  345    HD1  TYR  45           HD1      TYR  45   6.140   5.843  -8.400
  346    HD2  TYR  45           HD2      TYR  45   4.766   4.070  -4.739
  347    HE1  TYR  45           HE1      TYR  45   8.376   6.197  -7.391
  348    HE2  TYR  45           HE2      TYR  45   7.003   4.421  -3.728
  349    HH   TYR  45           HH       TYR  45   9.508   4.672  -4.854
  350    H    ASP  46           HN       ASP  46   4.499   6.766  -4.946
  351    HA   ASP  46           HA       ASP  46   3.941   9.358  -6.335
  352   1HB   ASP  46          HB2       ASP  46   4.033   8.932  -3.326
  353   2HB   ASP  46          HB1       ASP  46   3.702  10.449  -4.156
  354    H    ASP  47           HN       ASP  47   5.840  10.363  -6.842
  355    HA   ASP  47           HA       ASP  47   8.404   9.261  -6.037
  356   1HB   ASP  47          HB2       ASP  47   9.253  11.165  -7.394
  357   2HB   ASP  47          HB1       ASP  47   7.974  10.285  -8.230
  358    H    ALA  48           HN       ALA  48   6.263  11.358  -4.426
  359    HA   ALA  48           HA       ALA  48   7.907  13.341  -3.258
  360   1HB   ALA  48          HB1       ALA  48   6.160  12.862  -1.303
  361   2HB   ALA  48          HB2       ALA  48   5.426  11.820  -2.526
  362   3HB   ALA  48          HB3       ALA  48   5.626  13.546  -2.838
  363    H    THR  49           HN       THR  49   6.847  10.438  -1.479
  364    HA   THR  49           HA       THR  49   9.618  10.135  -0.376
  365    HB   THR  49           HB       THR  49   8.162  11.400   1.177
  366    HG1  THR  49           HG1      THR  49   8.761  10.229   2.853
  367   1HG2  THR  49          HG21      THR  49   5.983  10.634   0.441
  368   2HG2  THR  49          HG22      THR  49   6.168  10.208   2.144
  369   3HG2  THR  49          HG23      THR  49   6.368   8.974   0.898
  370    H    LYS  50           HN       LYS  50   8.320   8.625  -2.492
  371    HA   LYS  50           HA       LYS  50   7.908   6.401  -3.129
  372   1HB   LYS  50          HB2       LYS  50   9.297   5.895  -0.475
  373   2HB   LYS  50          HB1       LYS  50   9.118   4.723  -1.778
  374   1HG   LYS  50          HG2       LYS  50  10.815   5.624  -2.985
  375   2HG   LYS  50          HG1       LYS  50  10.294   7.276  -2.655
  376   1HD   LYS  50          HD2       LYS  50  12.470   6.923  -1.626
  377   2HD   LYS  50          HD1       LYS  50  11.257   7.067  -0.353
  378   1HE   LYS  50          HE2       LYS  50  11.185   4.375  -0.786
  379   2HE   LYS  50          HE1       LYS  50  12.891   4.720  -1.131
  380   1HZ   LYS  50          HZ1       LYS  50  11.376   5.553   1.287
  381   2HZ   LYS  50          HZ2       LYS  50  12.968   6.030   0.933
  382   3HZ   LYS  50          HZ3       LYS  50  12.613   4.395   1.228
  383    H    THR  51           HN       THR  51   5.678   7.587  -2.085
  384    HA   THR  51           HA       THR  51   4.548   5.830   0.023
  385    HB   THR  51           HB       THR  51   2.969   7.936  -1.404
  386    HG1  THR  51           HG1      THR  51   4.481   9.341  -1.107
  387   1HG2  THR  51          HG21      THR  51   1.770   7.908   0.507
  388   2HG2  THR  51          HG22      THR  51   3.216   8.034   1.507
  389   3HG2  THR  51          HG23      THR  51   2.679   6.457   0.930
  390    H    TRP  52           HN       TRP  52   1.925   5.623  -0.701
  391    HA   TRP  52           HA       TRP  52   1.699   4.584  -3.459
  392   1HB   TRP  52          HB2       TRP  52   1.833   2.939  -0.943
  393   2HB   TRP  52          HB1       TRP  52   0.907   2.375  -2.330
  394    HD1  TRP  52           HD1      TRP  52   4.422   2.773  -1.068
  395    HE1  TRP  52           HE1      TRP  52   6.067   1.826  -2.820
  396    HE3  TRP  52           HE3      TRP  52   1.217   2.055  -4.927
  397    HZ2  TRP  52           HZ2      TRP  52   6.005   0.876  -5.533
  398    HZ3  TRP  52           HZ3      TRP  52   2.008   1.126  -7.094
  399    HH2  TRP  52           HH2      TRP  52   4.399   0.535  -7.397
  400    H    THR  53           HN       THR  53  -0.597   3.251  -3.390
  401    HA   THR  53           HA       THR  53  -2.581   4.492  -1.605
  402    HB   THR  53           HB       THR  53  -2.784   4.909  -4.596
  403    HG1  THR  53           HG1      THR  53  -1.461   6.508  -4.403
  404   1HG2  THR  53          HG21      THR  53  -4.896   5.275  -3.721
  405   2HG2  THR  53          HG22      THR  53  -4.202   6.887  -3.553
  406   3HG2  THR  53          HG23      THR  53  -4.271   5.807  -2.161
  407    H    VAL  54           HN       VAL  54  -4.856   3.673  -2.300
  408    HA   VAL  54           HA       VAL  54  -5.058   1.310  -3.975
  409    HB   VAL  54           HB       VAL  54  -3.774   0.295  -2.193
  410   1HG1  VAL  54          HG11      VAL  54  -3.808   1.571  -0.308
  411   2HG1  VAL  54          HG12      VAL  54  -5.064   0.431   0.172
  412   3HG1  VAL  54          HG13      VAL  54  -5.505   2.000  -0.499
  413   1HG2  VAL  54          HG21      VAL  54  -6.131  -0.736  -2.957
  414   2HG2  VAL  54          HG22      VAL  54  -6.495  -0.495  -1.248
  415   3HG2  VAL  54          HG23      VAL  54  -5.130  -1.511  -1.723
  416    H    THR  55           HN       THR  55  -6.851   2.711  -4.656
  417    HA   THR  55           HA       THR  55  -9.062   3.180  -2.750
  418    HB   THR  55           HB       THR  55  -8.994   3.699  -5.728
  419    HG1  THR  55           HG1      THR  55  -7.749   5.413  -5.389
  420   1HG2  THR  55          HG21      THR  55 -10.448   5.564  -5.132
  421   2HG2  THR  55          HG22      THR  55 -10.241   5.211  -3.416
  422   3HG2  THR  55          HG23      THR  55 -11.104   4.074  -4.453
  423    H    GLU  56           HN       GLU  56 -10.819   1.831  -2.598
  424    HA   GLU  56           HA       GLU  56 -10.934  -0.703  -3.950
  425   1HB   GLU  56          HB2       GLU  56 -11.977   0.258  -1.713
  426   2HB   GLU  56          HB1       GLU  56 -13.344   0.638  -2.761
  427   1HG   GLU  56          HG2       GLU  56 -13.190  -1.800  -3.565
  428   2HG   GLU  56          HG1       GLU  56 -12.140  -2.070  -2.173
  Start of MODEL   13
    1   1H    THR   1          HT1       THR   1  14.274   5.440   6.055
    2   2H    THR   1          HT2       THR   1  15.424   6.094   4.990
    3   3H    THR   1          HT3       THR   1  15.352   4.415   5.239
    4    HA   THR   1           HA       THR   1  13.351   6.114   3.841
    5    HB   THR   1           HB       THR   1  14.018   4.582   1.984
    6    HG1  THR   1           HG1      THR   1  14.690   2.807   3.114
    7   1HG2  THR   1          HG21      THR   1  16.450   5.834   3.277
    8   2HG2  THR   1          HG22      THR   1  15.195   6.779   2.475
    9   3HG2  THR   1          HG23      THR   1  16.141   5.609   1.555
   10    H    THR   2           HN       THR   2  11.286   5.418   4.189
   11    HA   THR   2           HA       THR   2  10.817   2.498   4.679
   12    HB   THR   2           HB       THR   2   9.439   4.813   6.074
   13    HG1  THR   2           HG1      THR   2  10.770   4.212   7.835
   14   1HG2  THR   2          HG21      THR   2   9.580   1.892   6.846
   15   2HG2  THR   2          HG22      THR   2   8.274   2.561   5.866
   16   3HG2  THR   2          HG23      THR   2   8.523   3.136   7.515
   17    H    PHE   3           HN       PHE   3   9.223   1.691   3.366
   18    HA   PHE   3           HA       PHE   3   7.941   3.324   1.356
   19   1HB   PHE   3          HB2       PHE   3   7.371   0.512   2.363
   20   2HB   PHE   3          HB1       PHE   3   6.788   1.182   0.840
   21    HD1  PHE   3           HD1      PHE   3   8.951   2.568  -0.364
   22    HD2  PHE   3           HD2      PHE   3   9.103  -1.014   2.012
   23    HE1  PHE   3           HE1      PHE   3  11.085   1.930  -1.452
   24    HE2  PHE   3           HE2      PHE   3  11.236  -1.645   0.921
   25    HZ   PHE   3           HZ       PHE   3  12.228  -0.173  -0.809
   26    H    LYS   4           HN       LYS   4   5.614   3.717   1.164
   27    HA   LYS   4           HA       LYS   4   4.075   3.563   3.730
   28   1HB   LYS   4          HB2       LYS   4   5.276   5.800   3.202
   29   2HB   LYS   4          HB1       LYS   4   4.090   5.977   1.913
   30   1HG   LYS   4          HG2       LYS   4   2.286   5.611   3.652
   31   2HG   LYS   4          HG1       LYS   4   3.546   5.729   4.877
   32   1HD   LYS   4          HD2       LYS   4   3.350   7.967   4.818
   33   2HD   LYS   4          HD1       LYS   4   3.938   7.941   3.156
   34   1HE   LYS   4          HE2       LYS   4   1.580   7.542   2.380
   35   2HE   LYS   4          HE1       LYS   4   1.040   7.750   4.057
   36   1HZ   LYS   4          HZ1       LYS   4   0.972   9.861   2.888
   37   2HZ   LYS   4          HZ2       LYS   4   2.613   9.715   2.473
   38   3HZ   LYS   4          HZ3       LYS   4   2.158   9.905   4.099
   39    H    LEU   5           HN       LEU   5   1.774   3.525   3.414
   40    HA   LEU   5           HA       LEU   5   0.696   3.541   0.659
   41   1HB   LEU   5          HB2       LEU   5   1.646   1.192   1.520
   42   2HB   LEU   5          HB1       LEU   5   0.096   1.137   2.347
   43    HG   LEU   5           HG       LEU   5  -0.204   2.018  -0.423
   44   1HD1  LEU   5          HD11      LEU   5   0.540   0.147  -1.609
   45   2HD1  LEU   5          HD12      LEU   5   0.592  -0.870  -0.160
   46   3HD1  LEU   5          HD13      LEU   5   1.834   0.359  -0.423
   47   1HD2  LEU   5          HD21      LEU   5  -2.073   1.284   0.959
   48   2HD2  LEU   5          HD22      LEU   5  -1.312  -0.288   1.208
   49   3HD2  LEU   5          HD23      LEU   5  -1.886   0.170  -0.396
   50    H    ILE   6           HN       ILE   6  -1.405   4.297   0.704
   51    HA   ILE   6           HA       ILE   6  -2.653   4.698   3.393
   52    HB   ILE   6           HB       ILE   6  -2.960   6.071   0.708
   53   1HG1  ILE   6          HG12      ILE   6  -0.823   6.497   1.885
   54   2HG1  ILE   6          HG11      ILE   6  -1.825   7.946   1.831
   55   1HG2  ILE   6          HG21      ILE   6  -5.000   6.653   1.535
   56   2HG2  ILE   6          HG22      ILE   6  -4.076   7.761   2.548
   57   3HG2  ILE   6          HG23      ILE   6  -4.571   6.192   3.182
   58   1HD1  ILE   6          HD11      ILE   6  -2.613   6.658   4.185
   59   2HD1  ILE   6          HD12      ILE   6  -1.560   8.067   4.071
   60   3HD1  ILE   6          HD13      ILE   6  -0.863   6.449   4.140
   61    H    ILE   7           HN       ILE   7  -4.628   3.773   3.817
   62    HA   ILE   7           HA       ILE   7  -5.747   1.864   1.874
   63    HB   ILE   7           HB       ILE   7  -6.549   2.679   4.690
   64   1HG1  ILE   7          HG12      ILE   7  -4.969   0.269   3.738
   65   2HG1  ILE   7          HG11      ILE   7  -4.238   1.715   4.436
   66   1HG2  ILE   7          HG21      ILE   7  -8.426   1.602   3.672
   67   2HG2  ILE   7          HG22      ILE   7  -7.622   0.359   4.630
   68   3HG2  ILE   7          HG23      ILE   7  -7.398   0.406   2.882
   69   1HD1  ILE   7          HD11      ILE   7  -5.933  -0.377   5.754
   70   2HD1  ILE   7          HD12      ILE   7  -5.980   1.272   6.378
   71   3HD1  ILE   7          HD13      ILE   7  -4.454   0.390   6.333
   72    H    ASN   8           HN       ASN   8  -7.254   2.530   0.404
   73    HA   ASN   8           HA       ASN   8  -9.025   4.846   1.118
   74   1HB   ASN   8          HB2       ASN   8  -7.713   3.880  -1.420
   75   2HB   ASN   8          HB1       ASN   8  -9.138   4.918  -1.496
   76   1HD2  ASN   8          HD21      ASN   8  -7.777   6.674  -2.397
   77   2HD2  ASN   8          HD22      ASN   8  -6.742   7.565  -1.375
   78    H    GLY   9           HN       GLY   9  -9.898   2.457   2.073
   79   1HA   GLY   9          HA2       GLY   9 -11.581   1.085   0.094
   80   2HA   GLY   9          HA1       GLY   9 -11.486   0.708   1.819
   81    H    LYS  10           HN       LYS  10 -13.931   0.980   0.327
   82    HA   LYS  10           HA       LYS  10 -15.241   3.461   0.501
   83   1HB   LYS  10          HB2       LYS  10 -16.230   0.622   0.873
   84   2HB   LYS  10          HB1       LYS  10 -17.295   2.005   0.615
   85   1HG   LYS  10          HG2       LYS  10 -16.121   2.481  -1.525
   86   2HG   LYS  10          HG1       LYS  10 -15.128   1.045  -1.277
   87   1HD   LYS  10          HD2       LYS  10 -16.949  -0.418  -1.551
   88   2HD   LYS  10          HD1       LYS  10 -18.133   0.851  -1.235
   89   1HE   LYS  10          HE2       LYS  10 -17.898   1.786  -3.378
   90   2HE   LYS  10          HE1       LYS  10 -16.298   1.059  -3.621
   91   1HZ   LYS  10          HZ1       LYS  10 -18.159  -0.116  -4.784
   92   2HZ   LYS  10          HZ2       LYS  10 -18.775  -0.534  -3.256
   93   3HZ   LYS  10          HZ3       LYS  10 -17.247  -1.095  -3.742
   94    H    THR  11           HN       THR  11 -14.508   1.131   3.031
   95    HA   THR  11           HA       THR  11 -15.805   2.955   5.033
   96    HB   THR  11           HB       THR  11 -15.550  -0.067   5.131
   97    HG1  THR  11           HG1      THR  11 -17.263  -0.105   3.948
   98   1HG2  THR  11          HG21      THR  11 -16.676   0.017   7.127
   99   2HG2  THR  11          HG22      THR  11 -17.576   1.466   6.677
  100   3HG2  THR  11          HG23      THR  11 -15.901   1.599   7.213
  101    H    LEU  12           HN       LEU  12 -13.233   0.552   4.446
  102    HA   LEU  12           HA       LEU  12 -11.842   1.235   6.953
  103   1HB   LEU  12          HB2       LEU  12 -11.186  -0.539   4.579
  104   2HB   LEU  12          HB1       LEU  12 -10.245  -0.479   6.070
  105    HG   LEU  12           HG       LEU  12 -13.177  -0.910   6.356
  106   1HD1  LEU  12          HD11      LEU  12 -13.211  -3.110   5.603
  107   2HD1  LEU  12          HD12      LEU  12 -11.462  -3.293   5.743
  108   3HD1  LEU  12          HD13      LEU  12 -12.149  -2.371   4.405
  109   1HD2  LEU  12          HD21      LEU  12 -11.693  -0.806   8.309
  110   2HD2  LEU  12          HD22      LEU  12 -10.692  -2.093   7.638
  111   3HD2  LEU  12          HD23      LEU  12 -12.348  -2.435   8.140
  112    H    LYS  13           HN       LYS  13  -9.944   2.459   7.084
  113    HA   LYS  13           HA       LYS  13  -8.578   3.406   4.645
  114   1HB   LYS  13          HB2       LYS  13 -10.608   4.918   6.147
  115   2HB   LYS  13          HB1       LYS  13  -9.095   5.800   5.948
  116   1HG   LYS  13          HG2       LYS  13  -9.348   5.992   3.685
  117   2HG   LYS  13          HG1       LYS  13 -10.080   4.395   3.529
  118   1HD   LYS  13          HD2       LYS  13 -12.211   5.177   3.932
  119   2HD   LYS  13          HD1       LYS  13 -11.647   6.492   4.964
  120   1HE   LYS  13          HE2       LYS  13 -10.883   6.584   2.069
  121   2HE   LYS  13          HE1       LYS  13 -12.553   6.997   2.506
  122   1HZ   LYS  13          HZ1       LYS  13 -11.789   8.590   4.073
  123   2HZ   LYS  13          HZ2       LYS  13 -10.959   8.900   2.623
  124   3HZ   LYS  13          HZ3       LYS  13 -10.175   8.098   3.900
  125    H    GLY  14           HN       GLY  14  -6.959   5.305   5.576
  126   1HA   GLY  14          HA2       GLY  14  -5.783   5.842   7.792
  127   2HA   GLY  14          HA1       GLY  14  -5.665   4.093   7.983
  128    H    GLU  15           HN       GLU  15  -3.320   4.366   8.037
  129    HA   GLU  15           HA       GLU  15  -2.151   4.425   5.297
  130   1HB   GLU  15          HB2       GLU  15  -0.392   5.979   6.118
  131   2HB   GLU  15          HB1       GLU  15  -1.995   6.702   6.229
  132   1HG   GLU  15          HG2       GLU  15  -1.970   5.689   8.662
  133   2HG   GLU  15          HG1       GLU  15  -0.222   5.686   8.430
  134    H    THR  16           HN       THR  16   0.067   3.467   5.285
  135    HA   THR  16           HA       THR  16   0.927   1.995   7.697
  136    HB   THR  16           HB       THR  16  -0.860   0.594   6.758
  137    HG1  THR  16           HG1      THR  16   0.638  -0.712   7.536
  138   1HG2  THR  16          HG21      THR  16  -0.941   1.265   4.472
  139   2HG2  THR  16          HG22      THR  16  -0.420  -0.419   4.451
  140   3HG2  THR  16          HG23      THR  16   0.760   0.872   4.215
  141    H    THR  17           HN       THR  17   3.080   1.188   7.492
  142    HA   THR  17           HA       THR  17   4.505   1.788   4.929
  143    HB   THR  17           HB       THR  17   6.287   2.848   6.281
  144    HG1  THR  17           HG1      THR  17   5.993   3.116   8.459
  145   1HG2  THR  17          HG21      THR  17   3.786   3.927   5.673
  146   2HG2  THR  17          HG22      THR  17   5.229   4.835   6.122
  147   3HG2  THR  17          HG23      THR  17   4.052   4.384   7.355
  148    H    THR  18           HN       THR  18   6.538   0.573   4.731
  149    HA   THR  18           HA       THR  18   6.942  -1.606   6.703
  150    HB   THR  18           HB       THR  18   5.718  -1.763   4.038
  151    HG1  THR  18           HG1      THR  18   4.863  -2.755   5.832
  152   1HG2  THR  18          HG21      THR  18   6.914  -3.749   3.233
  153   2HG2  THR  18          HG22      THR  18   8.076  -3.606   4.554
  154   3HG2  THR  18          HG23      THR  18   7.994  -2.355   3.311
  155    H    GLU  19           HN       GLU  19   9.058  -2.796   6.102
  156    HA   GLU  19           HA       GLU  19  11.039  -0.889   4.897
  157   1HB   GLU  19          HB2       GLU  19  11.099  -0.987   7.378
  158   2HB   GLU  19          HB1       GLU  19  11.320  -2.735   7.294
  159   1HG   GLU  19          HG2       GLU  19  13.218  -1.090   5.702
  160   2HG   GLU  19          HG1       GLU  19  13.393  -1.011   7.456
  161    H    ALA  20           HN       ALA  20  11.954  -1.835   3.108
  162    HA   ALA  20           HA       ALA  20  12.797  -4.662   3.180
  163   1HB   ALA  20          HB1       ALA  20  10.414  -3.594   1.729
  164   2HB   ALA  20          HB2       ALA  20  10.653  -5.175   2.476
  165   3HB   ALA  20          HB3       ALA  20  11.382  -4.820   0.909
  166    H    VAL  21           HN       VAL  21  13.647  -5.217   0.828
  167    HA   VAL  21           HA       VAL  21  15.793  -3.464   0.174
  168    HB   VAL  21           HB       VAL  21  15.667  -5.878  -0.345
  169   1HG1  VAL  21          HG11      VAL  21  13.806  -5.228  -2.620
  170   2HG1  VAL  21          HG12      VAL  21  13.173  -5.678  -1.037
  171   3HG1  VAL  21          HG13      VAL  21  14.193  -6.804  -1.933
  172   1HG2  VAL  21          HG21      VAL  21  16.949  -5.732  -2.255
  173   2HG2  VAL  21          HG22      VAL  21  16.921  -4.027  -1.807
  174   3HG2  VAL  21          HG23      VAL  21  15.823  -4.630  -3.048
  175    H    ASP  22           HN       ASP  22  12.553  -3.799  -1.227
  176    HA   ASP  22           HA       ASP  22  12.798  -1.119  -2.464
  177   1HB   ASP  22          HB2       ASP  22  13.804  -2.776  -4.017
  178   2HB   ASP  22          HB1       ASP  22  12.300  -3.696  -3.987
  179    H    ALA  23           HN       ALA  23  10.669  -0.337  -3.186
  180    HA   ALA  23           HA       ALA  23   8.488  -1.020  -1.481
  181   1HB   ALA  23          HB1       ALA  23   8.958   0.579  -3.957
  182   2HB   ALA  23          HB2       ALA  23   8.294   1.089  -2.405
  183   3HB   ALA  23          HB3       ALA  23   7.282   0.212  -3.551
  184    H    ALA  24           HN       ALA  24   9.508  -2.344  -4.570
  185    HA   ALA  24           HA       ALA  24   7.081  -3.606  -5.400
  186   1HB   ALA  24          HB1       ALA  24   9.239  -3.317  -6.685
  187   2HB   ALA  24          HB2       ALA  24   8.578  -4.950  -6.771
  188   3HB   ALA  24          HB3       ALA  24   9.934  -4.603  -5.699
  189    H    THR  25           HN       THR  25   9.757  -4.795  -3.354
  190    HA   THR  25           HA       THR  25   8.573  -7.370  -2.790
  191    HB   THR  25           HB       THR  25  10.703  -5.646  -1.481
  192    HG1  THR  25           HG1      THR  25  11.620  -6.418  -3.209
  193   1HG2  THR  25          HG21      THR  25  11.364  -7.601  -0.167
  194   2HG2  THR  25          HG22      THR  25  10.042  -8.542  -0.859
  195   3HG2  THR  25          HG23      THR  25   9.690  -7.178   0.207
  196    H    ALA  26           HN       ALA  26   8.764  -4.323  -0.897
  197    HA   ALA  26           HA       ALA  26   7.269  -5.202   1.353
  198   1HB   ALA  26          HB1       ALA  26   8.492  -3.152   1.462
  199   2HB   ALA  26          HB2       ALA  26   6.794  -2.667   1.532
  200   3HB   ALA  26          HB3       ALA  26   7.700  -2.517   0.020
  201    H    GLU  27           HN       GLU  27   6.122  -3.259  -1.425
  202    HA   GLU  27           HA       GLU  27   3.429  -3.031  -0.946
  203   1HB   GLU  27          HB2       GLU  27   4.704  -2.195  -2.908
  204   2HB   GLU  27          HB1       GLU  27   4.733  -3.829  -3.569
  205   1HG   GLU  27          HG2       GLU  27   2.133  -3.710  -3.304
  206   2HG   GLU  27          HG1       GLU  27   2.394  -1.967  -3.242
  207    H    LYS  28           HN       LYS  28   5.030  -6.022  -2.049
  208    HA   LYS  28           HA       LYS  28   2.638  -7.529  -2.616
  209   1HB   LYS  28          HB2       LYS  28   5.373  -8.396  -1.591
  210   2HB   LYS  28          HB1       LYS  28   4.186  -9.461  -2.343
  211   1HG   LYS  28          HG2       LYS  28   4.497  -8.545  -4.456
  212   2HG   LYS  28          HG1       LYS  28   5.063  -7.002  -3.817
  213   1HD   LYS  28          HD2       LYS  28   7.099  -7.860  -4.457
  214   2HD   LYS  28          HD1       LYS  28   7.009  -8.583  -2.851
  215   1HE   LYS  28          HE2       LYS  28   7.436 -10.497  -4.096
  216   2HE   LYS  28          HE1       LYS  28   5.666 -10.474  -4.227
  217   1HZ   LYS  28          HZ1       LYS  28   7.600  -9.271  -6.136
  218   2HZ   LYS  28          HZ2       LYS  28   5.915  -9.072  -6.222
  219   3HZ   LYS  28          HZ3       LYS  28   6.603 -10.612  -6.423
  220    H    VAL  29           HN       VAL  29   4.635  -7.131   0.301
  221    HA   VAL  29           HA       VAL  29   3.008  -8.792   2.037
  222    HB   VAL  29           HB       VAL  29   5.092  -6.610   2.367
  223   1HG1  VAL  29          HG11      VAL  29   3.778  -8.165   4.622
  224   2HG1  VAL  29          HG12      VAL  29   3.545  -6.442   4.306
  225   3HG1  VAL  29          HG13      VAL  29   5.134  -7.047   4.786
  226   1HG2  VAL  29          HG21      VAL  29   4.992  -9.604   2.764
  227   2HG2  VAL  29          HG22      VAL  29   6.306  -8.617   3.406
  228   3HG2  VAL  29          HG23      VAL  29   6.022  -8.684   1.667
  229    H    LEU  30           HN       LEU  30   3.035  -5.334   1.167
  230    HA   LEU  30           HA       LEU  30   1.098  -4.499   3.109
  231   1HB   LEU  30          HB2       LEU  30   2.088  -3.481   0.439
  232   2HB   LEU  30          HB1       LEU  30   0.833  -2.618   1.313
  233    HG   LEU  30           HG       LEU  30   3.355  -1.938   1.625
  234   1HD1  LEU  30          HD11      LEU  30   1.639  -0.850   2.878
  235   2HD1  LEU  30          HD12      LEU  30   2.892  -1.343   4.024
  236   3HD1  LEU  30          HD13      LEU  30   1.394  -2.274   3.893
  237   1HD2  LEU  30          HD21      LEU  30   3.152  -4.333   3.457
  238   2HD2  LEU  30          HD22      LEU  30   4.287  -3.026   3.711
  239   3HD2  LEU  30          HD23      LEU  30   4.378  -3.980   2.244
  240    H    LYS  31           HN       LYS  31   0.882  -5.915  -0.109
  241    HA   LYS  31           HA       LYS  31  -1.934  -5.531  -0.599
  242   1HB   LYS  31          HB2       LYS  31   0.123  -6.497  -2.025
  243   2HB   LYS  31          HB1       LYS  31  -0.434  -8.020  -1.373
  244   1HG   LYS  31          HG2       LYS  31  -2.337  -6.094  -2.712
  245   2HG   LYS  31          HG1       LYS  31  -1.432  -7.291  -3.636
  246   1HD   LYS  31          HD2       LYS  31  -3.328  -7.881  -1.340
  247   2HD   LYS  31          HD1       LYS  31  -3.649  -8.175  -3.048
  248   1HE   LYS  31          HE2       LYS  31  -1.166  -9.425  -2.524
  249   2HE   LYS  31          HE1       LYS  31  -2.226  -9.859  -1.163
  250   1HZ   LYS  31          HZ1       LYS  31  -2.904 -10.075  -4.055
  251   2HZ   LYS  31          HZ2       LYS  31  -3.973 -10.405  -2.777
  252   3HZ   LYS  31          HZ3       LYS  31  -2.595 -11.371  -3.006
  253    H    GLN  32           HN       GLN  32  -0.036  -8.109   0.934
  254    HA   GLN  32           HA       GLN  32  -2.097  -9.932   1.606
  255   1HB   GLN  32          HB2       GLN  32   0.601  -9.181   2.623
  256   2HB   GLN  32          HB1       GLN  32  -0.398 -10.215   3.645
  257   1HG   GLN  32          HG2       GLN  32  -0.229 -10.916   0.755
  258   2HG   GLN  32          HG1       GLN  32   1.194 -11.233   1.748
  259   1HE2  GLN  32          HE21      GLN  32   1.013 -13.517   1.954
  260   2HE2  GLN  32          HE22      GLN  32  -0.324 -14.286   2.684
  261    H    TYR  33           HN       TYR  33  -0.935  -7.030   3.299
  262    HA   TYR  33           HA       TYR  33  -2.605  -7.249   5.647
  263   1HB   TYR  33          HB2       TYR  33  -0.635  -5.796   5.489
  264   2HB   TYR  33          HB1       TYR  33  -1.377  -4.885   4.174
  265    HD1  TYR  33           HD1      TYR  33  -1.691  -5.778   7.753
  266    HD2  TYR  33           HD2      TYR  33  -2.938  -3.138   4.608
  267    HE1  TYR  33           HE1      TYR  33  -2.817  -4.342   9.414
  268    HE2  TYR  33           HE2      TYR  33  -4.063  -1.688   6.274
  269    HH   TYR  33           HH       TYR  33  -3.882  -1.202   8.713
  270    H    ILE  34           HN       ILE  34  -2.997  -5.694   2.481
  271    HA   ILE  34           HA       ILE  34  -5.575  -4.496   2.942
  272    HB   ILE  34           HB       ILE  34  -4.177  -5.496   0.440
  273   1HG1  ILE  34          HG12      ILE  34  -3.040  -3.763   1.993
  274   2HG1  ILE  34          HG11      ILE  34  -3.151  -3.373   0.282
  275   1HG2  ILE  34          HG21      ILE  34  -6.370  -5.164  -0.290
  276   2HG2  ILE  34          HG22      ILE  34  -5.638  -3.587  -0.587
  277   3HG2  ILE  34          HG23      ILE  34  -6.650  -3.835   0.836
  278   1HD1  ILE  34          HD11      ILE  34  -5.392  -2.492   2.049
  279   2HD1  ILE  34          HD12      ILE  34  -4.695  -1.698   0.636
  280   3HD1  ILE  34          HD13      ILE  34  -3.858  -1.630   2.188
  281    H    ASN  35           HN       ASN  35  -4.517  -7.726   2.025
  282    HA   ASN  35           HA       ASN  35  -6.920  -8.810   0.967
  283   1HB   ASN  35          HB2       ASN  35  -4.565  -9.779   1.073
  284   2HB   ASN  35          HB1       ASN  35  -4.914 -10.222   2.744
  285   1HD2  ASN  35          HD21      ASN  35  -5.620 -10.991  -0.619
  286   2HD2  ASN  35          HD22      ASN  35  -6.545 -12.379  -0.302
  287    H    ASP  36           HN       ASP  36  -5.970  -8.123   4.284
  288    HA   ASP  36           HA       ASP  36  -8.084  -9.713   5.528
  289   1HB   ASP  36          HB2       ASP  36  -5.823  -9.031   6.490
  290   2HB   ASP  36          HB1       ASP  36  -6.484  -7.405   6.669
  291    H    ASN  37           HN       ASN  37  -7.526  -6.185   5.180
  292    HA   ASN  37           HA       ASN  37 -10.068  -5.350   6.191
  293   1HB   ASN  37          HB2       ASN  37  -8.181  -4.083   4.173
  294   2HB   ASN  37          HB1       ASN  37  -9.464  -3.225   5.034
  295   1HD2  ASN  37          HD21      ASN  37  -6.469  -2.841   5.213
  296   2HD2  ASN  37          HD22      ASN  37  -6.094  -3.047   6.864
  297    H    GLY  38           HN       GLY  38  -9.044  -6.449   3.006
  298   1HA   GLY  38          HA2       GLY  38 -10.429  -7.238   1.249
  299   2HA   GLY  38          HA1       GLY  38 -11.842  -6.714   2.166
  300    H    ILE  39           HN       ILE  39  -9.056  -4.684   1.374
  301    HA   ILE  39           HA       ILE  39 -10.861  -3.021  -0.357
  302    HB   ILE  39           HB       ILE  39  -8.604  -2.206   1.506
  303   1HG1  ILE  39          HG12      ILE  39 -10.613  -2.955   2.723
  304   2HG1  ILE  39          HG11      ILE  39 -10.414  -1.207   2.872
  305   1HG2  ILE  39          HG21      ILE  39 -10.501  -0.584  -0.213
  306   2HG2  ILE  39          HG22      ILE  39  -8.744  -0.656  -0.346
  307   3HG2  ILE  39          HG23      ILE  39  -9.491   0.108   1.056
  308   1HD1  ILE  39          HD11      ILE  39 -12.571  -2.742   1.590
  309   2HD1  ILE  39          HD12      ILE  39 -11.951  -1.432   0.586
  310   3HD1  ILE  39          HD13      ILE  39 -12.578  -1.086   2.198
  311    H    ASP  40           HN       ASP  40  -9.894  -4.525  -2.079
  312    HA   ASP  40           HA       ASP  40  -7.182  -3.553  -2.928
  313   1HB   ASP  40          HB2       ASP  40  -7.691  -6.028  -2.189
  314   2HB   ASP  40          HB1       ASP  40  -8.428  -6.154  -3.790
  315    H    GLY  41           HN       GLY  41  -7.776  -1.933  -4.395
  316   1HA   GLY  41          HA2       GLY  41  -9.463  -2.820  -6.699
  317   2HA   GLY  41          HA1       GLY  41  -9.696  -1.228  -5.971
  318    H    GLU  42           HN       GLU  42  -7.979   0.351  -6.197
  319    HA   GLU  42           HA       GLU  42  -5.996  -0.297  -8.354
  320   1HB   GLU  42          HB2       GLU  42  -8.202   1.613  -8.225
  321   2HB   GLU  42          HB1       GLU  42  -6.673   2.424  -8.549
  322   1HG   GLU  42          HG2       GLU  42  -6.900   1.804 -10.702
  323   2HG   GLU  42          HG1       GLU  42  -6.606   0.145 -10.185
  324    H    TRP  43           HN       TRP  43  -3.958  -0.005  -7.578
  325    HA   TRP  43           HA       TRP  43  -3.507   1.797  -5.245
  326   1HB   TRP  43          HB2       TRP  43  -1.849  -0.304  -6.678
  327   2HB   TRP  43          HB1       TRP  43  -1.236   0.664  -5.350
  328    HD1  TRP  43           HD1      TRP  43  -4.839  -0.673  -5.253
  329    HE1  TRP  43           HE1      TRP  43  -4.988  -2.451  -3.410
  330    HE3  TRP  43           HE3      TRP  43   0.076  -1.012  -3.977
  331    HZ2  TRP  43           HZ2      TRP  43  -3.263  -3.810  -1.595
  332    HZ3  TRP  43           HZ3      TRP  43   0.796  -2.545  -2.159
  333    HH2  TRP  43           HH2      TRP  43  -0.860  -3.937  -0.973
  334    H    THR  44           HN       THR  44  -1.518   3.203  -5.387
  335    HA   THR  44           HA       THR  44  -0.613   3.910  -8.119
  336    HB   THR  44           HB       THR  44  -1.230   6.272  -7.791
  337    HG1  THR  44           HG1      THR  44  -2.081   6.957  -5.967
  338   1HG2  THR  44          HG21      THR  44  -3.564   6.054  -8.205
  339   2HG2  THR  44          HG22      THR  44  -3.674   4.586  -7.235
  340   3HG2  THR  44          HG23      THR  44  -2.844   4.555  -8.790
  341    H    TYR  45           HN       TYR  45   1.535   4.372  -8.028
  342    HA   TYR  45           HA       TYR  45   2.878   4.488  -5.410
  343   1HB   TYR  45          HB2       TYR  45   3.771   3.105  -7.207
  344   2HB   TYR  45          HB1       TYR  45   3.800   4.480  -8.309
  345    HD1  TYR  45           HD1      TYR  45   5.208   3.283  -5.052
  346    HD2  TYR  45           HD2      TYR  45   5.714   5.838  -8.465
  347    HE1  TYR  45           HE1      TYR  45   7.492   3.864  -4.277
  348    HE2  TYR  45           HE2      TYR  45   7.997   6.421  -7.693
  349    HH   TYR  45           HH       TYR  45   9.757   4.801  -5.782
  350    H    ASP  46           HN       ASP  46   4.625   6.236  -5.134
  351    HA   ASP  46           HA       ASP  46   3.994   8.815  -6.494
  352   1HB   ASP  46          HB2       ASP  46   4.160   8.470  -3.479
  353   2HB   ASP  46          HB1       ASP  46   3.766   9.949  -4.349
  354    H    ASP  47           HN       ASP  47   5.906   9.745  -7.087
  355    HA   ASP  47           HA       ASP  47   8.466   8.650  -6.260
  356   1HB   ASP  47          HB2       ASP  47   7.358  10.670  -8.102
  357   2HB   ASP  47          HB1       ASP  47   8.971  11.055  -7.504
  358    H    ALA  48           HN       ALA  48   6.367  10.842  -4.716
  359    HA   ALA  48           HA       ALA  48   8.051  12.850  -3.653
  360   1HB   ALA  48          HB1       ALA  48   6.317  12.494  -1.665
  361   2HB   ALA  48          HB2       ALA  48   5.559  11.396  -2.822
  362   3HB   ALA  48          HB3       ALA  48   5.772  13.101  -3.229
  363    H    THR  49           HN       THR  49   6.958  10.065  -1.717
  364    HA   THR  49           HA       THR  49   9.741   9.730  -0.658
  365    HB   THR  49           HB       THR  49   8.352  11.149   0.838
  366    HG1  THR  49           HG1      THR  49   9.109  10.123   2.512
  367   1HG2  THR  49          HG21      THR  49   6.154  10.258   0.133
  368   2HG2  THR  49          HG22      THR  49   6.338  10.193   1.888
  369   3HG2  THR  49          HG23      THR  49   6.533   8.727   0.923
  370    H    LYS  50           HN       LYS  50   8.362   8.152  -2.645
  371    HA   LYS  50           HA       LYS  50   7.864   5.917  -3.147
  372   1HB   LYS  50          HB2       LYS  50   9.217   5.502  -0.461
  373   2HB   LYS  50          HB1       LYS  50   8.975   4.261  -1.688
  374   1HG   LYS  50          HG2       LYS  50  10.319   6.746  -2.606
  375   2HG   LYS  50          HG1       LYS  50  11.245   5.726  -1.507
  376   1HD   LYS  50          HD2       LYS  50   9.848   4.246  -3.646
  377   2HD   LYS  50          HD1       LYS  50  11.097   5.348  -4.222
  378   1HE   LYS  50          HE2       LYS  50  11.864   3.724  -1.862
  379   2HE   LYS  50          HE1       LYS  50  11.637   2.819  -3.372
  380   1HZ   LYS  50          HZ1       LYS  50  13.863   3.659  -3.344
  381   2HZ   LYS  50          HZ2       LYS  50  13.329   5.228  -2.969
  382   3HZ   LYS  50          HZ3       LYS  50  12.988   4.552  -4.490
  383    H    THR  51           HN       THR  51   5.703   7.302  -2.171
  384    HA   THR  51           HA       THR  51   4.438   5.694  -0.019
  385    HB   THR  51           HB       THR  51   3.485   8.080  -1.645
  386    HG1  THR  51           HG1      THR  51   4.699   7.864   0.905
  387   1HG2  THR  51          HG21      THR  51   2.052   8.286   0.549
  388   2HG2  THR  51          HG22      THR  51   2.366   6.555   0.685
  389   3HG2  THR  51          HG23      THR  51   1.534   7.192  -0.734
  390    H    TRP  52           HN       TRP  52   2.109   4.976  -0.491
  391    HA   TRP  52           HA       TRP  52   1.737   4.142  -3.344
  392   1HB   TRP  52          HB2       TRP  52   1.786   2.537  -0.794
  393   2HB   TRP  52          HB1       TRP  52   0.918   1.962  -2.212
  394    HD1  TRP  52           HD1      TRP  52   4.399   2.435  -0.834
  395    HE1  TRP  52           HE1      TRP  52   6.101   1.423  -2.493
  396    HE3  TRP  52           HE3      TRP  52   1.311   1.504  -4.739
  397    HZ2  TRP  52           HZ2      TRP  52   6.123   0.346  -5.161
  398    HZ3  TRP  52           HZ3      TRP  52   2.168   0.483  -6.839
  399    HH2  TRP  52           HH2      TRP  52   4.572  -0.098  -7.050
  400    H    THR  53           HN       THR  53  -0.592   2.821  -3.188
  401    HA   THR  53           HA       THR  53  -2.544   4.183  -1.463
  402    HB   THR  53           HB       THR  53  -2.742   4.480  -4.470
  403    HG1  THR  53           HG1      THR  53  -1.160   5.839  -4.205
  404   1HG2  THR  53          HG21      THR  53  -4.182   6.472  -3.604
  405   2HG2  THR  53          HG22      THR  53  -4.186   5.588  -2.078
  406   3HG2  THR  53          HG23      THR  53  -4.856   4.844  -3.529
  407    H    VAL  54           HN       VAL  54  -4.835   3.369  -2.107
  408    HA   VAL  54           HA       VAL  54  -5.076   0.944  -3.689
  409    HB   VAL  54           HB       VAL  54  -3.789   0.002  -1.863
  410   1HG1  VAL  54          HG11      VAL  54  -5.493   1.801  -0.259
  411   2HG1  VAL  54          HG12      VAL  54  -3.823   1.302  -0.006
  412   3HG1  VAL  54          HG13      VAL  54  -5.142   0.240   0.482
  413   1HG2  VAL  54          HG21      VAL  54  -5.148  -1.787  -1.339
  414   2HG2  VAL  54          HG22      VAL  54  -6.141  -1.056  -2.607
  415   3HG2  VAL  54          HG23      VAL  54  -6.515  -0.755  -0.910
  416    H    THR  55           HN       THR  55  -6.853   2.346  -4.413
  417    HA   THR  55           HA       THR  55  -9.058   2.887  -2.514
  418    HB   THR  55           HB       THR  55  -8.941   3.362  -5.501
  419    HG1  THR  55           HG1      THR  55  -7.660   5.025  -5.164
  420   1HG2  THR  55          HG21      THR  55 -10.241   4.950  -3.274
  421   2HG2  THR  55          HG22      THR  55 -11.082   3.724  -4.223
  422   3HG2  THR  55          HG23      THR  55 -10.459   5.174  -5.010
  423    H    GLU  56           HN       GLU  56 -10.957   1.698  -2.467
  424    HA   GLU  56           HA       GLU  56 -11.050  -0.890  -3.808
  425   1HB   GLU  56          HB2       GLU  56 -11.950  -0.076  -1.490
  426   2HB   GLU  56          HB1       GLU  56 -13.349   0.471  -2.414
  427   1HG   GLU  56          HG2       GLU  56 -12.347  -2.313  -2.868
  428   2HG   GLU  56          HG1       GLU  56 -13.273  -1.983  -1.403
  Start of MODEL   14
    1   1H    THR   1          HT1       THR   1  16.072   2.055   2.210
    2   2H    THR   1          HT2       THR   1  14.721   1.153   1.712
    3   3H    THR   1          HT3       THR   1  15.392   0.903   3.253
    4    HA   THR   1           HA       THR   1  14.744   3.144   3.927
    5    HB   THR   1           HB       THR   1  13.275   4.336   2.204
    6    HG1  THR   1           HG1      THR   1  12.953   2.439   0.929
    7   1HG2  THR   1          HG21      THR   1  15.784   4.726   2.687
    8   2HG2  THR   1          HG22      THR   1  15.139   5.352   1.170
    9   3HG2  THR   1          HG23      THR   1  16.070   3.854   1.181
   10    H    THR   2           HN       THR   2  12.396   3.674   4.473
   11    HA   THR   2           HA       THR   2  10.847   1.144   4.707
   12    HB   THR   2           HB       THR   2  10.297   3.832   5.981
   13    HG1  THR   2           HG1      THR   2  11.627   2.996   7.698
   14   1HG2  THR   2          HG21      THR   2   8.554   2.180   6.285
   15   2HG2  THR   2          HG22      THR   2   9.438   2.331   7.804
   16   3HG2  THR   2          HG23      THR   2   9.737   0.954   6.742
   17    H    PHE   3           HN       PHE   3   9.120   0.815   3.374
   18    HA   PHE   3           HA       PHE   3   8.163   2.956   1.600
   19   1HB   PHE   3          HB2       PHE   3   7.428   0.041   2.019
   20   2HB   PHE   3          HB1       PHE   3   6.778   1.047   0.723
   21    HD1  PHE   3           HD1      PHE   3   8.836   2.550  -0.404
   22    HD2  PHE   3           HD2      PHE   3   9.137  -1.381   1.312
   23    HE1  PHE   3           HE1      PHE   3  10.860   2.108  -1.765
   24    HE2  PHE   3           HE2      PHE   3  11.160  -1.819  -0.052
   25    HZ   PHE   3           HZ       PHE   3  12.022  -0.075  -1.589
   26    H    LYS   4           HN       LYS   4   5.817   3.458   1.454
   27    HA   LYS   4           HA       LYS   4   4.319   3.058   4.021
   28   1HB   LYS   4          HB2       LYS   4   5.629   5.343   3.426
   29   2HB   LYS   4          HB1       LYS   4   4.125   5.652   2.563
   30   1HG   LYS   4          HG2       LYS   4   2.952   4.938   4.754
   31   2HG   LYS   4          HG1       LYS   4   4.531   5.165   5.506
   32   1HD   LYS   4          HD2       LYS   4   3.825   7.319   5.740
   33   2HD   LYS   4          HD1       LYS   4   4.363   7.453   4.065
   34   1HE   LYS   4          HE2       LYS   4   2.220   7.597   3.261
   35   2HE   LYS   4          HE1       LYS   4   1.600   6.419   4.434
   36   1HZ   LYS   4          HZ1       LYS   4   2.001   8.139   6.176
   37   2HZ   LYS   4          HZ2       LYS   4   0.773   8.541   5.072
   38   3HZ   LYS   4          HZ3       LYS   4   2.307   9.258   4.938
   39    H    LEU   5           HN       LEU   5   2.022   3.037   3.756
   40    HA   LEU   5           HA       LEU   5   0.890   3.401   1.036
   41   1HB   LEU   5          HB2       LEU   5   1.772   0.952   1.642
   42   2HB   LEU   5          HB1       LEU   5   0.247   0.868   2.513
   43    HG   LEU   5           HG       LEU   5  -0.148   2.009  -0.138
   44   1HD1  LEU   5          HD11      LEU   5   0.566   0.298  -1.553
   45   2HD1  LEU   5          HD12      LEU   5   0.653  -0.887  -0.238
   46   3HD1  LEU   5          HD13      LEU   5   1.896   0.362  -0.388
   47   1HD2  LEU   5          HD21      LEU   5  -1.178  -0.464   1.288
   48   2HD2  LEU   5          HD22      LEU   5  -1.811   0.136  -0.245
   49   3HD2  LEU   5          HD23      LEU   5  -1.963   1.113   1.215
   50    H    ILE   6           HN       ILE   6  -1.317   3.961   1.134
   51    HA   ILE   6           HA       ILE   6  -2.466   4.236   3.892
   52    HB   ILE   6           HB       ILE   6  -2.720   5.898   1.369
   53   1HG1  ILE   6          HG12      ILE   6  -0.602   6.134   2.634
   54   2HG1  ILE   6          HG11      ILE   6  -1.566   7.608   2.704
   55   1HG2  ILE   6          HG21      ILE   6  -3.922   7.479   3.078
   56   2HG2  ILE   6          HG22      ILE   6  -4.224   5.989   3.973
   57   3HG2  ILE   6          HG23      ILE   6  -4.838   6.171   2.329
   58   1HD1  ILE   6          HD11      ILE   6  -0.684   5.885   4.872
   59   2HD1  ILE   6          HD12      ILE   6  -2.436   6.078   4.892
   60   3HD1  ILE   6          HD13      ILE   6  -1.392   7.497   4.951
   61    H    ILE   7           HN       ILE   7  -4.439   3.283   4.245
   62    HA   ILE   7           HA       ILE   7  -5.651   1.659   2.109
   63    HB   ILE   7           HB       ILE   7  -6.379   2.133   5.021
   64   1HG1  ILE   7          HG12      ILE   7  -4.919  -0.226   3.802
   65   2HG1  ILE   7          HG11      ILE   7  -4.076   1.153   4.511
   66   1HG2  ILE   7          HG21      ILE   7  -7.480  -0.160   4.682
   67   2HG2  ILE   7          HG22      ILE   7  -7.310   0.134   2.951
   68   3HG2  ILE   7          HG23      ILE   7  -8.294   1.216   3.937
   69   1HD1  ILE   7          HD11      ILE   7  -4.216  -0.183   6.385
   70   2HD1  ILE   7          HD12      ILE   7  -5.701  -0.966   5.845
   71   3HD1  ILE   7          HD13      ILE   7  -5.759   0.658   6.530
   72    H    ASN   8           HN       ASN   8  -7.103   2.614   0.739
   73    HA   ASN   8           HA       ASN   8  -8.795   4.859   1.776
   74   1HB   ASN   8          HB2       ASN   8  -7.621   4.095  -0.890
   75   2HB   ASN   8          HB1       ASN   8  -9.026   5.157  -0.825
   76   1HD2  ASN   8          HD21      ASN   8  -7.438   6.813  -1.747
   77   2HD2  ASN   8          HD22      ASN   8  -6.444   7.664  -0.651
   78    H    GLY   9           HN       GLY   9  -9.725   2.420   2.545
   79   1HA   GLY   9          HA2       GLY   9 -11.553   1.310   0.533
   80   2HA   GLY   9          HA1       GLY   9 -11.406   0.773   2.212
   81    H    LYS  10           HN       LYS  10 -13.799   1.592   0.521
   82    HA   LYS  10           HA       LYS  10 -14.902   4.057   1.311
   83   1HB   LYS  10          HB2       LYS  10 -16.197   1.363   0.802
   84   2HB   LYS  10          HB1       LYS  10 -17.068   2.897   0.827
   85   1HG   LYS  10          HG2       LYS  10 -15.470   3.712  -0.968
   86   2HG   LYS  10          HG1       LYS  10 -14.883   2.054  -1.093
   87   1HD   LYS  10          HD2       LYS  10 -16.545   2.108  -2.740
   88   2HD   LYS  10          HD1       LYS  10 -17.418   1.452  -1.355
   89   1HE   LYS  10          HE2       LYS  10 -18.707   3.335  -1.117
   90   2HE   LYS  10          HE1       LYS  10 -17.374   4.420  -1.561
   91   1HZ   LYS  10          HZ1       LYS  10 -18.785   2.612  -3.452
   92   2HZ   LYS  10          HZ2       LYS  10 -17.571   3.735  -3.843
   93   3HZ   LYS  10          HZ3       LYS  10 -19.090   4.274  -3.307
   94    H    THR  11           HN       THR  11 -14.903   0.937   3.023
   95    HA   THR  11           HA       THR  11 -16.279   2.223   5.341
   96    HB   THR  11           HB       THR  11 -16.165  -0.453   5.869
   97    HG1  THR  11           HG1      THR  11 -16.502  -0.267   3.070
   98   1HG2  THR  11          HG21      THR  11 -18.231   0.674   5.995
   99   2HG2  THR  11          HG22      THR  11 -18.467  -0.504   4.704
  100   3HG2  THR  11          HG23      THR  11 -18.150   1.186   4.309
  101    H    LEU  12           HN       LEU  12 -13.308   0.643   4.316
  102    HA   LEU  12           HA       LEU  12 -12.239   0.818   7.111
  103   1HB   LEU  12          HB2       LEU  12 -11.426  -0.787   4.667
  104   2HB   LEU  12          HB1       LEU  12 -10.578  -0.837   6.213
  105    HG   LEU  12           HG       LEU  12 -13.518  -1.257   6.324
  106   1HD1  LEU  12          HD11      LEU  12 -11.671  -2.965   4.744
  107   2HD1  LEU  12          HD12      LEU  12 -13.417  -2.765   4.605
  108   3HD1  LEU  12          HD13      LEU  12 -12.747  -3.811   5.856
  109   1HD2  LEU  12          HD21      LEU  12 -12.387  -1.464   8.385
  110   2HD2  LEU  12          HD22      LEU  12 -11.031  -2.325   7.656
  111   3HD2  LEU  12          HD23      LEU  12 -12.583  -3.137   7.862
  112    H    LYS  13           HN       LYS  13  -9.946   1.526   7.280
  113    HA   LYS  13           HA       LYS  13  -8.644   2.892   5.058
  114   1HB   LYS  13          HB2       LYS  13 -10.728   4.244   6.204
  115   2HB   LYS  13          HB1       LYS  13  -9.382   4.814   7.190
  116   1HG   LYS  13          HG2       LYS  13  -8.163   5.513   5.194
  117   2HG   LYS  13          HG1       LYS  13  -9.429   4.852   4.159
  118   1HD   LYS  13          HD2       LYS  13 -10.976   6.508   4.777
  119   2HD   LYS  13          HD1       LYS  13 -10.093   6.915   6.249
  120   1HE   LYS  13          HE2       LYS  13  -8.188   7.705   4.719
  121   2HE   LYS  13          HE1       LYS  13  -9.364   7.609   3.393
  122   1HZ   LYS  13          HZ1       LYS  13  -9.456   9.796   4.368
  123   2HZ   LYS  13          HZ2       LYS  13  -9.671   9.142   5.921
  124   3HZ   LYS  13          HZ3       LYS  13 -10.885   8.966   4.746
  125    H    GLY  14           HN       GLY  14  -6.806   4.392   6.136
  126   1HA   GLY  14          HA2       GLY  14  -5.626   4.505   8.453
  127   2HA   GLY  14          HA1       GLY  14  -5.588   2.748   8.302
  128    H    GLU  15           HN       GLU  15  -3.183   3.202   8.461
  129    HA   GLU  15           HA       GLU  15  -2.068   3.523   5.710
  130   1HB   GLU  15          HB2       GLU  15  -0.315   5.008   6.668
  131   2HB   GLU  15          HB1       GLU  15  -1.928   5.692   6.867
  132   1HG   GLU  15          HG2       GLU  15  -1.939   4.580   9.184
  133   2HG   GLU  15          HG1       GLU  15  -0.205   4.347   8.954
  134    H    THR  16           HN       THR  16   0.228   2.682   5.624
  135    HA   THR  16           HA       THR  16   1.124   0.954   7.835
  136    HB   THR  16           HB       THR  16  -0.642  -0.380   6.765
  137    HG1  THR  16           HG1      THR  16   1.916  -1.307   5.976
  138   1HG2  THR  16          HG21      THR  16  -0.753   0.539   4.564
  139   2HG2  THR  16          HG22      THR  16  -0.214  -1.127   4.362
  140   3HG2  THR  16          HG23      THR  16   0.950   0.196   4.255
  141    H    THR  17           HN       THR  17   3.270   0.076   7.425
  142    HA   THR  17           HA       THR  17   4.656   1.092   4.977
  143    HB   THR  17           HB       THR  17   6.444   1.981   6.410
  144    HG1  THR  17           HG1      THR  17   6.359   1.776   8.570
  145   1HG2  THR  17          HG21      THR  17   4.069   3.142   7.758
  146   2HG2  THR  17          HG22      THR  17   4.042   3.160   5.995
  147   3HG2  THR  17          HG23      THR  17   5.361   3.943   6.864
  148    H    THR  18           HN       THR  18   6.691  -0.067   4.567
  149    HA   THR  18           HA       THR  18   7.183  -2.482   6.205
  150    HB   THR  18           HB       THR  18   5.810  -2.315   3.608
  151    HG1  THR  18           HG1      THR  18   5.155  -3.483   5.474
  152   1HG2  THR  18          HG21      THR  18   6.939  -4.209   2.529
  153   2HG2  THR  18          HG22      THR  18   8.168  -4.216   3.796
  154   3HG2  THR  18          HG23      THR  18   8.034  -2.835   2.705
  155    H    GLU  19           HN       GLU  19   9.271  -3.546   5.425
  156    HA   GLU  19           HA       GLU  19  11.160  -1.535   4.245
  157   1HB   GLU  19          HB2       GLU  19  11.372  -1.793   6.704
  158   2HB   GLU  19          HB1       GLU  19  11.594  -3.530   6.496
  159   1HG   GLU  19          HG2       GLU  19  13.396  -1.834   4.868
  160   2HG   GLU  19          HG1       GLU  19  13.653  -1.739   6.611
  161    H    ALA  20           HN       ALA  20  11.914  -2.352   2.324
  162    HA   ALA  20           HA       ALA  20  12.779  -5.178   2.164
  163   1HB   ALA  20          HB1       ALA  20  10.354  -3.985   0.887
  164   2HB   ALA  20          HB2       ALA  20  10.599  -5.615   1.517
  165   3HB   ALA  20          HB3       ALA  20  11.275  -5.164  -0.048
  166    H    VAL  21           HN       VAL  21  13.526  -5.558  -0.256
  167    HA   VAL  21           HA       VAL  21  15.668  -3.791  -0.853
  168    HB   VAL  21           HB       VAL  21  15.762  -5.091  -2.968
  169   1HG1  VAL  21          HG11      VAL  21  15.368  -6.350  -0.301
  170   2HG1  VAL  21          HG12      VAL  21  16.773  -6.380  -1.365
  171   3HG1  VAL  21          HG13      VAL  21  15.397  -7.433  -1.692
  172   1HG2  VAL  21          HG21      VAL  21  12.963  -5.840  -2.116
  173   2HG2  VAL  21          HG22      VAL  21  13.918  -6.940  -3.107
  174   3HG2  VAL  21          HG23      VAL  21  13.538  -5.325  -3.701
  175    H    ASP  22           HN       ASP  22  12.380  -3.948  -2.220
  176    HA   ASP  22           HA       ASP  22  12.641  -1.145  -3.153
  177   1HB   ASP  22          HB2       ASP  22  11.978  -3.512  -4.941
  178   2HB   ASP  22          HB1       ASP  22  11.929  -1.821  -5.438
  179    H    ALA  23           HN       ALA  23  10.472  -0.292  -3.811
  180    HA   ALA  23           HA       ALA  23   8.385  -1.044  -1.995
  181   1HB   ALA  23          HB1       ALA  23   8.634   0.665  -4.465
  182   2HB   ALA  23          HB2       ALA  23   8.352   1.168  -2.798
  183   3HB   ALA  23          HB3       ALA  23   7.052   0.421  -3.725
  184    H    ALA  24           HN       ALA  24   9.188  -2.105  -5.249
  185    HA   ALA  24           HA       ALA  24   6.700  -3.262  -6.035
  186   1HB   ALA  24          HB1       ALA  24   8.852  -2.890  -7.365
  187   2HB   ALA  24          HB2       ALA  24   8.059  -4.442  -7.633
  188   3HB   ALA  24          HB3       ALA  24   9.477  -4.346  -6.589
  189    H    THR  25           HN       THR  25   9.457  -4.661  -4.244
  190    HA   THR  25           HA       THR  25   8.262  -7.260  -3.846
  191    HB   THR  25           HB       THR  25  10.475  -5.682  -2.492
  192    HG1  THR  25           HG1      THR  25  11.710  -7.288  -3.648
  193   1HG2  THR  25          HG21      THR  25  11.168  -7.758  -1.396
  194   2HG2  THR  25          HG22      THR  25   9.798  -8.614  -2.103
  195   3HG2  THR  25          HG23      THR  25   9.523  -7.348  -0.902
  196    H    ALA  26           HN       ALA  26   8.583  -4.394  -1.706
  197    HA   ALA  26           HA       ALA  26   7.186  -5.456   0.529
  198   1HB   ALA  26          HB1       ALA  26   6.760  -2.948   0.963
  199   2HB   ALA  26          HB2       ALA  26   7.577  -2.664  -0.580
  200   3HB   ALA  26          HB3       ALA  26   8.445  -3.433   0.748
  201    H    GLU  27           HN       GLU  27   5.929  -3.247  -1.992
  202    HA   GLU  27           HA       GLU  27   3.266  -3.052  -1.359
  203   1HB   GLU  27          HB2       GLU  27   4.456  -2.037  -3.294
  204   2HB   GLU  27          HB1       GLU  27   4.415  -3.597  -4.116
  205   1HG   GLU  27          HG2       GLU  27   1.845  -3.484  -3.711
  206   2HG   GLU  27          HG1       GLU  27   2.123  -1.762  -3.444
  207    H    LYS  28           HN       LYS  28   4.789  -5.935  -2.792
  208    HA   LYS  28           HA       LYS  28   2.362  -7.369  -3.411
  209   1HB   LYS  28          HB2       LYS  28   5.137  -8.318  -2.587
  210   2HB   LYS  28          HB1       LYS  28   3.910  -9.331  -3.347
  211   1HG   LYS  28          HG2       LYS  28   4.095  -8.254  -5.401
  212   2HG   LYS  28          HG1       LYS  28   4.713  -6.767  -4.681
  213   1HD   LYS  28          HD2       LYS  28   6.707  -7.572  -5.486
  214   2HD   LYS  28          HD1       LYS  28   6.691  -8.452  -3.958
  215   1HE   LYS  28          HE2       LYS  28   5.258  -9.716  -6.256
  216   2HE   LYS  28          HE1       LYS  28   7.033  -9.733  -6.288
  217   1HZ   LYS  28          HZ1       LYS  28   6.143 -11.631  -5.049
  218   2HZ   LYS  28          HZ2       LYS  28   5.350 -10.570  -3.984
  219   3HZ   LYS  28          HZ3       LYS  28   7.047 -10.606  -4.045
  220    H    VAL  29           HN       VAL  29   4.481  -7.282  -0.548
  221    HA   VAL  29           HA       VAL  29   2.886  -9.073   1.084
  222    HB   VAL  29           HB       VAL  29   5.023  -6.966   1.540
  223   1HG1  VAL  29          HG11      VAL  29   5.143  -7.636   3.904
  224   2HG1  VAL  29          HG12      VAL  29   3.758  -8.706   3.686
  225   3HG1  VAL  29          HG13      VAL  29   3.553  -6.956   3.544
  226   1HG2  VAL  29          HG21      VAL  29   5.505  -9.255   0.533
  227   2HG2  VAL  29          HG22      VAL  29   5.055  -9.940   2.095
  228   3HG2  VAL  29          HG23      VAL  29   6.435  -8.849   1.976
  229    H    LEU  30           HN       LEU  30   2.949  -5.549   0.551
  230    HA   LEU  30           HA       LEU  30   1.102  -4.865   2.633
  231   1HB   LEU  30          HB2       LEU  30   1.999  -3.626   0.027
  232   2HB   LEU  30          HB1       LEU  30   0.797  -2.829   1.027
  233    HG   LEU  30           HG       LEU  30   3.341  -2.215   1.293
  234   1HD1  LEU  30          HD11      LEU  30   1.465  -2.730   3.598
  235   2HD1  LEU  30          HD12      LEU  30   1.704  -1.220   2.714
  236   3HD1  LEU  30          HD13      LEU  30   2.988  -1.846   3.758
  237   1HD2  LEU  30          HD21      LEU  30   3.172  -4.764   2.906
  238   2HD2  LEU  30          HD22      LEU  30   4.339  -3.503   3.225
  239   3HD2  LEU  30          HD23      LEU  30   4.351  -4.321   1.677
  240    H    LYS  31           HN       LYS  31   0.732  -6.032  -0.667
  241    HA   LYS  31           HA       LYS  31  -2.090  -5.541  -1.021
  242   1HB   LYS  31          HB2       LYS  31  -0.119  -6.440  -2.596
  243   2HB   LYS  31          HB1       LYS  31  -0.676  -7.996  -2.031
  244   1HG   LYS  31          HG2       LYS  31  -2.599  -5.952  -3.146
  245   2HG   LYS  31          HG1       LYS  31  -1.750  -7.087  -4.194
  246   1HD   LYS  31          HD2       LYS  31  -3.566  -7.823  -1.875
  247   2HD   LYS  31          HD1       LYS  31  -3.953  -7.988  -3.586
  248   1HE   LYS  31          HE2       LYS  31  -1.474  -9.303  -3.255
  249   2HE   LYS  31          HE1       LYS  31  -2.481  -9.819  -1.883
  250   1HZ   LYS  31          HZ1       LYS  31  -3.358  -9.775  -4.728
  251   2HZ   LYS  31          HZ2       LYS  31  -4.284 -10.301  -3.404
  252   3HZ   LYS  31          HZ3       LYS  31  -2.902 -11.169  -3.877
  253    H    GLN  32           HN       GLN  32  -0.198  -8.258   0.255
  254    HA   GLN  32           HA       GLN  32  -2.274 -10.085   0.870
  255   1HB   GLN  32          HB2       GLN  32   0.490  -9.489   1.742
  256   2HB   GLN  32          HB1       GLN  32  -0.476 -10.450   2.861
  257   1HG   GLN  32          HG2       GLN  32  -1.074 -11.947   0.908
  258   2HG   GLN  32          HG1       GLN  32   0.140 -11.078  -0.031
  259   1HE2  GLN  32          HE21      GLN  32   2.420 -11.083   0.941
  260   2HE2  GLN  32          HE22      GLN  32   2.907 -12.463   1.817
  261    H    TYR  33           HN       TYR  33  -0.994  -7.329   2.717
  262    HA   TYR  33           HA       TYR  33  -2.594  -7.677   5.099
  263   1HB   TYR  33          HB2       TYR  33  -0.598  -6.250   4.968
  264   2HB   TYR  33          HB1       TYR  33  -1.375  -5.234   3.754
  265    HD1  TYR  33           HD1      TYR  33  -1.564  -6.384   7.268
  266    HD2  TYR  33           HD2      TYR  33  -2.893  -3.505   4.377
  267    HE1  TYR  33           HE1      TYR  33  -2.604  -5.061   9.074
  268    HE2  TYR  33           HE2      TYR  33  -3.931  -2.170   6.187
  269    HH   TYR  33           HH       TYR  33  -4.856  -2.717   8.580
  270    H    ILE  34           HN       ILE  34  -3.093  -6.086   1.989
  271    HA   ILE  34           HA       ILE  34  -5.647  -4.852   2.652
  272    HB   ILE  34           HB       ILE  34  -4.291  -5.563   0.033
  273   1HG1  ILE  34          HG12      ILE  34  -3.107  -4.024   1.754
  274   2HG1  ILE  34          HG11      ILE  34  -3.237  -3.456   0.097
  275   1HG2  ILE  34          HG21      ILE  34  -5.773  -3.459  -0.641
  276   2HG2  ILE  34          HG22      ILE  34  -6.786  -4.056   0.673
  277   3HG2  ILE  34          HG23      ILE  34  -6.422  -5.099  -0.702
  278   1HD1  ILE  34          HD11      ILE  34  -5.200  -2.717   2.286
  279   2HD1  ILE  34          HD12      ILE  34  -5.083  -2.010   0.674
  280   3HD1  ILE  34          HD13      ILE  34  -3.802  -1.730   1.855
  281    H    ASN  35           HN       ASN  35  -4.731  -8.094   2.096
  282    HA   ASN  35           HA       ASN  35  -7.059  -9.015   0.623
  283   1HB   ASN  35          HB2       ASN  35  -4.752 -10.071   0.789
  284   2HB   ASN  35          HB1       ASN  35  -5.174 -10.555   2.432
  285   1HD2  ASN  35          HD21      ASN  35  -5.725 -12.741   2.377
  286   2HD2  ASN  35          HD22      ASN  35  -6.721 -13.464   1.208
  287    H    ASP  36           HN       ASP  36  -6.310  -8.438   4.004
  288    HA   ASP  36           HA       ASP  36  -8.505 -10.051   5.071
  289   1HB   ASP  36          HB2       ASP  36  -6.359  -9.535   6.245
  290   2HB   ASP  36          HB1       ASP  36  -6.835  -7.837   6.310
  291    H    ASN  37           HN       ASN  37  -7.896  -6.513   5.182
  292    HA   ASN  37           HA       ASN  37 -10.524  -5.749   5.941
  293   1HB   ASN  37          HB2       ASN  37  -9.796  -3.518   5.140
  294   2HB   ASN  37          HB1       ASN  37  -8.512  -4.320   6.045
  295   1HD2  ASN  37          HD21      ASN  37  -8.201  -2.233   3.937
  296   2HD2  ASN  37          HD22      ASN  37  -7.249  -2.944   2.713
  297    H    GLY  38           HN       GLY  38  -9.216  -6.587   2.791
  298   1HA   GLY  38          HA2       GLY  38 -10.366  -7.072   0.793
  299   2HA   GLY  38          HA1       GLY  38 -11.881  -6.791   1.651
  300    H    ILE  39           HN       ILE  39  -9.054  -4.750   0.811
  301    HA   ILE  39           HA       ILE  39 -10.944  -2.843  -0.520
  302    HB   ILE  39           HB       ILE  39  -8.726  -2.229   1.466
  303   1HG1  ILE  39          HG12      ILE  39 -10.767  -3.134   2.521
  304   2HG1  ILE  39          HG11      ILE  39 -10.573  -1.420   2.899
  305   1HG2  ILE  39          HG21      ILE  39  -8.897  -0.496  -0.269
  306   2HG2  ILE  39          HG22      ILE  39  -9.512   0.114   1.268
  307   3HG2  ILE  39          HG23      ILE  39 -10.636  -0.381   0.002
  308   1HD1  ILE  39          HD11      ILE  39 -12.640  -1.055   2.084
  309   2HD1  ILE  39          HD12      ILE  39 -12.772  -2.735   1.568
  310   3HD1  ILE  39          HD13      ILE  39 -12.063  -1.535   0.488
  311    H    ASP  40           HN       ASP  40 -10.075  -3.782  -2.534
  312    HA   ASP  40           HA       ASP  40  -7.299  -2.819  -3.157
  313   1HB   ASP  40          HB2       ASP  40  -7.565  -5.302  -2.888
  314   2HB   ASP  40          HB1       ASP  40  -8.734  -5.278  -4.213
  315    H    GLY  41           HN       GLY  41  -7.159  -1.556  -4.997
  316   1HA   GLY  41          HA2       GLY  41  -9.044  -1.761  -7.193
  317   2HA   GLY  41          HA1       GLY  41  -9.341  -0.325  -6.208
  318    H    GLU  42           HN       GLU  42  -7.623   1.275  -6.048
  319    HA   GLU  42           HA       GLU  42  -5.599   1.071  -8.255
  320   1HB   GLU  42          HB2       GLU  42  -7.806   2.804  -7.946
  321   2HB   GLU  42          HB1       GLU  42  -6.397   3.782  -7.538
  322   1HG   GLU  42          HG2       GLU  42  -6.124   2.053  -9.938
  323   2HG   GLU  42          HG1       GLU  42  -7.244   3.408 -10.083
  324    H    TRP  43           HN       TRP  43  -3.557   1.096  -7.440
  325    HA   TRP  43           HA       TRP  43  -3.083   2.290  -4.749
  326   1HB   TRP  43          HB2       TRP  43  -1.612   0.323  -6.516
  327   2HB   TRP  43          HB1       TRP  43  -0.876   1.015  -5.083
  328    HD1  TRP  43           HD1      TRP  43  -4.584  -0.035  -5.242
  329    HE1  TRP  43           HE1      TRP  43  -4.925  -1.964  -3.577
  330    HE3  TRP  43           HE3      TRP  43   0.226  -0.778  -3.809
  331    HZ2  TRP  43           HZ2      TRP  43  -3.354  -3.584  -1.823
  332    HZ3  TRP  43           HZ3      TRP  43   0.791  -2.511  -2.117
  333    HH2  TRP  43           HH2      TRP  43  -0.992  -3.909  -1.128
  334    H    THR  44           HN       THR  44  -3.132   4.526  -5.740
  335    HA   THR  44           HA       THR  44  -1.263   5.363  -7.752
  336    HB   THR  44           HB       THR  44  -1.777   7.611  -6.850
  337    HG1  THR  44           HG1      THR  44  -2.691   7.843  -4.919
  338   1HG2  THR  44          HG21      THR  44  -4.401   6.264  -6.563
  339   2HG2  THR  44          HG22      THR  44  -3.516   5.901  -8.045
  340   3HG2  THR  44          HG23      THR  44  -3.918   7.571  -7.644
  341    H    TYR  45           HN       TYR  45   0.911   5.731  -7.595
  342    HA   TYR  45           HA       TYR  45   2.241   5.315  -4.969
  343   1HB   TYR  45          HB2       TYR  45   2.946   4.070  -6.987
  344   2HB   TYR  45          HB1       TYR  45   3.272   5.590  -7.818
  345    HD1  TYR  45           HD1      TYR  45   5.521   6.138  -7.948
  346    HD2  TYR  45           HD2      TYR  45   4.067   4.119  -4.448
  347    HE1  TYR  45           HE1      TYR  45   7.800   6.189  -6.972
  348    HE2  TYR  45           HE2      TYR  45   6.346   4.168  -3.472
  349    HH   TYR  45           HH       TYR  45   9.058   4.666  -5.165
  350    H    ASP  46           HN       ASP  46   4.096   6.873  -4.451
  351    HA   ASP  46           HA       ASP  46   3.686   9.620  -5.566
  352   1HB   ASP  46          HB2       ASP  46   3.896   8.934  -2.613
  353   2HB   ASP  46          HB1       ASP  46   3.622  10.530  -3.303
  354    H    ASP  47           HN       ASP  47   5.628  10.524  -6.080
  355    HA   ASP  47           HA       ASP  47   8.134   9.168  -5.470
  356   1HB   ASP  47          HB2       ASP  47   9.068  11.062  -6.780
  357   2HB   ASP  47          HB1       ASP  47   7.686  10.329  -7.592
  358    H    ALA  48           HN       ALA  48   6.229  11.255  -3.614
  359    HA   ALA  48           HA       ALA  48   8.033  13.102  -2.454
  360   1HB   ALA  48          HB1       ALA  48   5.808  13.391  -1.850
  361   2HB   ALA  48          HB2       ALA  48   6.390  12.551  -0.413
  362   3HB   ALA  48          HB3       ALA  48   5.528  11.657  -1.668
  363    H    THR  49           HN       THR  49   6.953  10.168  -0.747
  364    HA   THR  49           HA       THR  49   9.777   9.664   0.122
  365    HB   THR  49           HB       THR  49   8.473  10.899   1.841
  366    HG1  THR  49           HG1      THR  49   9.888   9.516   2.739
  367   1HG2  THR  49          HG21      THR  49   6.610   8.521   1.624
  368   2HG2  THR  49          HG22      THR  49   6.230  10.185   1.181
  369   3HG2  THR  49          HG23      THR  49   6.507   9.764   2.873
  370    H    LYS  50           HN       LYS  50   8.286   8.364  -1.985
  371    HA   LYS  50           HA       LYS  50   7.754   6.215  -2.747
  372   1HB   LYS  50          HB2       LYS  50   9.160   5.422  -0.174
  373   2HB   LYS  50          HB1       LYS  50   8.887   4.377  -1.566
  374   1HG   LYS  50          HG2       LYS  50  10.106   6.499  -2.769
  375   2HG   LYS  50          HG1       LYS  50  10.885   6.529  -1.187
  376   1HD   LYS  50          HD2       LYS  50  10.609   3.903  -2.603
  377   2HD   LYS  50          HD1       LYS  50  11.865   5.023  -3.131
  378   1HE   LYS  50          HE2       LYS  50  11.556   4.403  -0.196
  379   2HE   LYS  50          HE1       LYS  50  12.463   3.302  -1.253
  380   1HZ   LYS  50          HZ1       LYS  50  13.662   5.299  -2.095
  381   2HZ   LYS  50          HZ2       LYS  50  13.983   4.938  -0.466
  382   3HZ   LYS  50          HZ3       LYS  50  12.929   6.209  -0.866
  383    H    THR  51           HN       THR  51   5.719   7.586  -1.319
  384    HA   THR  51           HA       THR  51   4.470   5.711   0.578
  385    HB   THR  51           HB       THR  51   3.493   8.252  -0.779
  386    HG1  THR  51           HG1      THR  51   4.389   9.283   0.848
  387   1HG2  THR  51          HG21      THR  51   2.021   8.226   1.382
  388   2HG2  THR  51          HG22      THR  51   2.368   6.495   1.389
  389   3HG2  THR  51          HG23      THR  51   1.543   7.224   0.011
  390    H    TRP  52           HN       TRP  52   2.156   5.000   0.090
  391    HA   TRP  52           HA       TRP  52   1.715   4.480  -2.825
  392   1HB   TRP  52          HB2       TRP  52   1.877   2.594  -0.484
  393   2HB   TRP  52          HB1       TRP  52   0.935   2.179  -1.909
  394    HD1  TRP  52           HD1      TRP  52   4.473   2.468  -0.663
  395    HE1  TRP  52           HE1      TRP  52   6.089   1.691  -2.523
  396    HE3  TRP  52           HE3      TRP  52   1.197   2.078  -4.505
  397    HZ2  TRP  52           HZ2      TRP  52   5.978   0.986  -5.309
  398    HZ3  TRP  52           HZ3      TRP  52   1.949   1.351  -6.764
  399    HH2  TRP  52           HH2      TRP  52   4.337   0.803  -7.165
  400    H    THR  53           HN       THR  53  -0.584   3.142  -2.782
  401    HA   THR  53           HA       THR  53  -2.504   4.279  -0.862
  402    HB   THR  53           HB       THR  53  -2.951   4.831  -3.791
  403    HG1  THR  53           HG1      THR  53  -1.113   5.913  -3.585
  404   1HG2  THR  53          HG21      THR  53  -3.994   6.916  -2.491
  405   2HG2  THR  53          HG22      THR  53  -4.019   5.753  -1.165
  406   3HG2  THR  53          HG23      THR  53  -4.876   5.399  -2.665
  407    H    VAL  54           HN       VAL  54  -4.843   3.577  -1.792
  408    HA   VAL  54           HA       VAL  54  -5.056   1.273  -3.492
  409    HB   VAL  54           HB       VAL  54  -3.759   0.122  -1.807
  410   1HG1  VAL  54          HG11      VAL  54  -5.467   1.698   0.055
  411   2HG1  VAL  54          HG12      VAL  54  -3.736   1.372   0.116
  412   3HG1  VAL  54          HG13      VAL  54  -4.885   0.126   0.600
  413   1HG2  VAL  54          HG21      VAL  54  -6.167  -0.812  -2.550
  414   2HG2  VAL  54          HG22      VAL  54  -6.459  -0.669  -0.818
  415   3HG2  VAL  54          HG23      VAL  54  -5.137  -1.681  -1.406
  416    H    THR  55           HN       THR  55  -6.802   2.867  -3.982
  417    HA   THR  55           HA       THR  55  -8.987   3.202  -2.044
  418    HB   THR  55           HB       THR  55  -8.943   3.854  -5.000
  419    HG1  THR  55           HG1      THR  55  -7.311   5.074  -4.551
  420   1HG2  THR  55          HG21      THR  55 -10.244   5.165  -2.595
  421   2HG2  THR  55          HG22      THR  55 -11.069   4.176  -3.800
  422   3HG2  THR  55          HG23      THR  55 -10.371   5.729  -4.262
  423    H    GLU  56           HN       GLU  56 -10.861   1.982  -1.998
  424    HA   GLU  56           HA       GLU  56 -11.011  -0.550  -3.360
  425   1HB   GLU  56          HB2       GLU  56 -12.081   0.380  -1.149
  426   2HB   GLU  56          HB1       GLU  56 -13.381   0.914  -2.215
  427   1HG   GLU  56          HG2       GLU  56 -13.218  -1.566  -3.128
  428   2HG   GLU  56          HG1       GLU  56 -12.506  -1.872  -1.543
  Start of MODEL   15
    1   1H    THR   1          HT1       THR   1  14.938   5.217   5.117
    2   2H    THR   1          HT2       THR   1  15.135   6.847   4.680
    3   3H    THR   1          HT3       THR   1  15.141   5.638   3.487
    4    HA   THR   1           HA       THR   1  12.831   6.573   5.103
    5    HB   THR   1           HB       THR   1  13.212   6.325   2.114
    6    HG1  THR   1           HG1      THR   1  13.859   8.502   3.812
    7   1HG2  THR   1          HG21      THR   1  11.485   8.057   2.064
    8   2HG2  THR   1          HG22      THR   1  11.492   8.141   3.825
    9   3HG2  THR   1          HG23      THR   1  10.925   6.681   3.014
   10    H    THR   2           HN       THR   2  10.809   5.397   4.543
   11    HA   THR   2           HA       THR   2  11.285   2.559   3.691
   12    HB   THR   2           HB       THR   2   9.463   3.564   5.901
   13    HG1  THR   2           HG1      THR   2  11.079   2.658   7.256
   14   1HG2  THR   2          HG21      THR   2   8.754   1.445   4.890
   15   2HG2  THR   2          HG22      THR   2   9.386   1.164   6.513
   16   3HG2  THR   2          HG23      THR   2  10.376   0.786   5.103
   17    H    PHE   3           HN       PHE   3   9.507   1.587   2.582
   18    HA   PHE   3           HA       PHE   3   7.939   3.284   0.894
   19   1HB   PHE   3          HB2       PHE   3   7.593   0.375   1.706
   20   2HB   PHE   3          HB1       PHE   3   6.839   1.129   0.301
   21    HD1  PHE   3           HD1      PHE   3   8.807   2.731  -0.962
   22    HD2  PHE   3           HD2      PHE   3   9.365  -1.015   1.075
   23    HE1  PHE   3           HE1      PHE   3  10.862   2.315  -2.286
   24    HE2  PHE   3           HE2      PHE   3  11.419  -1.426  -0.250
   25    HZ   PHE   3           HZ       PHE   3  12.167   0.238  -1.929
   26    H    LYS   4           HN       LYS   4   5.588   3.568   0.912
   27    HA   LYS   4           HA       LYS   4   4.235   3.092   3.536
   28   1HB   LYS   4          HB2       LYS   4   5.359   5.383   3.322
   29   2HB   LYS   4          HB1       LYS   4   4.193   5.729   2.053
   30   1HG   LYS   4          HG2       LYS   4   2.336   5.347   3.593
   31   2HG   LYS   4          HG1       LYS   4   3.462   4.914   4.876
   32   1HD   LYS   4          HD2       LYS   4   4.018   7.082   5.302
   33   2HD   LYS   4          HD1       LYS   4   3.995   7.525   3.596
   34   1HE   LYS   4          HE2       LYS   4   1.895   8.361   3.778
   35   2HE   LYS   4          HE1       LYS   4   1.309   6.868   4.538
   36   1HZ   LYS   4          HZ1       LYS   4   2.287   7.572   6.624
   37   2HZ   LYS   4          HZ2       LYS   4   1.200   8.754   6.071
   38   3HZ   LYS   4          HZ3       LYS   4   2.874   8.993   5.909
   39    H    LEU   5           HN       LEU   5   1.911   3.089   3.357
   40    HA   LEU   5           HA       LEU   5   0.682   3.427   0.686
   41   1HB   LEU   5          HB2       LEU   5   1.664   1.001   1.214
   42   2HB   LEU   5          HB1       LEU   5   0.164   0.848   2.121
   43    HG   LEU   5           HG       LEU   5  -0.305   2.053  -0.498
   44   1HD1  LEU   5          HD11      LEU   5   1.738   0.432  -0.831
   45   2HD1  LEU   5          HD12      LEU   5   0.374   0.361  -1.954
   46   3HD1  LEU   5          HD13      LEU   5   0.517  -0.835  -0.655
   47   1HD2  LEU   5          HD21      LEU   5  -1.834  -0.065  -0.555
   48   2HD2  LEU   5          HD22      LEU   5  -2.180   1.203   0.621
   49   3HD2  LEU   5          HD23      LEU   5  -1.336  -0.262   1.125
   50    H    ILE   6           HN       ILE   6  -1.340   4.281   0.960
   51    HA   ILE   6           HA       ILE   6  -2.467   4.360   3.722
   52    HB   ILE   6           HB       ILE   6  -2.917   5.972   1.195
   53   1HG1  ILE   6          HG12      ILE   6  -0.726   6.297   2.309
   54   2HG1  ILE   6          HG11      ILE   6  -1.730   7.742   2.423
   55   1HG2  ILE   6          HG21      ILE   6  -4.923   6.440   2.175
   56   2HG2  ILE   6          HG22      ILE   6  -3.954   7.486   3.213
   57   3HG2  ILE   6          HG23      ILE   6  -4.394   5.867   3.758
   58   1HD1  ILE   6          HD11      ILE   6  -2.403   6.229   4.689
   59   2HD1  ILE   6          HD12      ILE   6  -1.392   7.674   4.654
   60   3HD1  ILE   6          HD13      ILE   6  -0.651   6.078   4.551
   61    H    ILE   7           HN       ILE   7  -4.488   3.490   4.148
   62    HA   ILE   7           HA       ILE   7  -5.664   1.703   2.116
   63    HB   ILE   7           HB       ILE   7  -6.367   2.311   5.007
   64   1HG1  ILE   7          HG12      ILE   7  -4.087   1.400   4.746
   65   2HG1  ILE   7          HG11      ILE   7  -5.150   0.214   5.500
   66   1HG2  ILE   7          HG21      ILE   7  -7.566   0.145   4.917
   67   2HG2  ILE   7          HG22      ILE   7  -7.191   0.019   3.198
   68   3HG2  ILE   7          HG23      ILE   7  -8.245   1.309   3.778
   69   1HD1  ILE   7          HD11      ILE   7  -3.813  -0.891   3.785
   70   2HD1  ILE   7          HD12      ILE   7  -4.322   0.293   2.581
   71   3HD1  ILE   7          HD13      ILE   7  -5.495  -0.839   3.256
   72    H    ASN   8           HN       ASN   8  -7.234   2.454   0.764
   73    HA   ASN   8           HA       ASN   8  -8.975   4.714   1.698
   74   1HB   ASN   8          HB2       ASN   8  -7.821   3.906  -0.977
   75   2HB   ASN   8          HB1       ASN   8  -9.183   5.020  -0.867
   76   1HD2  ASN   8          HD21      ASN   8  -7.745   6.748  -1.733
   77   2HD2  ASN   8          HD22      ASN   8  -6.609   7.500  -0.705
   78    H    GLY   9           HN       GLY   9  -9.803   2.257   2.521
   79   1HA   GLY   9          HA2       GLY   9 -11.533   0.986   0.524
   80   2HA   GLY   9          HA1       GLY   9 -11.409   0.535   2.228
   81    H    LYS  10           HN       LYS  10 -13.897   0.787   0.901
   82    HA   LYS  10           HA       LYS  10 -15.242   3.245   1.103
   83   1HB   LYS  10          HB2       LYS  10 -16.148   0.393   1.577
   84   2HB   LYS  10          HB1       LYS  10 -17.259   1.749   1.385
   85   1HG   LYS  10          HG2       LYS  10 -16.376   2.210  -0.843
   86   2HG   LYS  10          HG1       LYS  10 -15.167   0.938  -0.655
   87   1HD   LYS  10          HD2       LYS  10 -16.786  -0.248  -1.799
   88   2HD   LYS  10          HD1       LYS  10 -17.330  -0.537  -0.146
   89   1HE   LYS  10          HE2       LYS  10 -18.592   1.820  -0.644
   90   2HE   LYS  10          HE1       LYS  10 -18.579   1.113  -2.272
   91   1HZ   LYS  10          HZ1       LYS  10 -20.485   0.372  -0.885
   92   2HZ   LYS  10          HZ2       LYS  10 -19.382  -0.365   0.176
   93   3HZ   LYS  10          HZ3       LYS  10 -19.508  -0.903  -1.431
   94    H    THR  11           HN       THR  11 -14.257   1.033   3.640
   95    HA   THR  11           HA       THR  11 -15.413   2.908   5.674
   96    HB   THR  11           HB       THR  11 -15.363  -0.126   5.770
   97    HG1  THR  11           HG1      THR  11 -17.188  -0.028   4.769
   98   1HG2  THR  11          HG21      THR  11 -17.012   0.334   7.663
   99   2HG2  THR  11          HG22      THR  11 -16.479   2.014   7.589
  100   3HG2  THR  11          HG23      THR  11 -15.328   0.740   7.992
  101    H    LEU  12           HN       LEU  12 -13.071   0.281   5.052
  102    HA   LEU  12           HA       LEU  12 -11.507   0.819   7.456
  103   1HB   LEU  12          HB2       LEU  12 -11.029  -0.776   4.919
  104   2HB   LEU  12          HB1       LEU  12  -9.957  -0.815   6.320
  105    HG   LEU  12           HG       LEU  12 -12.898  -1.340   6.667
  106   1HD1  LEU  12          HD11      LEU  12 -12.155  -3.826   6.504
  107   2HD1  LEU  12          HD12      LEU  12 -10.796  -3.202   5.570
  108   3HD1  LEU  12          HD13      LEU  12 -12.446  -2.947   5.004
  109   1HD2  LEU  12          HD21      LEU  12 -11.822  -2.870   8.460
  110   2HD2  LEU  12          HD22      LEU  12 -11.739  -1.128   8.723
  111   3HD2  LEU  12          HD23      LEU  12 -10.330  -1.996   8.115
  112    H    LYS  13           HN       LYS  13  -9.459   1.858   7.545
  113    HA   LYS  13           HA       LYS  13  -8.232   3.035   5.158
  114   1HB   LYS  13          HB2       LYS  13 -10.222   4.441   6.771
  115   2HB   LYS  13          HB1       LYS  13  -8.690   5.312   6.737
  116   1HG   LYS  13          HG2       LYS  13  -8.786   5.676   4.458
  117   2HG   LYS  13          HG1       LYS  13  -9.728   4.216   4.157
  118   1HD   LYS  13          HD2       LYS  13 -11.728   5.257   4.562
  119   2HD   LYS  13          HD1       LYS  13 -11.049   6.302   5.810
  120   1HE   LYS  13          HE2       LYS  13 -10.123   6.749   2.999
  121   2HE   LYS  13          HE1       LYS  13 -11.754   7.299   3.433
  122   1HZ   LYS  13          HZ1       LYS  13 -10.839   8.422   5.359
  123   2HZ   LYS  13          HZ2       LYS  13 -10.084   8.989   3.946
  124   3HZ   LYS  13          HZ3       LYS  13  -9.276   7.894   4.964
  125    H    GLY  14           HN       GLY  14  -6.466   4.729   6.068
  126   1HA   GLY  14          HA2       GLY  14  -5.233   5.099   8.324
  127   2HA   GLY  14          HA1       GLY  14  -5.113   3.339   8.332
  128    H    GLU  15           HN       GLU  15  -2.779   3.540   8.281
  129    HA   GLU  15           HA       GLU  15  -1.734   3.916   5.518
  130   1HB   GLU  15          HB2       GLU  15   0.077   5.357   6.422
  131   2HB   GLU  15          HB1       GLU  15  -1.511   6.071   6.694
  132   1HG   GLU  15          HG2       GLU  15  -1.279   4.648   8.978
  133   2HG   GLU  15          HG1       GLU  15   0.427   4.959   8.657
  134    H    THR  16           HN       THR  16   0.484   2.962   5.304
  135    HA   THR  16           HA       THR  16   1.455   1.239   7.490
  136    HB   THR  16           HB       THR  16  -0.416  -0.048   6.553
  137    HG1  THR  16           HG1      THR  16   0.903  -1.615   6.930
  138   1HG2  THR  16          HG21      THR  16   1.008   0.502   3.944
  139   2HG2  THR  16          HG22      THR  16  -0.683   0.791   4.356
  140   3HG2  THR  16          HG23      THR  16  -0.103  -0.857   4.124
  141    H    THR  17           HN       THR  17   3.598   0.527   7.114
  142    HA   THR  17           HA       THR  17   4.844   1.297   4.499
  143    HB   THR  17           HB       THR  17   6.773   2.136   5.883
  144    HG1  THR  17           HG1      THR  17   6.655   1.438   7.862
  145   1HG2  THR  17          HG21      THR  17   5.314   3.815   5.050
  146   2HG2  THR  17          HG22      THR  17   5.491   4.175   6.767
  147   3HG2  THR  17          HG23      THR  17   4.035   3.374   6.180
  148    H    THR  18           HN       THR  18   6.837   0.076   4.053
  149    HA   THR  18           HA       THR  18   7.314  -2.281   5.795
  150    HB   THR  18           HB       THR  18   5.954  -2.161   3.194
  151    HG1  THR  18           HG1      THR  18   5.054  -3.359   4.735
  152   1HG2  THR  18          HG21      THR  18   7.061  -4.060   2.128
  153   2HG2  THR  18          HG22      THR  18   8.272  -4.108   3.410
  154   3HG2  THR  18          HG23      THR  18   8.197  -2.723   2.319
  155    H    GLU  19           HN       GLU  19   9.441  -3.246   5.385
  156    HA   GLU  19           HA       GLU  19  11.369  -1.336   4.106
  157   1HB   GLU  19          HB2       GLU  19  11.500  -1.715   6.582
  158   2HB   GLU  19          HB1       GLU  19  11.790  -3.427   6.269
  159   1HG   GLU  19          HG2       GLU  19  13.678  -2.377   4.661
  160   2HG   GLU  19          HG1       GLU  19  13.598  -1.096   5.872
  161    H    ALA  20           HN       ALA  20  12.038  -2.123   2.139
  162    HA   ALA  20           HA       ALA  20  12.854  -4.969   1.920
  163   1HB   ALA  20          HB1       ALA  20  10.596  -5.199   1.304
  164   2HB   ALA  20          HB2       ALA  20  11.393  -4.969  -0.253
  165   3HB   ALA  20          HB3       ALA  20  10.556  -3.620   0.519
  166    H    VAL  21           HN       VAL  21  13.686  -5.319  -0.447
  167    HA   VAL  21           HA       VAL  21  15.847  -3.548  -0.980
  168    HB   VAL  21           HB       VAL  21  16.016  -4.863  -3.079
  169   1HG1  VAL  21          HG11      VAL  21  16.536  -5.775  -0.694
  170   2HG1  VAL  21          HG12      VAL  21  16.461  -6.917  -2.036
  171   3HG1  VAL  21          HG13      VAL  21  15.093  -6.761  -0.934
  172   1HG2  VAL  21          HG21      VAL  21  14.183  -6.710  -3.287
  173   2HG2  VAL  21          HG22      VAL  21  13.814  -5.094  -3.886
  174   3HG2  VAL  21          HG23      VAL  21  13.190  -5.617  -2.323
  175    H    ASP  22           HN       ASP  22  12.601  -3.729  -2.430
  176    HA   ASP  22           HA       ASP  22  12.876  -0.932  -3.381
  177   1HB   ASP  22          HB2       ASP  22  12.253  -3.317  -5.159
  178   2HB   ASP  22          HB1       ASP  22  12.213  -1.631  -5.673
  179    H    ALA  23           HN       ALA  23  10.698  -0.140  -4.184
  180    HA   ALA  23           HA       ALA  23   8.586  -0.866  -2.364
  181   1HB   ALA  23          HB1       ALA  23   7.809   0.498  -4.853
  182   2HB   ALA  23          HB2       ALA  23   9.222   1.218  -4.081
  183   3HB   ALA  23          HB3       ALA  23   7.710   1.069  -3.187
  184    H    ALA  24           HN       ALA  24   9.457  -1.943  -5.594
  185    HA   ALA  24           HA       ALA  24   6.982  -3.105  -6.420
  186   1HB   ALA  24          HB1       ALA  24   8.502  -4.503  -7.843
  187   2HB   ALA  24          HB2       ALA  24   9.872  -3.909  -6.905
  188   3HB   ALA  24          HB3       ALA  24   8.922  -2.791  -7.884
  189    H    THR  25           HN       THR  25   9.721  -4.505  -4.601
  190    HA   THR  25           HA       THR  25   8.524  -7.100  -4.205
  191    HB   THR  25           HB       THR  25  10.712  -5.511  -2.822
  192    HG1  THR  25           HG1      THR  25  11.803  -6.261  -4.421
  193   1HG2  THR  25          HG21      THR  25  11.394  -7.582  -1.709
  194   2HG2  THR  25          HG22      THR  25  10.036  -8.444  -2.432
  195   3HG2  THR  25          HG23      THR  25   9.741  -7.174  -1.240
  196    H    ALA  26           HN       ALA  26   8.796  -4.222  -2.069
  197    HA   ALA  26           HA       ALA  26   7.376  -5.286   0.150
  198   1HB   ALA  26          HB1       ALA  26   7.759  -2.496  -0.966
  199   2HB   ALA  26          HB2       ALA  26   8.614  -3.252   0.378
  200   3HB   ALA  26          HB3       ALA  26   6.923  -2.780   0.565
  201    H    GLU  27           HN       GLU  27   6.128  -3.074  -2.370
  202    HA   GLU  27           HA       GLU  27   3.459  -2.904  -1.780
  203   1HB   GLU  27          HB2       GLU  27   4.669  -1.880  -3.696
  204   2HB   GLU  27          HB1       GLU  27   4.656  -3.440  -4.519
  205   1HG   GLU  27          HG2       GLU  27   2.082  -3.355  -4.175
  206   2HG   GLU  27          HG1       GLU  27   2.331  -1.634  -3.877
  207    H    LYS  28           HN       LYS  28   5.006  -5.779  -3.214
  208    HA   LYS  28           HA       LYS  28   2.586  -7.217  -3.849
  209   1HB   LYS  28          HB2       LYS  28   5.350  -8.181  -3.004
  210   2HB   LYS  28          HB1       LYS  28   4.131  -9.173  -3.806
  211   1HG   LYS  28          HG2       LYS  28   4.365  -8.063  -5.836
  212   2HG   LYS  28          HG1       LYS  28   4.970  -6.590  -5.078
  213   1HD   LYS  28          HD2       LYS  28   6.975  -7.396  -5.871
  214   2HD   LYS  28          HD1       LYS  28   6.935  -8.272  -4.341
  215   1HE   LYS  28          HE2       LYS  28   6.222 -10.282  -5.372
  216   2HE   LYS  28          HE1       LYS  28   5.702  -9.439  -6.846
  217   1HZ   LYS  28          HZ1       LYS  28   7.978  -8.815  -7.281
  218   2HZ   LYS  28          HZ2       LYS  28   7.883 -10.504  -7.121
  219   3HZ   LYS  28          HZ3       LYS  28   8.500  -9.560  -5.850
  220    H    VAL  29           HN       VAL  29   4.693  -7.145  -0.978
  221    HA   VAL  29           HA       VAL  29   3.102  -8.948   0.638
  222    HB   VAL  29           HB       VAL  29   5.224  -6.831   1.108
  223   1HG1  VAL  29          HG11      VAL  29   3.954  -8.571   3.251
  224   2HG1  VAL  29          HG12      VAL  29   3.747  -6.822   3.106
  225   3HG1  VAL  29          HG13      VAL  29   5.337  -7.498   3.473
  226   1HG2  VAL  29          HG21      VAL  29   6.537  -8.839   1.788
  227   2HG2  VAL  29          HG22      VAL  29   5.949  -8.945   0.129
  228   3HG2  VAL  29          HG23      VAL  29   5.139  -9.847   1.410
  229    H    LEU  30           HN       LEU  30   3.125  -5.426   0.107
  230    HA   LEU  30           HA       LEU  30   1.269  -4.768   2.192
  231   1HB   LEU  30          HB2       LEU  30   2.164  -3.507  -0.408
  232   2HB   LEU  30          HB1       LEU  30   0.954  -2.724   0.595
  233    HG   LEU  30           HG       LEU  30   3.496  -2.095   0.866
  234   1HD1  LEU  30          HD11      LEU  30   1.622  -2.625   3.171
  235   2HD1  LEU  30          HD12      LEU  30   1.839  -1.116   2.281
  236   3HD1  LEU  30          HD13      LEU  30   3.133  -1.720   3.325
  237   1HD2  LEU  30          HD21      LEU  30   3.333  -4.646   2.480
  238   2HD2  LEU  30          HD22      LEU  30   4.497  -3.380   2.800
  239   3HD2  LEU  30          HD23      LEU  30   4.513  -4.199   1.252
  240    H    LYS  31           HN       LYS  31   0.920  -5.908  -1.119
  241    HA   LYS  31           HA       LYS  31  -1.911  -5.457  -1.470
  242   1HB   LYS  31          HB2       LYS  31   0.080  -6.306  -3.054
  243   2HB   LYS  31          HB1       LYS  31  -0.462  -7.876  -2.513
  244   1HG   LYS  31          HG2       LYS  31  -2.402  -5.837  -3.605
  245   2HG   LYS  31          HG1       LYS  31  -1.541  -6.951  -4.665
  246   1HD   LYS  31          HD2       LYS  31  -3.351  -7.733  -2.357
  247   2HD   LYS  31          HD1       LYS  31  -3.738  -7.878  -4.070
  248   1HE   LYS  31          HE2       LYS  31  -1.245  -9.175  -3.754
  249   2HE   LYS  31          HE1       LYS  31  -2.251  -9.720  -2.392
  250   1HZ   LYS  31          HZ1       LYS  31  -3.163  -9.617  -5.224
  251   2HZ   LYS  31          HZ2       LYS  31  -4.030 -10.238  -3.901
  252   3HZ   LYS  31          HZ3       LYS  31  -2.628 -11.027  -4.447
  253    H    GLN  32           HN       GLN  32   0.023  -8.162  -0.234
  254    HA   GLN  32           HA       GLN  32  -2.023 -10.029   0.354
  255   1HB   GLN  32          HB2       GLN  32   0.721  -9.386   1.292
  256   2HB   GLN  32          HB1       GLN  32  -0.241 -10.448   2.320
  257   1HG   GLN  32          HG2       GLN  32  -0.573 -12.020   0.539
  258   2HG   GLN  32          HG1       GLN  32   0.096 -10.902  -0.650
  259   1HE2  GLN  32          HE21      GLN  32   2.277 -11.202  -1.121
  260   2HE2  GLN  32          HE22      GLN  32   3.389 -12.016  -0.115
  261    H    TYR  33           HN       TYR  33  -0.792  -7.278   2.240
  262    HA   TYR  33           HA       TYR  33  -2.379  -7.693   4.620
  263   1HB   TYR  33          HB2       TYR  33  -0.416  -6.231   4.526
  264   2HB   TYR  33          HB1       TYR  33  -1.188  -5.220   3.305
  265    HD1  TYR  33           HD1      TYR  33  -1.433  -6.397   6.808
  266    HD2  TYR  33           HD2      TYR  33  -2.707  -3.496   3.917
  267    HE1  TYR  33           HE1      TYR  33  -2.510  -5.091   8.604
  268    HE2  TYR  33           HE2      TYR  33  -3.783  -2.176   5.716
  269    HH   TYR  33           HH       TYR  33  -4.415  -3.393   8.761
  270    H    ILE  34           HN       ILE  34  -2.882  -5.884   1.606
  271    HA   ILE  34           HA       ILE  34  -5.441  -4.733   2.257
  272    HB   ILE  34           HB       ILE  34  -4.139  -5.525  -0.369
  273   1HG1  ILE  34          HG12      ILE  34  -2.936  -3.922   1.269
  274   2HG1  ILE  34          HG11      ILE  34  -3.123  -3.389  -0.397
  275   1HG2  ILE  34          HG21      ILE  34  -6.445  -5.160  -0.846
  276   2HG2  ILE  34          HG22      ILE  34  -5.622  -3.665  -1.290
  277   3HG2  ILE  34          HG23      ILE  34  -6.520  -3.761   0.225
  278   1HD1  ILE  34          HD11      ILE  34  -5.347  -2.660   1.416
  279   2HD1  ILE  34          HD12      ILE  34  -4.536  -1.697   0.182
  280   3HD1  ILE  34          HD13      ILE  34  -3.803  -1.886   1.774
  281    H    ASN  35           HN       ASN  35  -4.415  -7.870   1.030
  282    HA   ASN  35           HA       ASN  35  -6.873  -8.867  -0.001
  283   1HB   ASN  35          HB2       ASN  35  -4.513  -9.821  -0.125
  284   2HB   ASN  35          HB1       ASN  35  -4.760 -10.422   1.515
  285   1HD2  ASN  35          HD21      ASN  35  -4.658 -11.725  -1.376
  286   2HD2  ASN  35          HD22      ASN  35  -5.979 -12.789  -1.339
  287    H    ASP  36           HN       ASP  36  -5.725  -8.504   3.306
  288    HA   ASP  36           HA       ASP  36  -7.786 -10.207   4.498
  289   1HB   ASP  36          HB2       ASP  36  -5.468  -9.707   5.398
  290   2HB   ASP  36          HB1       ASP  36  -6.037  -8.078   5.764
  291    H    ASN  37           HN       ASN  37  -7.177  -6.673   4.452
  292    HA   ASN  37           HA       ASN  37  -9.591  -5.886   5.760
  293   1HB   ASN  37          HB2       ASN  37  -7.885  -4.485   3.671
  294   2HB   ASN  37          HB1       ASN  37  -9.055  -3.683   4.724
  295   1HD2  ASN  37          HD21      ASN  37  -7.987  -2.673   6.421
  296   2HD2  ASN  37          HD22      ASN  37  -6.637  -3.309   7.248
  297    H    GLY  38           HN       GLY  38  -8.921  -6.768   2.420
  298   1HA   GLY  38          HA2       GLY  38 -10.496  -7.383   0.756
  299   2HA   GLY  38          HA1       GLY  38 -11.794  -6.889   1.845
  300    H    ILE  39           HN       ILE  39  -9.075  -4.799   1.089
  301    HA   ILE  39           HA       ILE  39 -10.957  -2.997  -0.401
  302    HB   ILE  39           HB       ILE  39  -8.527  -2.382   1.317
  303   1HG1  ILE  39          HG12      ILE  39 -10.447  -3.185   2.642
  304   2HG1  ILE  39          HG11      ILE  39 -10.185  -1.461   2.912
  305   1HG2  ILE  39          HG21      ILE  39 -10.503  -0.605  -0.136
  306   2HG2  ILE  39          HG22      ILE  39  -8.755  -0.672  -0.357
  307   3HG2  ILE  39          HG23      ILE  39  -9.430  -0.020   1.135
  308   1HD1  ILE  39          HD11      ILE  39 -11.918  -1.470   0.756
  309   2HD1  ILE  39          HD12      ILE  39 -12.391  -1.232   2.438
  310   3HD1  ILE  39          HD13      ILE  39 -12.489  -2.837   1.713
  311    H    ASP  40           HN       ASP  40 -10.189  -4.363  -2.321
  312    HA   ASP  40           HA       ASP  40  -7.510  -3.424  -3.302
  313   1HB   ASP  40          HB2       ASP  40  -8.052  -5.924  -2.785
  314   2HB   ASP  40          HB1       ASP  40  -9.005  -5.860  -4.271
  315    H    GLY  41           HN       GLY  41  -8.175  -1.598  -4.489
  316   1HA   GLY  41          HA2       GLY  41 -10.036  -2.156  -6.762
  317   2HA   GLY  41          HA1       GLY  41 -10.170  -0.661  -5.830
  318    H    GLU  42           HN       GLU  42  -8.495   0.930  -6.039
  319    HA   GLU  42           HA       GLU  42  -6.607   0.479  -8.327
  320   1HB   GLU  42          HB2       GLU  42  -8.825   2.342  -7.965
  321   2HB   GLU  42          HB1       GLU  42  -7.318   3.200  -8.278
  322   1HG   GLU  42          HG2       GLU  42  -7.122   2.369 -10.403
  323   2HG   GLU  42          HG1       GLU  42  -7.854   0.821  -9.979
  324    H    TRP  43           HN       TRP  43  -4.533   0.793  -7.668
  325    HA   TRP  43           HA       TRP  43  -3.992   2.334  -5.174
  326   1HB   TRP  43          HB2       TRP  43  -2.361   0.487  -6.946
  327   2HB   TRP  43          HB1       TRP  43  -1.700   1.310  -5.545
  328    HD1  TRP  43           HD1      TRP  43  -5.249  -0.128  -5.348
  329    HE1  TRP  43           HE1      TRP  43  -5.219  -2.146  -3.763
  330    HE3  TRP  43           HE3      TRP  43  -0.235  -0.534  -4.543
  331    HZ2  TRP  43           HZ2      TRP  43  -3.332  -3.698  -2.300
  332    HZ3  TRP  43           HZ3      TRP  43   0.648  -2.284  -3.019
  333    HH2  TRP  43           HH2      TRP  43  -0.885  -3.859  -1.906
  334    H    THR  44           HN       THR  44  -2.007   3.768  -5.270
  335    HA   THR  44           HA       THR  44  -1.312   4.848  -7.938
  336    HB   THR  44           HB       THR  44  -1.906   7.135  -7.262
  337    HG1  THR  44           HG1      THR  44  -2.634   7.573  -5.306
  338   1HG2  THR  44          HG21      THR  44  -4.262   6.953  -7.522
  339   2HG2  THR  44          HG22      THR  44  -4.305   5.381  -6.725
  340   3HG2  THR  44          HG23      THR  44  -3.599   5.535  -8.334
  341    H    TYR  45           HN       TYR  45   0.840   5.290  -7.934
  342    HA   TYR  45           HA       TYR  45   2.298   5.233  -5.342
  343   1HB   TYR  45          HB2       TYR  45   2.909   3.744  -7.243
  344   2HB   TYR  45          HB1       TYR  45   3.240   5.166  -8.231
  345    HD1  TYR  45           HD1      TYR  45   4.041   4.178  -4.693
  346    HD2  TYR  45           HD2      TYR  45   5.518   5.531  -8.493
  347    HE1  TYR  45           HE1      TYR  45   6.335   4.298  -3.759
  348    HE2  TYR  45           HE2      TYR  45   7.811   5.652  -7.559
  349    HH   TYR  45           HH       TYR  45   8.643   4.264  -4.546
  350    H    ASP  46           HN       ASP  46   4.058   6.880  -5.026
  351    HA   ASP  46           HA       ASP  46   3.777   9.386  -6.612
  352   1HB   ASP  46          HB2       ASP  46   3.552   9.290  -3.584
  353   2HB   ASP  46          HB1       ASP  46   3.386  10.711  -4.607
  354    H    ASP  47           HN       ASP  47   5.846   9.853  -7.180
  355    HA   ASP  47           HA       ASP  47   8.190   8.808  -5.879
  356   1HB   ASP  47          HB2       ASP  47   7.962   9.569  -8.259
  357   2HB   ASP  47          HB1       ASP  47   7.877  11.233  -7.680
  358    H    ALA  48           HN       ALA  48   6.128  11.468  -5.090
  359    HA   ALA  48           HA       ALA  48   7.759  13.435  -3.969
  360   1HB   ALA  48          HB1       ALA  48   5.754  13.482  -2.255
  361   2HB   ALA  48          HB2       ALA  48   5.094  12.213  -3.291
  362   3HB   ALA  48          HB3       ALA  48   5.447  13.809  -3.961
  363    H    THR  49           HN       THR  49   6.478  10.585  -2.213
  364    HA   THR  49           HA       THR  49   8.939  10.528  -0.536
  365    HB   THR  49           HB       THR  49   7.329  11.996   0.606
  366    HG1  THR  49           HG1      THR  49   7.966  11.046   2.342
  367   1HG2  THR  49          HG21      THR  49   5.455   9.931  -0.301
  368   2HG2  THR  49          HG22      THR  49   5.146  11.608   0.154
  369   3HG2  THR  49          HG23      THR  49   5.236  10.359   1.396
  370    H    LYS  50           HN       LYS  50   8.196   8.737  -2.561
  371    HA   LYS  50           HA       LYS  50   7.600   6.507  -3.046
  372   1HB   LYS  50          HB2       LYS  50   8.942   4.994  -1.666
  373   2HB   LYS  50          HB1       LYS  50   9.834   6.478  -1.986
  374   1HG   LYS  50          HG2       LYS  50   9.461   7.303   0.210
  375   2HG   LYS  50          HG1       LYS  50   8.194   6.117   0.526
  376   1HD   LYS  50          HD2       LYS  50  10.199   5.389   1.671
  377   2HD   LYS  50          HD1       LYS  50   9.930   4.308   0.303
  378   1HE   LYS  50          HE2       LYS  50  11.527   5.740  -1.042
  379   2HE   LYS  50          HE1       LYS  50  11.912   6.603   0.460
  380   1HZ   LYS  50          HZ1       LYS  50  12.406   4.451   1.495
  381   2HZ   LYS  50          HZ2       LYS  50  13.429   4.761   0.175
  382   3HZ   LYS  50          HZ3       LYS  50  12.135   3.673   0.013
  383    H    THR  51           HN       THR  51   5.332   7.682  -1.928
  384    HA   THR  51           HA       THR  51   4.336   5.744   0.112
  385    HB   THR  51           HB       THR  51   3.232   8.351  -0.999
  386    HG1  THR  51           HG1      THR  51   4.378   7.755   1.522
  387   1HG2  THR  51          HG21      THR  51   2.245   6.420   1.089
  388   2HG2  THR  51          HG22      THR  51   1.341   7.207  -0.205
  389   3HG2  THR  51          HG23      THR  51   1.854   8.136   1.203
  390    H    TRP  52           HN       TRP  52   2.005   4.994  -0.291
  391    HA   TRP  52           HA       TRP  52   1.460   4.574  -3.212
  392   1HB   TRP  52          HB2       TRP  52   1.672   2.644  -0.909
  393   2HB   TRP  52          HB1       TRP  52   0.712   2.250  -2.327
  394    HD1  TRP  52           HD1      TRP  52   4.277   2.583  -1.138
  395    HE1  TRP  52           HE1      TRP  52   5.865   1.809  -3.021
  396    HE3  TRP  52           HE3      TRP  52   0.933   2.111  -4.916
  397    HZ2  TRP  52           HZ2      TRP  52   5.712   1.072  -5.794
  398    HZ3  TRP  52           HZ3      TRP  52   1.653   1.367  -7.178
  399    HH2  TRP  52           HH2      TRP  52   4.040   0.847  -7.617
  400    H    THR  53           HN       THR  53  -0.845   3.202  -3.114
  401    HA   THR  53           HA       THR  53  -2.717   4.306  -1.130
  402    HB   THR  53           HB       THR  53  -3.122   4.942  -4.058
  403    HG1  THR  53           HG1      THR  53  -1.536   6.289  -3.811
  404   1HG2  THR  53          HG21      THR  53  -4.383   6.882  -2.734
  405   2HG2  THR  53          HG22      THR  53  -4.402   5.662  -1.460
  406   3HG2  THR  53          HG23      THR  53  -5.146   5.318  -3.021
  407    H    VAL  54           HN       VAL  54  -5.039   3.558  -1.785
  408    HA   VAL  54           HA       VAL  54  -5.320   1.313  -3.614
  409    HB   VAL  54           HB       VAL  54  -3.967   0.248  -1.874
  410   1HG1  VAL  54          HG11      VAL  54  -4.119   0.848   0.279
  411   2HG1  VAL  54          HG12      VAL  54  -5.814   0.369   0.343
  412   3HG1  VAL  54          HG13      VAL  54  -5.377   1.997  -0.166
  413   1HG2  VAL  54          HG21      VAL  54  -6.650  -0.767  -1.080
  414   2HG2  VAL  54          HG22      VAL  54  -5.244  -1.651  -1.681
  415   3HG2  VAL  54          HG23      VAL  54  -6.290  -0.777  -2.807
  416    H    THR  55           HN       THR  55  -7.128   2.774  -4.140
  417    HA   THR  55           HA       THR  55  -9.259   3.131  -2.122
  418    HB   THR  55           HB       THR  55  -9.312   3.858  -5.055
  419    HG1  THR  55           HG1      THR  55  -8.324   5.842  -4.309
  420   1HG2  THR  55          HG21      THR  55 -10.557   5.839  -4.061
  421   2HG2  THR  55          HG22      THR  55 -10.538   4.972  -2.524
  422   3HG2  THR  55          HG23      THR  55 -11.375   4.283  -3.915
  423    H    GLU  56           HN       GLU  56 -11.048   1.824  -2.008
  424    HA   GLU  56           HA       GLU  56 -11.254  -0.635  -3.467
  425   1HB   GLU  56          HB2       GLU  56 -12.343   0.466  -1.221
  426   2HB   GLU  56          HB1       GLU  56 -13.712   0.575  -2.327
  427   1HG   GLU  56          HG2       GLU  56 -12.150  -1.987  -2.127
  428   2HG   GLU  56          HG1       GLU  56 -13.383  -1.612  -0.923
  Start of MODEL   16
    1   1H    THR   1          HT1       THR   1  12.511   7.577   5.046
    2   2H    THR   1          HT2       THR   1  13.369   6.705   6.226
    3   3H    THR   1          HT3       THR   1  12.388   8.016   6.680
    4    HA   THR   1           HA       THR   1  11.355   5.818   7.149
    5    HB   THR   1           HB       THR   1   9.222   6.576   5.873
    6    HG1  THR   1           HG1      THR   1   9.461   8.139   4.498
    7   1HG2  THR   1          HG21      THR   1  10.640   8.706   7.484
    8   2HG2  THR   1          HG22      THR   1   9.964   7.250   8.214
    9   3HG2  THR   1          HG23      THR   1   8.906   8.397   7.391
   10    H    THR   2           HN       THR   2  10.238   3.988   6.153
   11    HA   THR   2           HA       THR   2  11.525   3.114   3.622
   12    HB   THR   2           HB       THR   2  11.578   1.690   5.638
   13    HG1  THR   2           HG1      THR   2  11.555   0.562   3.757
   14   1HG2  THR   2          HG21      THR   2   9.004   0.660   5.854
   15   2HG2  THR   2          HG22      THR   2   8.741   2.397   5.698
   16   3HG2  THR   2          HG23      THR   2   9.770   1.773   6.987
   17    H    PHE   3           HN       PHE   3   9.571   1.303   2.752
   18    HA   PHE   3           HA       PHE   3   7.887   2.919   1.111
   19   1HB   PHE   3          HB2       PHE   3   7.539   0.021   1.956
   20   2HB   PHE   3          HB1       PHE   3   6.897   0.762   0.493
   21    HD1  PHE   3           HD1      PHE   3   9.235   2.426  -0.366
   22    HD2  PHE   3           HD2      PHE   3   9.068  -1.592   1.149
   23    HE1  PHE   3           HE1      PHE   3  11.341   1.887  -1.559
   24    HE2  PHE   3           HE2      PHE   3  11.175  -2.127  -0.042
   25    HZ   PHE   3           HZ       PHE   3  12.312  -0.388  -1.395
   26    H    LYS   4           HN       LYS   4   5.566   3.213   1.206
   27    HA   LYS   4           HA       LYS   4   4.220   2.606   3.795
   28   1HB   LYS   4          HB2       LYS   4   5.389   4.845   3.864
   29   2HB   LYS   4          HB1       LYS   4   4.354   5.363   2.543
   30   1HG   LYS   4          HG2       LYS   4   2.356   4.946   3.899
   31   2HG   LYS   4          HG1       LYS   4   3.362   4.373   5.228
   32   1HD   LYS   4          HD2       LYS   4   3.942   6.478   5.865
   33   2HD   LYS   4          HD1       LYS   4   4.118   7.035   4.201
   34   1HE   LYS   4          HE2       LYS   4   2.003   7.881   4.155
   35   2HE   LYS   4          HE1       LYS   4   1.324   6.442   4.941
   36   1HZ   LYS   4          HZ1       LYS   4   1.171   8.277   6.458
   37   2HZ   LYS   4          HZ2       LYS   4   2.816   8.652   6.256
   38   3HZ   LYS   4          HZ3       LYS   4   2.358   7.212   7.034
   39    H    LEU   5           HN       LEU   5   1.904   2.629   3.610
   40    HA   LEU   5           HA       LEU   5   0.716   3.220   0.950
   41   1HB   LEU   5          HB2       LEU   5   1.578   0.730   1.392
   42   2HB   LEU   5          HB1       LEU   5   0.055   0.608   2.264
   43    HG   LEU   5           HG       LEU   5  -0.324   1.933  -0.306
   44   1HD1  LEU   5          HD11      LEU   5   0.429  -0.967  -0.579
   45   2HD1  LEU   5          HD12      LEU   5   1.679   0.277  -0.683
   46   3HD1  LEU   5          HD13      LEU   5   0.332   0.285  -1.827
   47   1HD2  LEU   5          HD21      LEU   5  -1.924  -0.109  -0.499
   48   2HD2  LEU   5          HD22      LEU   5  -2.233   1.072   0.774
   49   3HD2  LEU   5          HD23      LEU   5  -1.439  -0.454   1.162
   50    H    ILE   6           HN       ILE   6  -1.352   4.027   1.180
   51    HA   ILE   6           HA       ILE   6  -2.503   4.074   3.941
   52    HB   ILE   6           HB       ILE   6  -2.850   5.826   1.490
   53   1HG1  ILE   6          HG12      ILE   6  -0.670   6.038   2.641
   54   2HG1  ILE   6          HG11      ILE   6  -1.640   7.498   2.834
   55   1HG2  ILE   6          HG21      ILE   6  -4.172   5.886   4.201
   56   2HG2  ILE   6          HG22      ILE   6  -4.925   5.986   2.610
   57   3HG2  ILE   6          HG23      ILE   6  -4.000   7.351   3.234
   58   1HD1  ILE   6          HD11      ILE   6  -1.204   5.295   4.864
   59   2HD1  ILE   6          HD12      ILE   6  -2.425   6.552   5.056
   60   3HD1  ILE   6          HD13      ILE   6  -0.716   6.984   4.994
   61    H    ILE   7           HN       ILE   7  -4.567   3.258   4.279
   62    HA   ILE   7           HA       ILE   7  -5.767   1.646   2.110
   63    HB   ILE   7           HB       ILE   7  -6.457   2.032   5.044
   64   1HG1  ILE   7          HG12      ILE   7  -4.984  -0.242   3.677
   65   2HG1  ILE   7          HG11      ILE   7  -4.183   1.063   4.553
   66   1HG2  ILE   7          HG21      ILE   7  -7.332  -0.092   3.060
   67   2HG2  ILE   7          HG22      ILE   7  -8.356   1.192   3.704
   68   3HG2  ILE   7          HG23      ILE   7  -7.734  -0.062   4.777
   69   1HD1  ILE   7          HD11      ILE   7  -5.778   0.411   6.510
   70   2HD1  ILE   7          HD12      ILE   7  -4.378  -0.613   6.188
   71   3HD1  ILE   7          HD13      ILE   7  -5.977  -1.103   5.628
   72    H    ASN   8           HN       ASN   8  -7.274   2.589   0.802
   73    HA   ASN   8           HA       ASN   8  -8.987   4.778   1.935
   74   1HB   ASN   8          HB2       ASN   8  -7.717   4.252  -0.747
   75   2HB   ASN   8          HB1       ASN   8  -9.135   5.294  -0.633
   76   1HD2  ASN   8          HD21      ASN   8  -7.699   7.130  -1.282
   77   2HD2  ASN   8          HD22      ASN   8  -6.679   7.849  -0.119
   78    H    GLY   9           HN       GLY   9  -9.877   2.259   2.464
   79   1HA   GLY   9          HA2       GLY   9 -11.619   1.289   0.306
   80   2HA   GLY   9          HA1       GLY   9 -11.501   0.606   1.933
   81    H    LYS  10           HN       LYS  10 -13.986   1.087   0.666
   82    HA   LYS  10           HA       LYS  10 -15.275   3.525   1.216
   83   1HB   LYS  10          HB2       LYS  10 -16.288   0.669   1.321
   84   2HB   LYS  10          HB1       LYS  10 -17.327   2.091   1.224
   85   1HG   LYS  10          HG2       LYS  10 -16.045   2.737  -0.879
   86   2HG   LYS  10          HG1       LYS  10 -15.318   1.131  -0.826
   87   1HD   LYS  10          HD2       LYS  10 -17.359   0.050  -1.223
   88   2HD   LYS  10          HD1       LYS  10 -18.307   1.434  -0.677
   89   1HE   LYS  10          HE2       LYS  10 -17.262   2.687  -2.706
   90   2HE   LYS  10          HE1       LYS  10 -16.874   1.063  -3.307
   91   1HZ   LYS  10          HZ1       LYS  10 -19.075   1.710  -4.043
   92   2HZ   LYS  10          HZ2       LYS  10 -19.555   2.016  -2.442
   93   3HZ   LYS  10          HZ3       LYS  10 -19.194   0.431  -2.936
   94    H    THR  11           HN       THR  11 -14.367   0.932   3.400
   95    HA   THR  11           HA       THR  11 -15.494   2.515   5.685
   96    HB   THR  11           HB       THR  11 -15.445  -0.506   5.431
   97    HG1  THR  11           HG1      THR  11 -17.687  -0.238   4.982
   98   1HG2  THR  11          HG21      THR  11 -15.633   0.889   7.685
   99   2HG2  THR  11          HG22      THR  11 -16.619  -0.549   7.422
  100   3HG2  THR  11          HG23      THR  11 -17.311   1.053   7.169
  101    H    LEU  12           HN       LEU  12 -13.174  -0.014   4.687
  102    HA   LEU  12           HA       LEU  12 -11.609   0.198   7.154
  103   1HB   LEU  12          HB2       LEU  12 -11.119  -1.129   4.467
  104   2HB   LEU  12          HB1       LEU  12 -10.146  -1.397   5.913
  105    HG   LEU  12           HG       LEU  12 -13.090  -1.738   6.196
  106   1HD1  LEU  12          HD11      LEU  12 -11.446  -3.984   5.041
  107   2HD1  LEU  12          HD12      LEU  12 -12.274  -2.842   3.983
  108   3HD1  LEU  12          HD13      LEU  12 -13.201  -3.825   5.115
  109   1HD2  LEU  12          HD21      LEU  12 -11.570  -2.067   8.095
  110   2HD2  LEU  12          HD22      LEU  12 -10.644  -3.249   7.171
  111   3HD2  LEU  12          HD23      LEU  12 -12.305  -3.606   7.644
  112    H    LYS  13           HN       LYS  13  -9.819   1.491   7.472
  113    HA   LYS  13           HA       LYS  13  -8.416   2.712   5.166
  114   1HB   LYS  13          HB2       LYS  13 -10.020   4.201   7.260
  115   2HB   LYS  13          HB1       LYS  13  -8.795   4.991   6.267
  116   1HG   LYS  13          HG2       LYS  13 -10.032   4.035   4.239
  117   2HG   LYS  13          HG1       LYS  13 -11.347   3.654   5.352
  118   1HD   LYS  13          HD2       LYS  13 -11.521   6.008   6.000
  119   2HD   LYS  13          HD1       LYS  13 -10.154   6.415   4.961
  120   1HE   LYS  13          HE2       LYS  13 -11.512   5.457   3.014
  121   2HE   LYS  13          HE1       LYS  13 -12.903   5.458   4.117
  122   1HZ   LYS  13          HZ1       LYS  13 -12.459   7.799   4.592
  123   2HZ   LYS  13          HZ2       LYS  13 -12.771   7.559   2.939
  124   3HZ   LYS  13          HZ3       LYS  13 -11.178   7.795   3.480
  125    H    GLY  14           HN       GLY  14  -6.694   4.359   6.267
  126   1HA   GLY  14          HA2       GLY  14  -5.511   4.561   8.559
  127   2HA   GLY  14          HA1       GLY  14  -5.401   2.804   8.460
  128    H    GLU  15           HN       GLU  15  -3.063   2.998   8.485
  129    HA   GLU  15           HA       GLU  15  -1.946   3.524   5.776
  130   1HB   GLU  15          HB2       GLU  15  -0.152   4.907   6.809
  131   2HB   GLU  15          HB1       GLU  15  -1.746   5.616   7.058
  132   1HG   GLU  15          HG2       GLU  15  -1.131   5.716   9.245
  133   2HG   GLU  15          HG1       GLU  15  -1.522   3.997   9.266
  134    H    THR  16           HN       THR  16   0.332   2.640   5.626
  135    HA   THR  16           HA       THR  16   1.224   0.776   7.716
  136    HB   THR  16           HB       THR  16  -0.618  -0.454   6.647
  137    HG1  THR  16           HG1      THR  16   0.836  -1.916   7.127
  138   1HG2  THR  16          HG21      THR  16  -0.266  -1.115   4.196
  139   2HG2  THR  16          HG22      THR  16   0.907   0.200   4.116
  140   3HG2  THR  16          HG23      THR  16  -0.782   0.545   4.491
  141    H    THR  17           HN       THR  17   3.317  -0.186   7.168
  142    HA   THR  17           HA       THR  17   4.651   0.891   4.722
  143    HB   THR  17           HB       THR  17   6.596   1.456   6.286
  144    HG1  THR  17           HG1      THR  17   6.264   1.349   8.382
  145   1HG2  THR  17          HG21      THR  17   5.484   3.583   7.080
  146   2HG2  THR  17          HG22      THR  17   3.959   2.928   6.485
  147   3HG2  THR  17          HG23      THR  17   5.279   3.246   5.361
  148    H    THR  18           HN       THR  18   6.603  -0.333   4.176
  149    HA   THR  18           HA       THR  18   7.050  -2.837   5.701
  150    HB   THR  18           HB       THR  18   5.594  -2.509   3.183
  151    HG1  THR  18           HG1      THR  18   5.047  -3.809   5.002
  152   1HG2  THR  18          HG21      THR  18   7.813  -2.975   2.165
  153   2HG2  THR  18          HG22      THR  18   6.650  -4.270   1.875
  154   3HG2  THR  18          HG23      THR  18   7.910  -4.471   3.095
  155    H    GLU  19           HN       GLU  19   9.144  -3.817   5.134
  156    HA   GLU  19           HA       GLU  19  11.055  -1.871   3.876
  157   1HB   GLU  19          HB2       GLU  19  11.200  -2.225   6.366
  158   2HB   GLU  19          HB1       GLU  19  11.546  -3.927   6.056
  159   1HG   GLU  19          HG2       GLU  19  13.379  -2.812   4.423
  160   2HG   GLU  19          HG1       GLU  19  13.270  -1.539   5.641
  161    H    ALA  20           HN       ALA  20  11.711  -2.685   1.918
  162    HA   ALA  20           HA       ALA  20  12.495  -5.551   1.740
  163   1HB   ALA  20          HB1       ALA  20  10.396  -5.898   0.889
  164   2HB   ALA  20          HB2       ALA  20  11.111  -5.242  -0.584
  165   3HB   ALA  20          HB3       ALA  20  10.175  -4.195   0.484
  166    H    VAL  21           HN       VAL  21  13.283  -5.863  -0.718
  167    HA   VAL  21           HA       VAL  21  15.610  -4.280  -1.119
  168    HB   VAL  21           HB       VAL  21  15.209  -6.545  -2.024
  169   1HG1  VAL  21          HG11      VAL  21  12.757  -5.947  -2.628
  170   2HG1  VAL  21          HG12      VAL  21  13.638  -7.027  -3.709
  171   3HG1  VAL  21          HG13      VAL  21  13.440  -5.326  -4.131
  172   1HG2  VAL  21          HG21      VAL  21  15.514  -4.873  -4.478
  173   2HG2  VAL  21          HG22      VAL  21  16.483  -6.240  -3.928
  174   3HG2  VAL  21          HG23      VAL  21  16.686  -4.657  -3.178
  175    H    ASP  22           HN       ASP  22  12.357  -4.003  -2.497
  176    HA   ASP  22           HA       ASP  22  12.937  -1.211  -3.310
  177   1HB   ASP  22          HB2       ASP  22  13.676  -2.728  -5.132
  178   2HB   ASP  22          HB1       ASP  22  12.061  -3.435  -5.179
  179    H    ALA  23           HN       ALA  23  10.888  -0.110  -3.984
  180    HA   ALA  23           HA       ALA  23   8.692  -0.660  -2.240
  181   1HB   ALA  23          HB1       ALA  23   7.624   0.886  -4.213
  182   2HB   ALA  23          HB2       ALA  23   9.343   1.120  -4.527
  183   3HB   ALA  23          HB3       ALA  23   8.672   1.525  -2.947
  184    H    ALA  24           HN       ALA  24   9.297  -1.570  -5.620
  185    HA   ALA  24           HA       ALA  24   6.721  -2.535  -6.333
  186   1HB   ALA  24          HB1       ALA  24   8.929  -2.228  -7.673
  187   2HB   ALA  24          HB2       ALA  24   7.884  -3.579  -8.114
  188   3HB   ALA  24          HB3       ALA  24   9.317  -3.859  -7.125
  189    H    THR  25           HN       THR  25   9.421  -4.206  -4.706
  190    HA   THR  25           HA       THR  25   8.144  -6.776  -4.499
  191    HB   THR  25           HB       THR  25  10.354  -5.348  -2.989
  192    HG1  THR  25           HG1      THR  25  11.313  -5.935  -4.744
  193   1HG2  THR  25          HG21      THR  25   9.579  -8.275  -2.777
  194   2HG2  THR  25          HG22      THR  25   9.325  -7.067  -1.513
  195   3HG2  THR  25          HG23      THR  25  10.965  -7.508  -2.000
  196    H    ALA  26           HN       ALA  26   8.374  -4.004  -2.258
  197    HA   ALA  26           HA       ALA  26   6.996  -5.164  -0.066
  198   1HB   ALA  26          HB1       ALA  26   6.550  -2.718   0.496
  199   2HB   ALA  26          HB2       ALA  26   7.259  -2.316  -1.073
  200   3HB   ALA  26          HB3       ALA  26   8.239  -3.112   0.158
  201    H    GLU  27           HN       GLU  27   5.616  -2.787  -2.383
  202    HA   GLU  27           HA       GLU  27   2.967  -2.839  -1.677
  203   1HB   GLU  27          HB2       GLU  27   2.502  -2.233  -4.017
  204   2HB   GLU  27          HB1       GLU  27   3.989  -1.470  -3.459
  205   1HG   GLU  27          HG2       GLU  27   5.347  -3.024  -4.648
  206   2HG   GLU  27          HG1       GLU  27   3.989  -4.105  -4.944
  207    H    LYS  28           HN       LYS  28   4.630  -5.479  -3.336
  208    HA   LYS  28           HA       LYS  28   2.272  -6.926  -4.186
  209   1HB   LYS  28          HB2       LYS  28   5.079  -7.818  -3.413
  210   2HB   LYS  28          HB1       LYS  28   3.907  -8.832  -4.254
  211   1HG   LYS  28          HG2       LYS  28   3.994  -7.538  -6.208
  212   2HG   LYS  28          HG1       LYS  28   4.635  -6.131  -5.360
  213   1HD   LYS  28          HD2       LYS  28   6.624  -6.843  -6.238
  214   2HD   LYS  28          HD1       LYS  28   6.605  -7.931  -4.850
  215   1HE   LYS  28          HE2       LYS  28   5.483  -9.664  -6.254
  216   2HE   LYS  28          HE1       LYS  28   5.620  -8.580  -7.652
  217   1HZ   LYS  28          HZ1       LYS  28   7.533 -10.016  -7.592
  218   2HZ   LYS  28          HZ2       LYS  28   7.853  -9.601  -5.977
  219   3HZ   LYS  28          HZ3       LYS  28   8.025  -8.440  -7.206
  220    H    VAL  29           HN       VAL  29   4.323  -7.042  -1.276
  221    HA   VAL  29           HA       VAL  29   2.751  -9.050   0.122
  222    HB   VAL  29           HB       VAL  29   4.857  -6.980   0.814
  223   1HG1  VAL  29          HG11      VAL  29   3.578  -8.909   2.781
  224   2HG1  VAL  29          HG12      VAL  29   3.368  -7.155   2.794
  225   3HG1  VAL  29          HG13      VAL  29   4.957  -7.858   3.108
  226   1HG2  VAL  29          HG21      VAL  29   4.714  -9.977   0.562
  227   2HG2  VAL  29          HG22      VAL  29   6.013  -9.214   1.479
  228   3HG2  VAL  29          HG23      VAL  29   5.813  -8.852  -0.236
  229    H    LEU  30           HN       LEU  30   2.732  -5.498  -0.052
  230    HA   LEU  30           HA       LEU  30   0.856  -5.068   2.077
  231   1HB   LEU  30          HB2       LEU  30   1.693  -3.540  -0.398
  232   2HB   LEU  30          HB1       LEU  30   0.515  -2.881   0.720
  233    HG   LEU  30           HG       LEU  30   3.088  -2.279   0.949
  234   1HD1  LEU  30          HD11      LEU  30   2.776  -2.062   3.429
  235   2HD1  LEU  30          HD12      LEU  30   1.253  -2.945   3.250
  236   3HD1  LEU  30          HD13      LEU  30   1.465  -1.383   2.456
  237   1HD2  LEU  30          HD21      LEU  30   4.114  -3.701   2.767
  238   2HD2  LEU  30          HD22      LEU  30   4.076  -4.430   1.174
  239   3HD2  LEU  30          HD23      LEU  30   2.916  -4.927   2.401
  240    H    LYS  31           HN       LYS  31   0.554  -5.894  -1.334
  241    HA   LYS  31           HA       LYS  31  -2.266  -5.446  -1.697
  242   1HB   LYS  31          HB2       LYS  31  -0.246  -6.172  -3.300
  243   2HB   LYS  31          HB1       LYS  31  -0.786  -7.781  -2.883
  244   1HG   LYS  31          HG2       LYS  31  -2.721  -5.679  -3.861
  245   2HG   LYS  31          HG1       LYS  31  -1.832  -6.708  -4.983
  246   1HD   LYS  31          HD2       LYS  31  -3.682  -7.665  -2.773
  247   2HD   LYS  31          HD1       LYS  31  -4.032  -7.690  -4.500
  248   1HE   LYS  31          HE2       LYS  31  -1.538  -8.991  -4.229
  249   2HE   LYS  31          HE1       LYS  31  -2.564  -9.637  -2.927
  250   1HZ   LYS  31          HZ1       LYS  31  -4.326 -10.015  -4.524
  251   2HZ   LYS  31          HZ2       LYS  31  -2.920 -10.819  -5.037
  252   3HZ   LYS  31          HZ3       LYS  31  -3.386  -9.362  -5.776
  253    H    GLN  32           HN       GLN  32  -0.348  -8.228  -0.622
  254    HA   GLN  32           HA       GLN  32  -2.403 -10.133  -0.204
  255   1HB   GLN  32          HB2       GLN  32   0.345  -9.586   0.733
  256   2HB   GLN  32          HB1       GLN  32  -0.618 -10.635   1.775
  257   1HG   GLN  32          HG2       GLN  32  -0.735 -11.195  -1.140
  258   2HG   GLN  32          HG1       GLN  32   0.779 -11.583  -0.322
  259   1HE2  GLN  32          HE21      GLN  32   0.585 -13.032   1.651
  260   2HE2  GLN  32          HE22      GLN  32  -0.687 -14.168   1.702
  261    H    TYR  33           HN       TYR  33  -1.196  -7.524   1.884
  262    HA   TYR  33           HA       TYR  33  -2.836  -8.111   4.199
  263   1HB   TYR  33          HB2       TYR  33  -0.842  -6.686   4.272
  264   2HB   TYR  33          HB1       TYR  33  -1.566  -5.563   3.121
  265    HD1  TYR  33           HD1      TYR  33  -1.906  -7.012   6.512
  266    HD2  TYR  33           HD2      TYR  33  -3.084  -3.873   3.834
  267    HE1  TYR  33           HE1      TYR  33  -3.004  -5.837   8.383
  268    HE2  TYR  33           HE2      TYR  33  -4.181  -2.685   5.712
  269    HH   TYR  33           HH       TYR  33  -3.628  -3.408   8.920
  270    H    ILE  34           HN       ILE  34  -3.208  -6.011   1.355
  271    HA   ILE  34           HA       ILE  34  -5.761  -4.872   2.006
  272    HB   ILE  34           HB       ILE  34  -4.395  -5.519  -0.627
  273   1HG1  ILE  34          HG12      ILE  34  -3.242  -4.032   1.153
  274   2HG1  ILE  34          HG11      ILE  34  -3.353  -3.403  -0.487
  275   1HG2  ILE  34          HG21      ILE  34  -6.780  -5.102  -0.993
  276   2HG2  ILE  34          HG22      ILE  34  -5.828  -3.746  -1.598
  277   3HG2  ILE  34          HG23      ILE  34  -6.680  -3.609  -0.060
  278   1HD1  ILE  34          HD11      ILE  34  -5.663  -2.734   1.217
  279   2HD1  ILE  34          HD12      ILE  34  -4.714  -1.699   0.150
  280   3HD1  ILE  34          HD13      ILE  34  -4.135  -2.052   1.779
  281    H    ASN  35           HN       ASN  35  -4.780  -7.960   0.633
  282    HA   ASN  35           HA       ASN  35  -7.208  -8.836  -0.552
  283   1HB   ASN  35          HB2       ASN  35  -4.861  -9.850  -0.575
  284   2HB   ASN  35          HB1       ASN  35  -5.247 -10.541   1.001
  285   1HD2  ASN  35          HD21      ASN  35  -5.707 -10.908  -2.424
  286   2HD2  ASN  35          HD22      ASN  35  -6.756 -12.240  -2.351
  287    H    ASP  36           HN       ASP  36  -6.217  -8.674   2.823
  288    HA   ASP  36           HA       ASP  36  -8.383 -10.354   3.837
  289   1HB   ASP  36          HB2       ASP  36  -6.171 -10.031   4.936
  290   2HB   ASP  36          HB1       ASP  36  -6.568  -8.332   5.195
  291    H    ASN  37           HN       ASN  37  -7.698  -6.836   3.953
  292    HA   ASN  37           HA       ASN  37 -10.181  -6.051   5.137
  293   1HB   ASN  37          HB2       ASN  37  -8.256  -4.619   3.273
  294   2HB   ASN  37          HB1       ASN  37  -9.524  -3.815   4.205
  295   1HD2  ASN  37          HD21      ASN  37  -7.851  -2.623   5.431
  296   2HD2  ASN  37          HD22      ASN  37  -6.949  -3.411   6.646
  297    H    GLY  38           HN       GLY  38  -9.272  -6.764   1.811
  298   1HA   GLY  38          HA2       GLY  38 -10.719  -7.256  -0.001
  299   2HA   GLY  38          HA1       GLY  38 -12.093  -6.818   1.017
  300    H    ILE  39           HN       ILE  39  -9.304  -4.722   0.564
  301    HA   ILE  39           HA       ILE  39 -11.082  -2.793  -0.893
  302    HB   ILE  39           HB       ILE  39  -8.687  -2.349   0.924
  303   1HG1  ILE  39          HG12      ILE  39 -10.666  -3.172   2.146
  304   2HG1  ILE  39          HG11      ILE  39 -10.366  -1.473   2.524
  305   1HG2  ILE  39          HG21      ILE  39  -9.298   0.023   0.812
  306   2HG2  ILE  39          HG22      ILE  39 -10.638  -0.356  -0.270
  307   3HG2  ILE  39          HG23      ILE  39  -8.976  -0.593  -0.809
  308   1HD1  ILE  39          HD11      ILE  39 -12.464  -2.600   0.649
  309   2HD1  ILE  39          HD12      ILE  39 -12.055  -0.886   0.718
  310   3HD1  ILE  39          HD13      ILE  39 -12.729  -1.689   2.136
  311    H    ASP  40           HN       ASP  40 -10.319  -4.023  -2.884
  312    HA   ASP  40           HA       ASP  40  -7.573  -3.145  -3.726
  313   1HB   ASP  40          HB2       ASP  40  -9.257  -5.598  -4.229
  314   2HB   ASP  40          HB1       ASP  40  -7.955  -5.164  -5.343
  315    H    GLY  41           HN       GLY  41  -8.126  -1.202  -4.784
  316   1HA   GLY  41          HA2       GLY  41  -9.945  -1.503  -7.138
  317   2HA   GLY  41          HA1       GLY  41 -10.042  -0.079  -6.097
  318    H    GLU  42           HN       GLU  42  -8.246   1.418  -6.101
  319    HA   GLU  42           HA       GLU  42  -6.343   1.073  -8.394
  320   1HB   GLU  42          HB2       GLU  42  -8.463   3.036  -7.888
  321   2HB   GLU  42          HB1       GLU  42  -6.903   3.801  -8.187
  322   1HG   GLU  42          HG2       GLU  42  -6.797   3.066 -10.355
  323   2HG   GLU  42          HG1       GLU  42  -7.646   1.561  -9.998
  324    H    TRP  43           HN       TRP  43  -4.278   1.216  -7.655
  325    HA   TRP  43           HA       TRP  43  -3.728   2.576  -5.058
  326   1HB   TRP  43          HB2       TRP  43  -2.163   0.716  -6.874
  327   2HB   TRP  43          HB1       TRP  43  -1.488   1.432  -5.423
  328    HD1  TRP  43           HD1      TRP  43  -5.121   0.182  -5.423
  329    HE1  TRP  43           HE1      TRP  43  -5.260  -1.885  -3.909
  330    HE3  TRP  43           HE3      TRP  43  -0.178  -0.485  -4.409
  331    HZ2  TRP  43           HZ2      TRP  43  -3.516  -3.572  -2.415
  332    HZ3  TRP  43           HZ3      TRP  43   0.556  -2.323  -2.908
  333    HH2  TRP  43           HH2      TRP  43  -1.100  -3.857  -1.916
  334    H    THR  44           HN       THR  44  -1.705   3.933  -5.006
  335    HA   THR  44           HA       THR  44  -0.827   5.080  -7.592
  336    HB   THR  44           HB       THR  44  -1.367   7.364  -6.855
  337    HG1  THR  44           HG1      THR  44  -2.338   7.729  -4.942
  338   1HG2  THR  44          HG21      THR  44  -3.853   5.683  -6.512
  339   2HG2  THR  44          HG22      THR  44  -3.063   5.882  -8.076
  340   3HG2  THR  44          HG23      THR  44  -3.714   7.287  -7.232
  341    H    TYR  45           HN       TYR  45   1.338   5.463  -7.466
  342    HA   TYR  45           HA       TYR  45   2.696   5.131  -4.859
  343   1HB   TYR  45          HB2       TYR  45   3.430   3.926  -6.884
  344   2HB   TYR  45          HB1       TYR  45   3.684   5.458  -7.717
  345    HD1  TYR  45           HD1      TYR  45   5.921   6.050  -7.901
  346    HD2  TYR  45           HD2      TYR  45   4.574   4.061  -4.343
  347    HE1  TYR  45           HE1      TYR  45   8.209   6.190  -6.957
  348    HE2  TYR  45           HE2      TYR  45   6.861   4.198  -3.398
  349    HH   TYR  45           HH       TYR  45   9.402   4.448  -4.766
  350    H    ASP  46           HN       ASP  46   4.412   6.730  -4.236
  351    HA   ASP  46           HA       ASP  46   4.010   9.475  -5.362
  352   1HB   ASP  46          HB2       ASP  46   4.147   8.783  -2.405
  353   2HB   ASP  46          HB1       ASP  46   3.849  10.372  -3.102
  354    H    ASP  47           HN       ASP  47   5.961  10.404  -5.807
  355    HA   ASP  47           HA       ASP  47   8.459   9.062  -5.127
  356   1HB   ASP  47          HB2       ASP  47   7.992  10.265  -7.252
  357   2HB   ASP  47          HB1       ASP  47   7.884  11.779  -6.353
  358    H    ALA  48           HN       ALA  48   6.481  11.124  -3.320
  359    HA   ALA  48           HA       ALA  48   8.237  12.985  -2.105
  360   1HB   ALA  48          HB1       ALA  48   5.991  13.254  -1.572
  361   2HB   ALA  48          HB2       ALA  48   6.539  12.423  -0.116
  362   3HB   ALA  48          HB3       ALA  48   5.722  11.518  -1.395
  363    H    THR  49           HN       THR  49   7.133  10.016  -0.476
  364    HA   THR  49           HA       THR  49   9.927   9.510   0.476
  365    HB   THR  49           HB       THR  49   8.662  10.775   2.179
  366    HG1  THR  49           HG1      THR  49  10.053   9.006   2.788
  367   1HG2  THR  49          HG21      THR  49   6.727   8.779   2.919
  368   2HG2  THR  49          HG22      THR  49   6.496   9.205   1.223
  369   3HG2  THR  49          HG23      THR  49   6.452  10.460   2.461
  370    H    LYS  50           HN       LYS  50   8.433   8.213  -1.628
  371    HA   LYS  50           HA       LYS  50   7.858   6.069  -2.377
  372   1HB   LYS  50          HB2       LYS  50   9.356   5.331   0.160
  373   2HB   LYS  50          HB1       LYS  50   9.013   4.235  -1.177
  374   1HG   LYS  50          HG2       LYS  50  10.593   5.179  -2.543
  375   2HG   LYS  50          HG1       LYS  50  10.352   6.796  -1.881
  376   1HD   LYS  50          HD2       LYS  50  11.857   6.474  -0.175
  377   2HD   LYS  50          HD1       LYS  50  11.498   4.751  -0.044
  378   1HE   LYS  50          HE2       LYS  50  13.109   4.179  -1.565
  379   2HE   LYS  50          HE1       LYS  50  12.757   5.577  -2.601
  380   1HZ   LYS  50          HZ1       LYS  50  14.113   5.720   0.040
  381   2HZ   LYS  50          HZ2       LYS  50  13.827   7.019  -1.018
  382   3HZ   LYS  50          HZ3       LYS  50  14.911   5.785  -1.456
  383    H    THR  51           HN       THR  51   5.626   7.018  -1.540
  384    HA   THR  51           HA       THR  51   4.514   5.240   0.605
  385    HB   THR  51           HB       THR  51   3.067   7.594  -0.584
  386    HG1  THR  51           HG1      THR  51   5.084   7.816   1.389
  387   1HG2  THR  51          HG21      THR  51   3.175   7.390   2.305
  388   2HG2  THR  51          HG22      THR  51   2.674   5.855   1.594
  389   3HG2  THR  51          HG23      THR  51   1.773   7.329   1.238
  390    H    TRP  52           HN       TRP  52   1.876   5.163  -0.071
  391    HA   TRP  52           HA       TRP  52   1.559   4.491  -2.932
  392   1HB   TRP  52          HB2       TRP  52   1.670   2.530  -0.648
  393   2HB   TRP  52          HB1       TRP  52   0.738   2.175  -2.096
  394    HD1  TRP  52           HD1      TRP  52   4.268   2.364  -0.800
  395    HE1  TRP  52           HE1      TRP  52   5.892   1.597  -2.656
  396    HE3  TRP  52           HE3      TRP  52   1.040   2.134  -4.699
  397    HZ2  TRP  52           HZ2      TRP  52   5.808   0.961  -5.456
  398    HZ3  TRP  52           HZ3      TRP  52   1.810   1.444  -6.961
  399    HH2  TRP  52           HH2      TRP  52   4.191   0.856  -7.340
  400    H    THR  53           HN       THR  53  -0.786   3.171  -2.911
  401    HA   THR  53           HA       THR  53  -2.681   4.275  -0.957
  402    HB   THR  53           HB       THR  53  -2.888   5.075  -3.873
  403    HG1  THR  53           HG1      THR  53  -1.236   6.280  -3.282
  404   1HG2  THR  53          HG21      THR  53  -4.353   6.879  -2.699
  405   2HG2  THR  53          HG22      THR  53  -4.365   5.751  -1.343
  406   3HG2  THR  53          HG23      THR  53  -5.015   5.258  -2.907
  407    H    VAL  54           HN       VAL  54  -4.991   3.607  -1.644
  408    HA   VAL  54           HA       VAL  54  -5.318   1.476  -3.601
  409    HB   VAL  54           HB       VAL  54  -4.026   0.274  -1.911
  410   1HG1  VAL  54          HG11      VAL  54  -5.842   0.348   0.321
  411   2HG1  VAL  54          HG12      VAL  54  -5.396   1.993  -0.123
  412   3HG1  VAL  54          HG13      VAL  54  -4.144   0.814   0.257
  413   1HG2  VAL  54          HG21      VAL  54  -6.383  -0.620  -2.885
  414   2HG2  VAL  54          HG22      VAL  54  -6.750  -0.662  -1.161
  415   3HG2  VAL  54          HG23      VAL  54  -5.378  -1.579  -1.791
  416    H    THR  55           HN       THR  55  -7.025   3.142  -4.007
  417    HA   THR  55           HA       THR  55  -9.196   3.403  -2.029
  418    HB   THR  55           HB       THR  55  -9.141   4.339  -4.904
  419    HG1  THR  55           HG1      THR  55  -7.365   5.307  -4.327
  420   1HG2  THR  55          HG21      THR  55 -11.228   4.702  -3.717
  421   2HG2  THR  55          HG22      THR  55 -10.400   6.250  -3.883
  422   3HG2  THR  55          HG23      THR  55 -10.367   5.394  -2.341
  423    H    GLU  56           HN       GLU  56 -11.161   2.324  -2.151
  424    HA   GLU  56           HA       GLU  56 -11.369   0.012  -3.951
  425   1HB   GLU  56          HB2       GLU  56 -12.073   0.413  -1.425
  426   2HB   GLU  56          HB1       GLU  56 -13.564   1.004  -2.160
  427   1HG   GLU  56          HG2       GLU  56 -12.418  -1.615  -3.076
  428   2HG   GLU  56          HG1       GLU  56 -13.324  -1.551  -1.563
  Start of MODEL   17
    1   1H    THR   1          HT1       THR   1  15.286   3.139   4.231
    2   2H    THR   1          HT2       THR   1  14.251   4.418   3.809
    3   3H    THR   1          HT3       THR   1  15.731   4.217   2.999
    4    HA   THR   1           HA       THR   1  14.062   3.400   1.536
    5    HB   THR   1           HB       THR   1  14.761   0.903   1.680
    6    HG1  THR   1           HG1      THR   1  16.212   0.416   3.237
    7   1HG2  THR   1          HG21      THR   1  17.297   1.752   1.461
    8   2HG2  THR   1          HG22      THR   1  16.481   3.313   1.369
    9   3HG2  THR   1          HG23      THR   1  16.097   2.047   0.203
   10    H    THR   2           HN       THR   2  12.276   4.091   3.445
   11    HA   THR   2           HA       THR   2  10.856   1.596   4.286
   12    HB   THR   2           HB       THR   2  10.253   4.441   5.107
   13    HG1  THR   2           HG1      THR   2  12.204   2.663   6.140
   14   1HG2  THR   2          HG21      THR   2   8.655   2.655   5.721
   15   2HG2  THR   2          HG22      THR   2   9.446   3.333   7.145
   16   3HG2  THR   2          HG23      THR   2   9.961   1.770   6.510
   17    H    PHE   3           HN       PHE   3   9.231   0.984   2.925
   18    HA   PHE   3           HA       PHE   3   8.089   2.831   0.951
   19   1HB   PHE   3          HB2       PHE   3   7.443  -0.037   1.725
   20   2HB   PHE   3          HB1       PHE   3   6.879   0.775   0.265
   21    HD1  PHE   3           HD1      PHE   3   9.065   2.178  -0.846
   22    HD2  PHE   3           HD2      PHE   3   9.145  -1.570   1.260
   23    HE1  PHE   3           HE1      PHE   3  11.179   1.575  -1.994
   24    HE2  PHE   3           HE2      PHE   3  11.258  -2.168   0.109
   25    HZ   PHE   3           HZ       PHE   3  12.275  -0.596  -1.516
   26    H    LYS   4           HN       LYS   4   5.664   3.086   0.792
   27    HA   LYS   4           HA       LYS   4   4.229   2.854   3.401
   28   1HB   LYS   4          HB2       LYS   4   5.412   5.081   3.130
   29   2HB   LYS   4          HB1       LYS   4   4.371   5.387   1.748
   30   1HG   LYS   4          HG2       LYS   4   2.392   5.304   3.098
   31   2HG   LYS   4          HG1       LYS   4   3.294   4.706   4.488
   32   1HD   LYS   4          HD2       LYS   4   4.079   6.777   5.040
   33   2HD   LYS   4          HD1       LYS   4   4.273   7.261   3.356
   34   1HE   LYS   4          HE2       LYS   4   2.223   8.251   3.299
   35   2HE   LYS   4          HE1       LYS   4   1.454   6.890   4.141
   36   1HZ   LYS   4          HZ1       LYS   4   2.258   7.654   6.213
   37   2HZ   LYS   4          HZ2       LYS   4   1.585   9.014   5.450
   38   3HZ   LYS   4          HZ3       LYS   4   3.271   8.807   5.492
   39    H    LEU   5           HN       LEU   5   1.897   3.062   3.160
   40    HA   LEU   5           HA       LEU   5   0.727   3.230   0.460
   41   1HB   LEU   5          HB2       LEU   5   1.603   0.798   1.124
   42   2HB   LEU   5          HB1       LEU   5   0.102   0.756   2.037
   43    HG   LEU   5           HG       LEU   5  -0.315   1.826  -0.651
   44   1HD1  LEU   5          HD11      LEU   5   1.641   0.064  -0.857
   45   2HD1  LEU   5          HD12      LEU   5   0.292   0.029  -2.001
   46   3HD1  LEU   5          HD13      LEU   5   0.332  -1.107  -0.643
   47   1HD2  LEU   5          HD21      LEU   5  -2.033  -0.047  -0.621
   48   2HD2  LEU   5          HD22      LEU   5  -2.171   1.124   0.691
   49   3HD2  LEU   5          HD23      LEU   5  -1.441  -0.454   0.990
   50    H    ILE   6           HN       ILE   6  -1.251   4.209   0.679
   51    HA   ILE   6           HA       ILE   6  -2.394   4.465   3.423
   52    HB   ILE   6           HB       ILE   6  -2.771   5.962   0.815
   53   1HG1  ILE   6          HG12      ILE   6  -0.572   6.256   1.921
   54   2HG1  ILE   6          HG11      ILE   6  -1.518   7.743   1.958
   55   1HG2  ILE   6          HG21      ILE   6  -4.265   6.041   3.367
   56   2HG2  ILE   6          HG22      ILE   6  -4.756   6.571   1.758
   57   3HG2  ILE   6          HG23      ILE   6  -3.748   7.615   2.760
   58   1HD1  ILE   6          HD11      ILE   6  -0.508   6.153   4.171
   59   2HD1  ILE   6          HD12      ILE   6  -2.254   6.365   4.293
   60   3HD1  ILE   6          HD13      ILE   6  -1.199   7.775   4.192
   61    H    ILE   7           HN       ILE   7  -4.517   3.816   3.855
   62    HA   ILE   7           HA       ILE   7  -5.756   1.980   1.879
   63    HB   ILE   7           HB       ILE   7  -6.382   2.600   4.783
   64   1HG1  ILE   7          HG12      ILE   7  -4.126   1.651   4.494
   65   2HG1  ILE   7          HG11      ILE   7  -5.197   0.476   5.251
   66   1HG2  ILE   7          HG21      ILE   7  -7.138  -0.003   3.599
   67   2HG2  ILE   7          HG22      ILE   7  -8.029   1.382   2.972
   68   3HG2  ILE   7          HG23      ILE   7  -8.036   1.039   4.702
   69   1HD1  ILE   7          HD11      ILE   7  -3.840   0.368   2.645
   70   2HD1  ILE   7          HD12      ILE   7  -5.550  -0.052   2.565
   71   3HD1  ILE   7          HD13      ILE   7  -4.472  -0.945   3.637
   72    H    ASN   8           HN       ASN   8  -7.134   3.005   0.472
   73    HA   ASN   8           HA       ASN   8  -8.820   5.257   1.486
   74   1HB   ASN   8          HB2       ASN   8  -7.748   4.364  -1.185
   75   2HB   ASN   8          HB1       ASN   8  -9.132   5.455  -1.113
   76   1HD2  ASN   8          HD21      ASN   8  -7.582   7.067  -2.143
   77   2HD2  ASN   8          HD22      ASN   8  -6.520   7.930  -1.125
   78    H    GLY   9           HN       GLY   9  -9.711   2.840   2.379
   79   1HA   GLY   9          HA2       GLY   9 -11.648   1.697   0.481
   80   2HA   GLY   9          HA1       GLY   9 -11.387   1.165   2.147
   81    H    LYS  10           HN       LYS  10 -13.907   1.908   0.675
   82    HA   LYS  10           HA       LYS  10 -14.986   4.381   1.473
   83   1HB   LYS  10          HB2       LYS  10 -16.271   1.649   1.186
   84   2HB   LYS  10          HB1       LYS  10 -17.160   3.173   1.216
   85   1HG   LYS  10          HG2       LYS  10 -15.695   3.916  -0.736
   86   2HG   LYS  10          HG1       LYS  10 -15.157   2.240  -0.850
   87   1HD   LYS  10          HD2       LYS  10 -17.560   1.544  -1.046
   88   2HD   LYS  10          HD1       LYS  10 -18.003   3.250  -1.105
   89   1HE   LYS  10          HE2       LYS  10 -16.129   3.266  -3.034
   90   2HE   LYS  10          HE1       LYS  10 -16.658   1.578  -3.177
   91   1HZ   LYS  10          HZ1       LYS  10 -18.911   2.262  -3.366
   92   2HZ   LYS  10          HZ2       LYS  10 -18.025   3.194  -4.477
   93   3HZ   LYS  10          HZ3       LYS  10 -18.530   3.875  -3.004
   94    H    THR  11           HN       THR  11 -14.596   1.390   3.316
   95    HA   THR  11           HA       THR  11 -15.795   2.748   5.710
   96    HB   THR  11           HB       THR  11 -15.461  -0.223   5.267
   97    HG1  THR  11           HG1      THR  11 -17.226  -0.241   4.090
   98   1HG2  THR  11          HG21      THR  11 -17.410  -0.288   6.820
   99   2HG2  THR  11          HG22      THR  11 -17.330   1.469   6.948
  100   3HG2  THR  11          HG23      THR  11 -15.995   0.481   7.540
  101    H    LEU  12           HN       LEU  12 -13.063   0.878   4.469
  102    HA   LEU  12           HA       LEU  12 -11.721   1.011   7.136
  103   1HB   LEU  12          HB2       LEU  12 -11.209  -0.544   4.581
  104   2HB   LEU  12          HB1       LEU  12 -10.188  -0.649   6.016
  105    HG   LEU  12           HG       LEU  12 -13.151  -1.069   6.275
  106   1HD1  LEU  12          HD11      LEU  12 -11.295  -3.377   5.762
  107   2HD1  LEU  12          HD12      LEU  12 -12.017  -2.519   4.401
  108   3HD1  LEU  12          HD13      LEU  12 -13.050  -3.303   5.596
  109   1HD2  LEU  12          HD21      LEU  12 -10.693  -2.130   7.708
  110   2HD2  LEU  12          HD22      LEU  12 -12.356  -2.547   8.121
  111   3HD2  LEU  12          HD23      LEU  12 -11.792  -0.886   8.305
  112    H    LYS  13           HN       LYS  13  -9.723   2.069   7.359
  113    HA   LYS  13           HA       LYS  13  -8.405   3.284   5.005
  114   1HB   LYS  13          HB2       LYS  13  -9.924   4.765   7.151
  115   2HB   LYS  13          HB1       LYS  13  -8.603   5.547   6.282
  116   1HG   LYS  13          HG2       LYS  13  -9.782   4.825   4.129
  117   2HG   LYS  13          HG1       LYS  13 -11.173   4.434   5.142
  118   1HD   LYS  13          HD2       LYS  13 -11.593   6.655   4.467
  119   2HD   LYS  13          HD1       LYS  13 -10.901   6.837   6.080
  120   1HE   LYS  13          HE2       LYS  13  -8.982   7.810   5.284
  121   2HE   LYS  13          HE1       LYS  13  -8.946   6.782   3.837
  122   1HZ   LYS  13          HZ1       LYS  13  -9.546   9.108   3.333
  123   2HZ   LYS  13          HZ2       LYS  13 -10.921   8.950   4.318
  124   3HZ   LYS  13          HZ3       LYS  13 -10.770   8.013   2.910
  125    H    GLY  14           HN       GLY  14  -6.504   4.757   5.972
  126   1HA   GLY  14          HA2       GLY  14  -5.154   4.940   8.154
  127   2HA   GLY  14          HA1       GLY  14  -5.250   3.179   8.178
  128    H    GLU  15           HN       GLU  15  -2.767   4.459   8.138
  129    HA   GLU  15           HA       GLU  15  -1.807   4.087   5.322
  130   1HB   GLU  15          HB2       GLU  15   0.094   5.500   6.104
  131   2HB   GLU  15          HB1       GLU  15  -1.458   6.309   6.310
  132   1HG   GLU  15          HG2       GLU  15  -0.622   4.672   8.625
  133   2HG   GLU  15          HG1       GLU  15   0.426   6.049   8.289
  134    H    THR  16           HN       THR  16   0.346   3.013   5.118
  135    HA   THR  16           HA       THR  16   1.268   1.395   7.417
  136    HB   THR  16           HB       THR  16  -0.611   0.111   6.494
  137    HG1  THR  16           HG1      THR  16   0.884  -1.277   7.130
  138   1HG2  THR  16          HG21      THR  16  -0.828   0.853   4.262
  139   2HG2  THR  16          HG22      THR  16  -0.253  -0.805   4.103
  140   3HG2  THR  16          HG23      THR  16   0.869   0.539   3.893
  141    H    THR  17           HN       THR  17   3.402   0.639   7.126
  142    HA   THR  17           HA       THR  17   4.722   1.234   4.504
  143    HB   THR  17           HB       THR  17   6.630   2.134   5.907
  144    HG1  THR  17           HG1      THR  17   6.415   2.193   8.000
  145   1HG2  THR  17          HG21      THR  17   3.917   3.458   5.922
  146   2HG2  THR  17          HG22      THR  17   5.274   3.761   4.837
  147   3HG2  THR  17          HG23      THR  17   5.358   4.278   6.521
  148    H    THR  18           HN       THR  18   6.699  -0.035   4.185
  149    HA   THR  18           HA       THR  18   7.156  -2.236   6.120
  150    HB   THR  18           HB       THR  18   5.809  -2.337   3.505
  151    HG1  THR  18           HG1      THR  18   5.421  -4.513   4.417
  152   1HG2  THR  18          HG21      THR  18   6.902  -4.355   2.648
  153   2HG2  THR  18          HG22      THR  18   8.102  -4.282   3.940
  154   3HG2  THR  18          HG23      THR  18   8.046  -3.014   2.713
  155    H    GLU  19           HN       GLU  19   9.291  -3.188   5.856
  156    HA   GLU  19           HA       GLU  19  11.205  -1.447   4.337
  157   1HB   GLU  19          HB2       GLU  19  11.315  -1.494   6.852
  158   2HB   GLU  19          HB1       GLU  19  11.665  -3.220   6.760
  159   1HG   GLU  19          HG2       GLU  19  13.363  -1.513   5.037
  160   2HG   GLU  19          HG1       GLU  19  13.586  -1.276   6.771
  161    H    ALA  20           HN       ALA  20  12.012  -2.473   2.547
  162    HA   ALA  20           HA       ALA  20  12.780  -5.331   2.707
  163   1HB   ALA  20          HB1       ALA  20  11.361  -5.439   0.422
  164   2HB   ALA  20          HB2       ALA  20  10.442  -4.183   1.255
  165   3HB   ALA  20          HB3       ALA  20  10.632  -5.775   1.993
  166    H    VAL  21           HN       VAL  21  13.577  -5.971   0.346
  167    HA   VAL  21           HA       VAL  21  15.828  -4.369  -0.335
  168    HB   VAL  21           HB       VAL  21  15.534  -6.770  -0.844
  169   1HG1  VAL  21          HG11      VAL  21  13.986  -7.600  -2.415
  170   2HG1  VAL  21          HG12      VAL  21  13.700  -6.003  -3.104
  171   3HG1  VAL  21          HG13      VAL  21  13.054  -6.405  -1.514
  172   1HG2  VAL  21          HG21      VAL  21  16.800  -6.722  -2.771
  173   2HG2  VAL  21          HG22      VAL  21  16.902  -5.020  -2.321
  174   3HG2  VAL  21          HG23      VAL  21  15.750  -5.539  -3.551
  175    H    ASP  22           HN       ASP  22  12.561  -4.487  -1.700
  176    HA   ASP  22           HA       ASP  22  12.953  -1.827  -2.931
  177   1HB   ASP  22          HB2       ASP  22  13.885  -3.520  -4.494
  178   2HB   ASP  22          HB1       ASP  22  12.336  -4.363  -4.480
  179    H    ALA  23           HN       ALA  23  10.842  -1.014  -3.799
  180    HA   ALA  23           HA       ALA  23   8.635  -1.561  -2.052
  181   1HB   ALA  23          HB1       ALA  23   9.063  -0.093  -4.650
  182   2HB   ALA  23          HB2       ALA  23   8.702   0.568  -3.056
  183   3HB   ALA  23          HB3       ALA  23   7.437  -0.239  -3.983
  184    H    ALA  24           HN       ALA  24   9.549  -2.852  -5.208
  185    HA   ALA  24           HA       ALA  24   7.117  -4.060  -6.023
  186   1HB   ALA  24          HB1       ALA  24   8.774  -5.727  -7.096
  187   2HB   ALA  24          HB2       ALA  24  10.040  -4.787  -6.307
  188   3HB   ALA  24          HB3       ALA  24   8.988  -4.024  -7.500
  189    H    THR  25           HN       THR  25   9.719  -5.415  -3.977
  190    HA   THR  25           HA       THR  25   8.383  -7.910  -3.419
  191    HB   THR  25           HB       THR  25  10.598  -6.320  -2.084
  192    HG1  THR  25           HG1      THR  25  10.543  -8.631  -3.722
  193   1HG2  THR  25          HG21      THR  25   9.501  -7.821  -0.425
  194   2HG2  THR  25          HG22      THR  25  11.149  -8.334  -0.805
  195   3HG2  THR  25          HG23      THR  25   9.775  -9.185  -1.513
  196    H    ALA  26           HN       ALA  26   8.737  -4.891  -1.499
  197    HA   ALA  26           HA       ALA  26   7.206  -5.713   0.747
  198   1HB   ALA  26          HB1       ALA  26   7.757  -3.036  -0.560
  199   2HB   ALA  26          HB2       ALA  26   8.538  -3.730   0.861
  200   3HB   ALA  26          HB3       ALA  26   6.866  -3.164   0.962
  201    H    GLU  27           HN       GLU  27   6.129  -3.638  -1.965
  202    HA   GLU  27           HA       GLU  27   3.455  -3.309  -1.461
  203   1HB   GLU  27          HB2       GLU  27   4.959  -2.642  -3.457
  204   2HB   GLU  27          HB1       GLU  27   4.439  -4.161  -4.188
  205   1HG   GLU  27          HG2       GLU  27   2.314  -2.416  -3.052
  206   2HG   GLU  27          HG1       GLU  27   3.089  -1.862  -4.535
  207    H    LYS  28           HN       LYS  28   4.904  -6.340  -2.664
  208    HA   LYS  28           HA       LYS  28   2.444  -7.718  -3.262
  209   1HB   LYS  28          HB2       LYS  28   5.138  -8.727  -2.262
  210   2HB   LYS  28          HB1       LYS  28   3.899  -9.731  -3.014
  211   1HG   LYS  28          HG2       LYS  28   4.223  -8.793  -5.120
  212   2HG   LYS  28          HG1       LYS  28   4.884  -7.295  -4.463
  213   1HD   LYS  28          HD2       LYS  28   6.863  -8.256  -5.140
  214   2HD   LYS  28          HD1       LYS  28   6.747  -9.004  -3.547
  215   1HE   LYS  28          HE2       LYS  28   5.532 -10.942  -4.633
  216   2HE   LYS  28          HE1       LYS  28   5.931 -10.222  -6.206
  217   1HZ   LYS  28          HZ1       LYS  28   7.893 -10.883  -4.072
  218   2HZ   LYS  28          HZ2       LYS  28   8.258 -10.211  -5.589
  219   3HZ   LYS  28          HZ3       LYS  28   7.645 -11.792  -5.482
  220    H    VAL  29           HN       VAL  29   4.461  -7.526  -0.330
  221    HA   VAL  29           HA       VAL  29   2.738  -9.140   1.353
  222    HB   VAL  29           HB       VAL  29   4.929  -7.077   1.756
  223   1HG1  VAL  29          HG11      VAL  29   3.384  -6.890   3.693
  224   2HG1  VAL  29          HG12      VAL  29   4.936  -7.595   4.160
  225   3HG1  VAL  29          HG13      VAL  29   3.524  -8.632   3.955
  226   1HG2  VAL  29          HG21      VAL  29   6.260  -8.971   2.362
  227   2HG2  VAL  29          HG22      VAL  29   5.367  -9.443   0.916
  228   3HG2  VAL  29          HG23      VAL  29   4.840 -10.008   2.502
  229    H    LEU  30           HN       LEU  30   2.942  -5.668   0.581
  230    HA   LEU  30           HA       LEU  30   1.050  -4.782   2.541
  231   1HB   LEU  30          HB2       LEU  30   2.077  -3.755  -0.112
  232   2HB   LEU  30          HB1       LEU  30   0.872  -2.851   0.790
  233    HG   LEU  30           HG       LEU  30   3.434  -2.314   1.097
  234   1HD1  LEU  30          HD11      LEU  30   3.008  -1.738   3.511
  235   2HD1  LEU  30          HD12      LEU  30   1.454  -2.571   3.359
  236   3HD1  LEU  30          HD13      LEU  30   1.792  -1.146   2.373
  237   1HD2  LEU  30          HD21      LEU  30   4.339  -4.423   1.685
  238   2HD2  LEU  30          HD22      LEU  30   3.097  -4.718   2.899
  239   3HD2  LEU  30          HD23      LEU  30   4.309  -3.482   3.162
  240    H    LYS  31           HN       LYS  31   0.744  -6.206  -0.659
  241    HA   LYS  31           HA       LYS  31  -2.053  -5.641  -1.141
  242   1HB   LYS  31          HB2       LYS  31  -0.063  -6.712  -2.589
  243   2HB   LYS  31          HB1       LYS  31  -0.695  -8.203  -1.934
  244   1HG   LYS  31          HG2       LYS  31  -2.503  -6.177  -3.254
  245   2HG   LYS  31          HG1       LYS  31  -1.671  -7.420  -4.187
  246   1HD   LYS  31          HD2       LYS  31  -3.580  -7.908  -1.877
  247   2HD   LYS  31          HD1       LYS  31  -3.926  -8.187  -3.582
  248   1HE   LYS  31          HE2       LYS  31  -1.511  -9.568  -3.079
  249   2HE   LYS  31          HE1       LYS  31  -2.575  -9.938  -1.702
  250   1HZ   LYS  31          HZ1       LYS  31  -2.953 -11.400  -3.663
  251   2HZ   LYS  31          HZ2       LYS  31  -3.437 -10.033  -4.549
  252   3HZ   LYS  31          HZ3       LYS  31  -4.333 -10.532  -3.194
  253    H    GLN  32           HN       GLN  32  -0.283  -8.310   0.382
  254    HA   GLN  32           HA       GLN  32  -2.430 -10.024   1.065
  255   1HB   GLN  32          HB2       GLN  32   0.320  -9.439   1.988
  256   2HB   GLN  32          HB1       GLN  32  -0.710 -10.293   3.137
  257   1HG   GLN  32          HG2       GLN  32  -1.312 -11.817   1.115
  258   2HG   GLN  32          HG1       GLN  32   0.153 -11.155   0.388
  259   1HE2  GLN  32          HE21      GLN  32   2.223 -11.526   1.571
  260   2HE2  GLN  32          HE22      GLN  32   2.355 -12.840   2.651
  261    H    TYR  33           HN       TYR  33  -1.153  -7.150   2.714
  262    HA   TYR  33           HA       TYR  33  -2.817  -7.277   5.076
  263   1HB   TYR  33          HB2       TYR  33  -0.811  -5.896   4.924
  264   2HB   TYR  33          HB1       TYR  33  -1.481  -5.002   3.561
  265    HD1  TYR  33           HD1      TYR  33  -1.921  -5.752   7.158
  266    HD2  TYR  33           HD2      TYR  33  -2.967  -3.175   3.892
  267    HE1  TYR  33           HE1      TYR  33  -3.022  -4.211   8.737
  268    HE2  TYR  33           HE2      TYR  33  -4.066  -1.617   5.475
  269    HH   TYR  33           HH       TYR  33  -3.709  -1.136   8.133
  270    H    ILE  34           HN       ILE  34  -3.187  -5.786   1.872
  271    HA   ILE  34           HA       ILE  34  -5.721  -4.491   2.342
  272    HB   ILE  34           HB       ILE  34  -4.395  -5.577  -0.165
  273   1HG1  ILE  34          HG12      ILE  34  -3.125  -3.891   1.285
  274   2HG1  ILE  34          HG11      ILE  34  -3.358  -3.440  -0.400
  275   1HG2  ILE  34          HG21      ILE  34  -6.629  -5.178  -0.799
  276   2HG2  ILE  34          HG22      ILE  34  -5.795  -3.687  -1.237
  277   3HG2  ILE  34          HG23      ILE  34  -6.762  -3.756   0.236
  278   1HD1  ILE  34          HD11      ILE  34  -3.953  -1.837   1.739
  279   2HD1  ILE  34          HD12      ILE  34  -5.521  -2.575   1.412
  280   3HD1  ILE  34          HD13      ILE  34  -4.686  -1.678   0.144
  281    H    ASN  35           HN       ASN  35  -4.764  -7.760   1.453
  282    HA   ASN  35           HA       ASN  35  -7.236  -8.781   0.473
  283   1HB   ASN  35          HB2       ASN  35  -4.909  -9.812   0.462
  284   2HB   ASN  35          HB1       ASN  35  -5.174 -10.235   2.154
  285   1HD2  ASN  35          HD21      ASN  35  -5.427 -12.510   1.971
  286   2HD2  ASN  35          HD22      ASN  35  -6.639 -13.245   1.037
  287    H    ASP  36           HN       ASP  36  -6.106  -8.157   3.749
  288    HA   ASP  36           HA       ASP  36  -8.227  -9.679   5.068
  289   1HB   ASP  36          HB2       ASP  36  -5.783  -8.824   5.780
  290   2HB   ASP  36          HB1       ASP  36  -6.725  -7.472   6.409
  291    H    ASN  37           HN       ASN  37  -7.522  -6.175   4.735
  292    HA   ASN  37           HA       ASN  37  -9.947  -5.227   5.911
  293   1HB   ASN  37          HB2       ASN  37  -8.174  -4.026   3.754
  294   2HB   ASN  37          HB1       ASN  37  -9.328  -3.126   4.742
  295   1HD2  ASN  37          HD21      ASN  37  -8.248  -2.031   6.378
  296   2HD2  ASN  37          HD22      ASN  37  -6.916  -2.641   7.253
  297    H    GLY  38           HN       GLY  38  -9.203  -6.368   2.665
  298   1HA   GLY  38          HA2       GLY  38 -10.736  -7.074   1.002
  299   2HA   GLY  38          HA1       GLY  38 -12.058  -6.503   2.021
  300    H    ILE  39           HN       ILE  39  -9.320  -4.456   1.230
  301    HA   ILE  39           HA       ILE  39 -11.151  -2.768  -0.444
  302    HB   ILE  39           HB       ILE  39  -8.769  -2.022   1.288
  303   1HG1  ILE  39          HG12      ILE  39 -10.705  -2.749   2.631
  304   2HG1  ILE  39          HG11      ILE  39 -10.470  -1.005   2.780
  305   1HG2  ILE  39          HG21      ILE  39 -10.772  -0.316  -0.222
  306   2HG2  ILE  39          HG22      ILE  39  -9.054  -0.478  -0.585
  307   3HG2  ILE  39          HG23      ILE  39  -9.569   0.305   0.909
  308   1HD1  ILE  39          HD11      ILE  39 -12.186  -0.751   0.900
  309   2HD1  ILE  39          HD12      ILE  39 -12.817  -1.319   2.446
  310   3HD1  ILE  39          HD13      ILE  39 -12.549  -2.461   1.129
  311    H    ASP  40           HN       ASP  40 -10.408  -4.091  -2.327
  312    HA   ASP  40           HA       ASP  40  -7.656  -3.304  -3.240
  313   1HB   ASP  40          HB2       ASP  40  -8.015  -5.722  -2.662
  314   2HB   ASP  40          HB1       ASP  40  -9.267  -5.791  -3.908
  315    H    GLY  41           HN       GLY  41  -8.574  -1.403  -4.297
  316   1HA   GLY  41          HA2       GLY  41 -10.282  -2.055  -6.668
  317   2HA   GLY  41          HA1       GLY  41 -10.348  -0.506  -5.821
  318    H    GLU  42           HN       GLU  42  -8.698   1.030  -6.194
  319    HA   GLU  42           HA       GLU  42  -6.792   0.350  -8.410
  320   1HB   GLU  42          HB2       GLU  42  -8.898   2.343  -8.138
  321   2HB   GLU  42          HB1       GLU  42  -7.344   3.119  -8.442
  322   1HG   GLU  42          HG2       GLU  42  -7.116   2.169 -10.530
  323   2HG   GLU  42          HG1       GLU  42  -8.035   0.728 -10.092
  324    H    TRP  43           HN       TRP  43  -4.698   0.593  -7.805
  325    HA   TRP  43           HA       TRP  43  -4.046   2.131  -5.338
  326   1HB   TRP  43          HB2       TRP  43  -2.570   0.158  -7.104
  327   2HB   TRP  43          HB1       TRP  43  -1.812   0.977  -5.749
  328    HD1  TRP  43           HD1      TRP  43  -5.438  -0.216  -5.405
  329    HE1  TRP  43           HE1      TRP  43  -5.492  -2.182  -3.753
  330    HE3  TRP  43           HE3      TRP  43  -0.441  -0.934  -4.741
  331    HZ2  TRP  43           HZ2      TRP  43  -3.660  -3.811  -2.295
  332    HZ3  TRP  43           HZ3      TRP  43   0.374  -2.692  -3.192
  333    HH2  TRP  43           HH2      TRP  43  -1.218  -4.125  -1.979
  334    H    THR  44           HN       THR  44  -1.985   3.438  -5.462
  335    HA   THR  44           HA       THR  44  -1.231   4.463  -8.133
  336    HB   THR  44           HB       THR  44  -1.702   6.790  -7.454
  337    HG1  THR  44           HG1      THR  44  -2.679   7.212  -5.535
  338   1HG2  THR  44          HG21      THR  44  -4.055   6.731  -7.785
  339   2HG2  THR  44          HG22      THR  44  -4.203   5.158  -7.001
  340   3HG2  THR  44          HG23      THR  44  -3.443   5.285  -8.587
  341    H    TYR  45           HN       TYR  45   0.946   4.804  -8.113
  342    HA   TYR  45           HA       TYR  45   2.371   4.697  -5.503
  343   1HB   TYR  45          HB2       TYR  45   2.935   3.146  -7.358
  344   2HB   TYR  45          HB1       TYR  45   3.325   4.526  -8.384
  345    HD1  TYR  45           HD1      TYR  45   4.089   3.572  -4.828
  346    HD2  TYR  45           HD2      TYR  45   5.614   4.816  -8.646
  347    HE1  TYR  45           HE1      TYR  45   6.386   3.624  -3.894
  348    HE2  TYR  45           HE2      TYR  45   7.909   4.869  -7.712
  349    HH   TYR  45           HH       TYR  45   9.003   3.449  -5.443
  350    H    ASP  46           HN       ASP  46   4.222   6.236  -5.198
  351    HA   ASP  46           HA       ASP  46   4.000   8.782  -6.750
  352   1HB   ASP  46          HB2       ASP  46   4.033   8.559  -3.718
  353   2HB   ASP  46          HB1       ASP  46   3.916  10.046  -4.652
  354    H    ASP  47           HN       ASP  47   6.021   9.432  -7.340
  355    HA   ASP  47           HA       ASP  47   8.406   8.066  -6.406
  356   1HB   ASP  47          HB2       ASP  47   9.511   9.698  -7.925
  357   2HB   ASP  47          HB1       ASP  47   8.120   8.930  -8.688
  358    H    ALA  48           HN       ALA  48   6.587  10.580  -5.013
  359    HA   ALA  48           HA       ALA  48   8.454  12.441  -4.024
  360   1HB   ALA  48          HB1       ALA  48   6.234  12.932  -3.559
  361   2HB   ALA  48          HB2       ALA  48   6.717  12.278  -1.994
  362   3HB   ALA  48          HB3       ALA  48   5.845  11.261  -3.145
  363    H    THR  49           HN       THR  49   7.173   9.769  -2.032
  364    HA   THR  49           HA       THR  49   9.921   9.327  -0.920
  365    HB   THR  49           HB       THR  49   8.612  10.785   0.571
  366    HG1  THR  49           HG1      THR  49   9.930   9.099   1.458
  367   1HG2  THR  49          HG21      THR  49   6.382  10.553   0.740
  368   2HG2  THR  49          HG22      THR  49   6.595   8.958   1.460
  369   3HG2  THR  49          HG23      THR  49   6.455   9.123  -0.291
  370    H    LYS  50           HN       LYS  50   8.417   7.812  -2.925
  371    HA   LYS  50           HA       LYS  50   7.839   5.591  -3.428
  372   1HB   LYS  50          HB2       LYS  50   9.339   5.124  -0.828
  373   2HB   LYS  50          HB1       LYS  50   9.034   3.914  -2.072
  374   1HG   LYS  50          HG2       LYS  50  10.319   5.267  -3.699
  375   2HG   LYS  50          HG1       LYS  50  10.647   6.456  -2.438
  376   1HD   LYS  50          HD2       LYS  50  11.435   3.534  -2.268
  377   2HD   LYS  50          HD1       LYS  50  12.524   4.829  -2.766
  378   1HE   LYS  50          HE2       LYS  50  11.557   5.876  -0.439
  379   2HE   LYS  50          HE1       LYS  50  11.545   4.143  -0.056
  380   1HZ   LYS  50          HZ1       LYS  50  13.816   4.000  -0.940
  381   2HZ   LYS  50          HZ2       LYS  50  13.723   5.050   0.393
  382   3HZ   LYS  50          HZ3       LYS  50  13.828   5.679  -1.182
  383    H    THR  51           HN       THR  51   5.716   6.923  -2.330
  384    HA   THR  51           HA       THR  51   4.611   5.180  -0.169
  385    HB   THR  51           HB       THR  51   3.706   7.815  -1.393
  386    HG1  THR  51           HG1      THR  51   4.440   8.610   0.630
  387   1HG2  THR  51          HG21      THR  51   2.343   7.822   0.827
  388   2HG2  THR  51          HG22      THR  51   2.589   6.076   0.797
  389   3HG2  THR  51          HG23      THR  51   1.737   6.869  -0.528
  390    H    TRP  52           HN       TRP  52   2.206   4.612  -0.510
  391    HA   TRP  52           HA       TRP  52   1.573   4.133  -3.402
  392   1HB   TRP  52          HB2       TRP  52   1.711   2.238  -1.063
  393   2HB   TRP  52          HB1       TRP  52   0.721   1.876  -2.468
  394    HD1  TRP  52           HD1      TRP  52   4.311   2.048  -1.313
  395    HE1  TRP  52           HE1      TRP  52   5.838   1.145  -3.191
  396    HE3  TRP  52           HE3      TRP  52   0.904   1.644  -5.037
  397    HZ2  TRP  52           HZ2      TRP  52   5.614   0.345  -5.942
  398    HZ3  TRP  52           HZ3      TRP  52   1.557   0.807  -7.288
  399    HH2  TRP  52           HH2      TRP  52   3.909   0.155  -7.740
  400    H    THR  53           HN       THR  53  -0.793   2.917  -3.242
  401    HA   THR  53           HA       THR  53  -2.567   4.147  -1.237
  402    HB   THR  53           HB       THR  53  -3.071   4.743  -4.150
  403    HG1  THR  53           HG1      THR  53  -2.066   6.798  -3.674
  404   1HG2  THR  53          HG21      THR  53  -4.961   5.386  -3.030
  405   2HG2  THR  53          HG22      THR  53  -4.008   6.844  -2.751
  406   3HG2  THR  53          HG23      THR  53  -4.107   5.602  -1.502
  407    H    VAL  54           HN       VAL  54  -4.963   3.540  -1.947
  408    HA   VAL  54           HA       VAL  54  -5.356   1.263  -3.695
  409    HB   VAL  54           HB       VAL  54  -4.059   0.127  -1.974
  410   1HG1  VAL  54          HG11      VAL  54  -4.049   1.177   0.024
  411   2HG1  VAL  54          HG12      VAL  54  -5.469   0.195   0.380
  412   3HG1  VAL  54          HG13      VAL  54  -5.661   1.845  -0.209
  413   1HG2  VAL  54          HG21      VAL  54  -5.457  -1.671  -1.689
  414   2HG2  VAL  54          HG22      VAL  54  -6.483  -0.751  -2.797
  415   3HG2  VAL  54          HG23      VAL  54  -6.775  -0.677  -1.059
  416    H    THR  55           HN       THR  55  -7.060   2.885  -4.200
  417    HA   THR  55           HA       THR  55  -9.164   3.412  -2.220
  418    HB   THR  55           HB       THR  55  -9.215   3.866  -5.213
  419    HG1  THR  55           HG1      THR  55  -7.966   5.403  -3.183
  420   1HG2  THR  55          HG21      THR  55 -11.254   4.310  -3.786
  421   2HG2  THR  55          HG22      THR  55 -10.644   5.720  -4.653
  422   3HG2  THR  55          HG23      THR  55 -10.307   5.529  -2.932
  423    H    GLU  56           HN       GLU  56 -11.144   2.353  -2.097
  424    HA   GLU  56           HA       GLU  56 -11.437  -0.307  -3.115
  425   1HB   GLU  56          HB2       GLU  56 -12.601   1.217  -1.202
  426   2HB   GLU  56          HB1       GLU  56 -13.853   1.296  -2.442
  427   1HG   GLU  56          HG2       GLU  56 -12.684  -1.388  -1.926
  428   2HG   GLU  56          HG1       GLU  56 -13.700  -0.720  -0.648
  Start of MODEL   18
    1   1H    THR   1          HT1       THR   1  15.731   1.241   1.525
    2   2H    THR   1          HT2       THR   1  14.171   1.089   0.869
    3   3H    THR   1          HT3       THR   1  14.690   0.026   2.088
    4    HA   THR   1           HA       THR   1  14.877   1.968   3.623
    5    HB   THR   1           HB       THR   1  13.557   3.976   2.670
    6    HG1  THR   1           HG1      THR   1  13.348   4.033   0.486
    7   1HG2  THR   1          HG21      THR   1  16.091   3.434   1.142
    8   2HG2  THR   1          HG22      THR   1  16.132   3.638   2.893
    9   3HG2  THR   1          HG23      THR   1  15.537   4.943   1.868
   10    H    THR   2           HN       THR   2  12.650   3.038   4.460
   11    HA   THR   2           HA       THR   2  10.722   0.817   4.637
   12    HB   THR   2           HB       THR   2  10.511   3.573   5.859
   13    HG1  THR   2           HG1      THR   2  12.021   1.384   6.841
   14   1HG2  THR   2          HG21      THR   2   9.720   1.965   7.781
   15   2HG2  THR   2          HG22      THR   2   9.513   0.809   6.465
   16   3HG2  THR   2          HG23      THR   2   8.627   2.334   6.447
   17    H    PHE   3           HN       PHE   3   9.096   0.665   3.152
   18    HA   PHE   3           HA       PHE   3   8.333   2.931   1.456
   19   1HB   PHE   3          HB2       PHE   3   7.299   0.094   1.787
   20   2HB   PHE   3          HB1       PHE   3   6.816   1.188   0.489
   21    HD1  PHE   3           HD1      PHE   3   9.112   2.494  -0.470
   22    HD2  PHE   3           HD2      PHE   3   8.831  -1.513   1.061
   23    HE1  PHE   3           HE1      PHE   3  11.129   1.856  -1.765
   24    HE2  PHE   3           HE2      PHE   3  10.847  -2.148  -0.234
   25    HZ   PHE   3           HZ       PHE   3  11.996  -0.464  -1.646
   26    H    LYS   4           HN       LYS   4   5.691   2.954   1.169
   27    HA   LYS   4           HA       LYS   4   4.329   2.949   3.806
   28   1HB   LYS   4          HB2       LYS   4   5.706   5.140   3.198
   29   2HB   LYS   4          HB1       LYS   4   4.294   5.482   2.201
   30   1HG   LYS   4          HG2       LYS   4   2.891   4.996   4.290
   31   2HG   LYS   4          HG1       LYS   4   4.404   5.074   5.190
   32   1HD   LYS   4          HD2       LYS   4   3.964   7.299   5.320
   33   2HD   LYS   4          HD1       LYS   4   4.586   7.339   3.670
   34   1HE   LYS   4          HE2       LYS   4   2.513   7.717   2.778
   35   2HE   LYS   4          HE1       LYS   4   1.724   6.592   3.901
   36   1HZ   LYS   4          HZ1       LYS   4   2.049   8.208   5.679
   37   2HZ   LYS   4          HZ2       LYS   4   1.118   8.873   4.422
   38   3HZ   LYS   4          HZ3       LYS   4   2.756   9.295   4.586
   39    H    LEU   5           HN       LEU   5   2.042   2.964   3.588
   40    HA   LEU   5           HA       LEU   5   0.842   3.290   0.895
   41   1HB   LEU   5          HB2       LEU   5   1.688   0.840   1.507
   42   2HB   LEU   5          HB1       LEU   5   0.201   0.800   2.443
   43    HG   LEU   5           HG       LEU   5  -0.249   1.909  -0.222
   44   1HD1  LEU   5          HD11      LEU   5   0.309   0.113  -1.599
   45   2HD1  LEU   5          HD12      LEU   5   0.399  -1.025  -0.246
   46   3HD1  LEU   5          HD13      LEU   5   1.690   0.155  -0.496
   47   1HD2  LEU   5          HD21      LEU   5  -1.359  -0.431   1.354
   48   2HD2  LEU   5          HD22      LEU   5  -2.000   0.096  -0.202
   49   3HD2  LEU   5          HD23      LEU   5  -2.071   1.175   1.191
   50    H    ILE   6           HN       ILE   6  -1.223   4.130   1.086
   51    HA   ILE   6           HA       ILE   6  -2.328   4.398   3.855
   52    HB   ILE   6           HB       ILE   6  -2.688   5.997   1.303
   53   1HG1  ILE   6          HG12      ILE   6  -0.464   6.202   2.378
   54   2HG1  ILE   6          HG11      ILE   6  -1.375   7.707   2.486
   55   1HG2  ILE   6          HG21      ILE   6  -3.691   7.658   3.070
   56   2HG2  ILE   6          HG22      ILE   6  -3.967   6.196   4.017
   57   3HG2  ILE   6          HG23      ILE   6  -4.706   6.368   2.425
   58   1HD1  ILE   6          HD11      ILE   6  -1.015   7.651   4.713
   59   2HD1  ILE   6          HD12      ILE   6  -0.359   6.018   4.621
   60   3HD1  ILE   6          HD13      ILE   6  -2.097   6.260   4.784
   61    H    ILE   7           HN       ILE   7  -4.300   3.488   4.299
   62    HA   ILE   7           HA       ILE   7  -5.630   1.867   2.225
   63    HB   ILE   7           HB       ILE   7  -6.211   2.351   5.169
   64   1HG1  ILE   7          HG12      ILE   7  -4.785   0.032   3.827
   65   2HG1  ILE   7          HG11      ILE   7  -3.959   1.357   4.647
   66   1HG2  ILE   7          HG21      ILE   7  -8.189   1.430   4.315
   67   2HG2  ILE   7          HG22      ILE   7  -7.288  -0.009   4.792
   68   3HG2  ILE   7          HG23      ILE   7  -7.336   0.480   3.099
   69   1HD1  ILE   7          HD11      ILE   7  -4.115  -0.286   6.324
   70   2HD1  ILE   7          HD12      ILE   7  -5.737  -0.770   5.827
   71   3HD1  ILE   7          HD13      ILE   7  -5.492   0.763   6.665
   72    H    ASN   8           HN       ASN   8  -7.202   2.765   0.964
   73    HA   ASN   8           HA       ASN   8  -8.810   5.039   2.083
   74   1HB   ASN   8          HB2       ASN   8  -7.678   4.366  -0.625
   75   2HB   ASN   8          HB1       ASN   8  -9.082   5.427  -0.505
   76   1HD2  ASN   8          HD21      ASN   8  -7.593   7.170  -1.348
   77   2HD2  ASN   8          HD22      ASN   8  -6.546   7.956  -0.255
   78    H    GLY   9           HN       GLY   9  -9.727   2.563   2.769
   79   1HA   GLY   9          HA2       GLY   9 -11.593   1.532   0.753
   80   2HA   GLY   9          HA1       GLY   9 -11.429   0.945   2.414
   81    H    LYS  10           HN       LYS  10 -13.946   1.452   1.182
   82    HA   LYS  10           HA       LYS  10 -15.129   3.957   1.650
   83   1HB   LYS  10          HB2       LYS  10 -16.207   1.136   1.880
   84   2HB   LYS  10          HB1       LYS  10 -17.230   2.572   1.837
   85   1HG   LYS  10          HG2       LYS  10 -16.562   3.120  -0.372
   86   2HG   LYS  10          HG1       LYS  10 -15.178   2.028  -0.310
   87   1HD   LYS  10          HD2       LYS  10 -16.694   0.091  -0.215
   88   2HD   LYS  10          HD1       LYS  10 -18.087   1.173  -0.255
   89   1HE   LYS  10          HE2       LYS  10 -17.127   2.084  -2.462
   90   2HE   LYS  10          HE1       LYS  10 -16.064   0.662  -2.448
   91   1HZ   LYS  10          HZ1       LYS  10 -17.934  -0.777  -2.300
   92   2HZ   LYS  10          HZ2       LYS  10 -18.239   0.295  -3.582
   93   3HZ   LYS  10          HZ3       LYS  10 -19.006   0.519  -2.083
   94    H    THR  11           HN       THR  11 -14.305   1.413   3.938
   95    HA   THR  11           HA       THR  11 -15.309   3.157   6.165
   96    HB   THR  11           HB       THR  11 -15.282   0.133   6.172
   97    HG1  THR  11           HG1      THR  11 -17.388   0.217   5.451
   98   1HG2  THR  11          HG21      THR  11 -15.607   1.809   8.227
   99   2HG2  THR  11          HG22      THR  11 -16.526   0.309   8.103
  100   3HG2  THR  11          HG23      THR  11 -17.261   1.837   7.615
  101    H    LEU  12           HN       LEU  12 -13.051   0.552   5.233
  102    HA   LEU  12           HA       LEU  12 -11.410   0.903   7.643
  103   1HB   LEU  12          HB2       LEU  12 -11.188  -0.707   5.086
  104   2HB   LEU  12          HB1       LEU  12  -9.998  -0.797   6.386
  105    HG   LEU  12           HG       LEU  12 -12.938  -1.205   6.924
  106   1HD1  LEU  12          HD11      LEU  12 -12.826  -3.459   6.387
  107   2HD1  LEU  12          HD12      LEU  12 -11.073  -3.523   6.573
  108   3HD1  LEU  12          HD13      LEU  12 -11.781  -2.788   5.134
  109   1HD2  LEU  12          HD21      LEU  12 -11.923  -1.048   8.983
  110   2HD2  LEU  12          HD22      LEU  12 -10.348  -1.541   8.360
  111   3HD2  LEU  12          HD23      LEU  12 -11.592  -2.752   8.672
  112    H    LYS  13           HN       LYS  13  -9.661   2.254   7.801
  113    HA   LYS  13           HA       LYS  13  -8.278   3.197   5.342
  114   1HB   LYS  13          HB2       LYS  13 -10.085   4.730   7.122
  115   2HB   LYS  13          HB1       LYS  13  -8.565   5.535   6.732
  116   1HG   LYS  13          HG2       LYS  13  -9.008   5.519   4.418
  117   2HG   LYS  13          HG1       LYS  13 -10.233   4.259   4.570
  118   1HD   LYS  13          HD2       LYS  13 -11.866   5.732   5.224
  119   2HD   LYS  13          HD1       LYS  13 -10.727   6.779   6.072
  120   1HE   LYS  13          HE2       LYS  13  -9.838   7.231   3.593
  121   2HE   LYS  13          HE1       LYS  13 -11.507   6.785   3.183
  122   1HZ   LYS  13          HZ1       LYS  13 -12.350   8.390   4.692
  123   2HZ   LYS  13          HZ2       LYS  13 -11.184   9.187   3.747
  124   3HZ   LYS  13          HZ3       LYS  13 -10.813   8.707   5.334
  125    H    GLY  14           HN       GLY  14  -6.487   4.903   6.279
  126   1HA   GLY  14          HA2       GLY  14  -5.200   5.224   8.492
  127   2HA   GLY  14          HA1       GLY  14  -5.146   3.461   8.524
  128    H    GLU  15           HN       GLU  15  -2.793   3.640   8.473
  129    HA   GLU  15           HA       GLU  15  -1.765   3.871   5.689
  130   1HB   GLU  15          HB2       GLU  15   0.074   5.328   6.508
  131   2HB   GLU  15          HB1       GLU  15  -1.502   6.077   6.756
  132   1HG   GLU  15          HG2       GLU  15  -1.262   4.750   9.104
  133   2HG   GLU  15          HG1       GLU  15   0.441   5.051   8.756
  134    H    THR  16           HN       THR  16   0.449   2.889   5.515
  135    HA   THR  16           HA       THR  16   1.380   1.235   7.776
  136    HB   THR  16           HB       THR  16  -0.483  -0.064   6.837
  137    HG1  THR  16           HG1      THR  16   1.987  -1.145   5.973
  138   1HG2  THR  16          HG21      THR  16  -0.148  -0.939   4.445
  139   2HG2  THR  16          HG22      THR  16   1.011   0.376   4.244
  140   3HG2  THR  16          HG23      THR  16  -0.678   0.734   4.610
  141    H    THR  17           HN       THR  17   3.453   0.208   7.301
  142    HA   THR  17           HA       THR  17   4.794   1.105   4.780
  143    HB   THR  17           HB       THR  17   6.706   1.851   6.163
  144    HG1  THR  17           HG1      THR  17   6.731   1.519   8.252
  145   1HG2  THR  17          HG21      THR  17   4.535   3.286   7.540
  146   2HG2  THR  17          HG22      THR  17   4.333   3.184   5.791
  147   3HG2  THR  17          HG23      THR  17   5.792   3.906   6.470
  148    H    THR  18           HN       THR  18   6.739  -0.183   4.306
  149    HA   THR  18           HA       THR  18   7.119  -2.630   5.931
  150    HB   THR  18           HB       THR  18   5.610  -2.399   3.444
  151    HG1  THR  18           HG1      THR  18   4.857  -3.673   5.017
  152   1HG2  THR  18          HG21      THR  18   7.803  -2.919   2.378
  153   2HG2  THR  18          HG22      THR  18   6.611  -4.202   2.158
  154   3HG2  THR  18          HG23      THR  18   7.901  -4.391   3.347
  155    H    GLU  19           HN       GLU  19   9.146  -3.756   5.295
  156    HA   GLU  19           HA       GLU  19  11.125  -1.903   4.005
  157   1HB   GLU  19          HB2       GLU  19  11.263  -2.368   6.509
  158   2HB   GLU  19          HB1       GLU  19  11.626  -4.044   6.093
  159   1HG   GLU  19          HG2       GLU  19  13.406  -2.800   4.488
  160   2HG   GLU  19          HG1       GLU  19  13.308  -1.610   5.788
  161    H    ALA  20           HN       ALA  20  11.680  -2.717   2.017
  162    HA   ALA  20           HA       ALA  20  12.313  -5.611   1.769
  163   1HB   ALA  20          HB1       ALA  20  10.829  -5.262  -0.469
  164   2HB   ALA  20          HB2       ALA  20  10.003  -4.138   0.612
  165   3HB   ALA  20          HB3       ALA  20  10.143  -5.842   1.049
  166    H    VAL  21           HN       VAL  21  13.041  -5.974  -0.656
  167    HA   VAL  21           HA       VAL  21  15.355  -4.401  -1.188
  168    HB   VAL  21           HB       VAL  21  14.932  -6.712  -1.969
  169   1HG1  VAL  21          HG11      VAL  21  13.113  -5.581  -4.086
  170   2HG1  VAL  21          HG12      VAL  21  12.470  -6.157  -2.548
  171   3HG1  VAL  21          HG13      VAL  21  13.334  -7.265  -3.614
  172   1HG2  VAL  21          HG21      VAL  21  15.729  -4.517  -3.797
  173   2HG2  VAL  21          HG22      VAL  21  15.401  -6.073  -4.558
  174   3HG2  VAL  21          HG23      VAL  21  16.628  -5.949  -3.298
  175    H    ASP  22           HN       ASP  22  12.061  -4.213  -2.476
  176    HA   ASP  22           HA       ASP  22  12.598  -1.461  -3.449
  177   1HB   ASP  22          HB2       ASP  22  13.257  -3.076  -5.219
  178   2HB   ASP  22          HB1       ASP  22  11.642  -3.781  -5.156
  179    H    ALA  23           HN       ALA  23  10.539  -0.362  -4.013
  180    HA   ALA  23           HA       ALA  23   8.414  -0.853  -2.175
  181   1HB   ALA  23          HB1       ALA  23   8.484   1.319  -2.990
  182   2HB   ALA  23          HB2       ALA  23   7.227   0.661  -4.038
  183   3HB   ALA  23          HB3       ALA  23   8.884   0.798  -4.627
  184    H    ALA  24           HN       ALA  24   8.880  -1.893  -5.535
  185    HA   ALA  24           HA       ALA  24   6.277  -2.874  -6.115
  186   1HB   ALA  24          HB1       ALA  24   7.503  -4.295  -7.743
  187   2HB   ALA  24          HB2       ALA  24   9.011  -3.939  -6.902
  188   3HB   ALA  24          HB3       ALA  24   8.136  -2.649  -7.726
  189    H    THR  25           HN       THR  25   9.044  -4.523  -4.572
  190    HA   THR  25           HA       THR  25   7.755  -7.059  -4.177
  191    HB   THR  25           HB       THR  25  10.047  -5.588  -2.830
  192    HG1  THR  25           HG1      THR  25   9.907  -7.761  -4.644
  193   1HG2  THR  25          HG21      THR  25   9.261  -8.498  -2.468
  194   2HG2  THR  25          HG22      THR  25   9.071  -7.239  -1.243
  195   3HG2  THR  25          HG23      THR  25  10.685  -7.712  -1.785
  196    H    ALA  26           HN       ALA  26   8.116  -4.201  -2.059
  197    HA   ALA  26           HA       ALA  26   6.822  -5.265   0.233
  198   1HB   ALA  26          HB1       ALA  26   8.095  -3.223   0.334
  199   2HB   ALA  26          HB2       ALA  26   6.425  -2.791   0.721
  200   3HB   ALA  26          HB3       ALA  26   7.078  -2.459  -0.889
  201    H    GLU  27           HN       GLU  27   5.385  -3.006  -2.170
  202    HA   GLU  27           HA       GLU  27   2.768  -2.973  -1.329
  203   1HB   GLU  27          HB2       GLU  27   2.202  -2.476  -3.675
  204   2HB   GLU  27          HB1       GLU  27   3.709  -1.694  -3.211
  205   1HG   GLU  27          HG2       GLU  27   4.970  -2.990  -4.614
  206   2HG   GLU  27          HG1       GLU  27   3.965  -4.414  -4.380
  207    H    LYS  28           HN       LYS  28   4.327  -5.738  -2.865
  208    HA   LYS  28           HA       LYS  28   1.894  -7.168  -3.546
  209   1HB   LYS  28          HB2       LYS  28   4.714  -8.107  -2.876
  210   2HB   LYS  28          HB1       LYS  28   3.480  -9.093  -3.661
  211   1HG   LYS  28          HG2       LYS  28   3.549  -7.846  -5.638
  212   2HG   LYS  28          HG1       LYS  28   4.231  -6.431  -4.836
  213   1HD   LYS  28          HD2       LYS  28   6.183  -7.182  -5.758
  214   2HD   LYS  28          HD1       LYS  28   6.193  -8.243  -4.348
  215   1HE   LYS  28          HE2       LYS  28   5.634 -10.111  -5.582
  216   2HE   LYS  28          HE1       LYS  28   4.660  -9.180  -6.738
  217   1HZ   LYS  28          HZ1       LYS  28   7.625  -9.162  -6.518
  218   2HZ   LYS  28          HZ2       LYS  28   6.722  -8.162  -7.555
  219   3HZ   LYS  28          HZ3       LYS  28   6.719  -9.846  -7.779
  220    H    VAL  29           HN       VAL  29   4.091  -7.127  -0.749
  221    HA   VAL  29           HA       VAL  29   2.590  -9.051   0.839
  222    HB   VAL  29           HB       VAL  29   4.735  -6.957   1.312
  223   1HG1  VAL  29          HG11      VAL  29   4.950  -7.726   3.638
  224   2HG1  VAL  29          HG12      VAL  29   3.559  -8.791   3.431
  225   3HG1  VAL  29          HG13      VAL  29   3.345  -7.038   3.372
  226   1HG2  VAL  29          HG21      VAL  29   6.088  -8.972   1.813
  227   2HG2  VAL  29          HG22      VAL  29   5.377  -9.050   0.201
  228   3HG2  VAL  29          HG23      VAL  29   4.672  -9.982   1.523
  229    H    LEU  30           HN       LEU  30   2.582  -5.513   0.461
  230    HA   LEU  30           HA       LEU  30   0.819  -4.955   2.659
  231   1HB   LEU  30          HB2       LEU  30   1.560  -3.565   0.075
  232   2HB   LEU  30          HB1       LEU  30   0.431  -2.837   1.201
  233    HG   LEU  30           HG       LEU  30   3.008  -2.241   1.304
  234   1HD1  LEU  30          HD11      LEU  30   2.801  -1.928   3.790
  235   2HD1  LEU  30          HD12      LEU  30   1.263  -2.799   3.703
  236   3HD1  LEU  30          HD13      LEU  30   1.462  -1.271   2.842
  237   1HD2  LEU  30          HD21      LEU  30   2.894  -4.825   2.873
  238   2HD2  LEU  30          HD22      LEU  30   4.106  -3.589   3.136
  239   3HD2  LEU  30          HD23      LEU  30   4.001  -4.382   1.577
  240    H    LYS  31           HN       LYS  31   0.346  -5.895  -0.707
  241    HA   LYS  31           HA       LYS  31  -2.486  -5.459  -0.948
  242   1HB   LYS  31          HB2       LYS  31  -0.549  -6.261  -2.614
  243   2HB   LYS  31          HB1       LYS  31  -1.071  -7.849  -2.104
  244   1HG   LYS  31          HG2       LYS  31  -3.052  -5.786  -3.072
  245   2HG   LYS  31          HG1       LYS  31  -2.214  -6.856  -4.195
  246   1HD   LYS  31          HD2       LYS  31  -3.955  -7.730  -1.866
  247   2HD   LYS  31          HD1       LYS  31  -4.387  -7.821  -3.572
  248   1HE   LYS  31          HE2       LYS  31  -1.879  -9.110  -3.368
  249   2HE   LYS  31          HE1       LYS  31  -2.844  -9.707  -1.998
  250   1HZ   LYS  31          HZ1       LYS  31  -3.266 -10.945  -4.090
  251   2HZ   LYS  31          HZ2       LYS  31  -3.839  -9.510  -4.797
  252   3HZ   LYS  31          HZ3       LYS  31  -4.657 -10.195  -3.474
  253    H    GLN  32           HN       GLN  32  -0.533  -8.211   0.151
  254    HA   GLN  32           HA       GLN  32  -2.576 -10.084   0.735
  255   1HB   GLN  32          HB2       GLN  32   0.207  -9.509   1.562
  256   2HB   GLN  32          HB1       GLN  32  -0.724 -10.536   2.652
  257   1HG   GLN  32          HG2       GLN  32  -1.375 -11.904   0.600
  258   2HG   GLN  32          HG1       GLN  32  -0.131 -11.007  -0.271
  259   1HE2  GLN  32          HE21      GLN  32   2.140 -11.189   0.598
  260   2HE2  GLN  32          HE22      GLN  32   2.586 -12.599   1.450
  261    H    TYR  33           HN       TYR  33  -1.269  -7.403   2.673
  262    HA   TYR  33           HA       TYR  33  -2.829  -7.884   5.068
  263   1HB   TYR  33          HB2       TYR  33  -0.826  -6.475   5.022
  264   2HB   TYR  33          HB1       TYR  33  -1.572  -5.397   3.844
  265    HD1  TYR  33           HD1      TYR  33  -1.826  -6.688   7.303
  266    HD2  TYR  33           HD2      TYR  33  -3.052  -3.657   4.523
  267    HE1  TYR  33           HE1      TYR  33  -2.856  -5.420   9.151
  268    HE2  TYR  33           HE2      TYR  33  -4.080  -2.376   6.377
  269    HH   TYR  33           HH       TYR  33  -3.803  -2.191   8.865
  270    H    ILE  34           HN       ILE  34  -3.291  -5.922   2.146
  271    HA   ILE  34           HA       ILE  34  -5.810  -4.726   2.849
  272    HB   ILE  34           HB       ILE  34  -4.535  -5.467   0.196
  273   1HG1  ILE  34          HG12      ILE  34  -3.291  -3.951   1.864
  274   2HG1  ILE  34          HG11      ILE  34  -3.497  -3.333   0.230
  275   1HG2  ILE  34          HG21      ILE  34  -6.774  -3.509   0.776
  276   2HG2  ILE  34          HG22      ILE  34  -6.930  -5.035  -0.095
  277   3HG2  ILE  34          HG23      ILE  34  -5.981  -3.719  -0.786
  278   1HD1  ILE  34          HD11      ILE  34  -3.997  -1.599   1.908
  279   2HD1  ILE  34          HD12      ILE  34  -5.228  -2.641   2.625
  280   3HD1  ILE  34          HD13      ILE  34  -5.444  -2.015   0.989
  281    H    ASN  35           HN       ASN  35  -4.900  -7.874   1.571
  282    HA   ASN  35           HA       ASN  35  -7.355  -8.768   0.466
  283   1HB   ASN  35          HB2       ASN  35  -5.034  -9.824   0.446
  284   2HB   ASN  35          HB1       ASN  35  -5.384 -10.417   2.069
  285   1HD2  ASN  35          HD21      ASN  35  -5.080 -11.921  -0.581
  286   2HD2  ASN  35          HD22      ASN  35  -6.503 -12.838  -0.710
  287    H    ASP  36           HN       ASP  36  -6.356  -8.406   3.816
  288    HA   ASP  36           HA       ASP  36  -8.490 -10.052   4.943
  289   1HB   ASP  36          HB2       ASP  36  -6.614  -7.955   6.085
  290   2HB   ASP  36          HB1       ASP  36  -7.646  -9.003   7.060
  291    H    ASN  37           HN       ASN  37  -7.865  -6.517   4.938
  292    HA   ASN  37           HA       ASN  37 -10.404  -5.750   6.015
  293   1HB   ASN  37          HB2       ASN  37  -8.439  -4.320   4.191
  294   2HB   ASN  37          HB1       ASN  37  -9.750  -3.523   5.068
  295   1HD2  ASN  37          HD21      ASN  37  -8.117  -2.281   6.310
  296   2HD2  ASN  37          HD22      ASN  37  -7.251  -3.031   7.574
  297    H    GLY  38           HN       GLY  38  -9.363  -6.523   2.742
  298   1HA   GLY  38          HA2       GLY  38 -10.749  -7.087   0.899
  299   2HA   GLY  38          HA1       GLY  38 -12.157  -6.605   1.847
  300    H    ILE  39           HN       ILE  39  -9.360  -4.517   1.480
  301    HA   ILE  39           HA       ILE  39 -11.065  -2.622  -0.093
  302    HB   ILE  39           HB       ILE  39  -8.709  -2.223   1.783
  303   1HG1  ILE  39          HG12      ILE  39 -10.798  -2.830   2.932
  304   2HG1  ILE  39          HG11      ILE  39 -10.407  -1.135   3.231
  305   1HG2  ILE  39          HG21      ILE  39  -9.586   0.243   1.554
  306   2HG2  ILE  39          HG22      ILE  39 -10.231  -0.329   0.016
  307   3HG2  ILE  39          HG23      ILE  39  -8.498  -0.409   0.329
  308   1HD1  ILE  39          HD11      ILE  39 -12.535  -0.714   2.567
  309   2HD1  ILE  39          HD12      ILE  39 -12.709  -2.301   1.819
  310   3HD1  ILE  39          HD13      ILE  39 -11.934  -0.989   0.932
  311    H    ASP  40           HN       ASP  40 -10.272  -4.046  -1.991
  312    HA   ASP  40           HA       ASP  40  -7.556  -3.139  -2.900
  313   1HB   ASP  40          HB2       ASP  40  -7.848  -5.579  -2.410
  314   2HB   ASP  40          HB1       ASP  40  -9.127  -5.636  -3.628
  315    H    GLY  41           HN       GLY  41  -8.387  -1.250  -3.977
  316   1HA   GLY  41          HA2       GLY  41 -10.168  -1.843  -6.310
  317   2HA   GLY  41          HA1       GLY  41 -10.229  -0.316  -5.425
  318    H    GLU  42           HN       GLU  42  -8.480   1.190  -5.692
  319    HA   GLU  42           HA       GLU  42  -6.691   0.606  -8.032
  320   1HB   GLU  42          HB2       GLU  42  -8.708   2.674  -7.509
  321   2HB   GLU  42          HB1       GLU  42  -7.152   3.354  -7.984
  322   1HG   GLU  42          HG2       GLU  42  -7.251   2.475 -10.095
  323   2HG   GLU  42          HG1       GLU  42  -8.097   1.021  -9.563
  324    H    TRP  43           HN       TRP  43  -4.587   0.681  -7.399
  325    HA   TRP  43           HA       TRP  43  -3.826   2.248  -4.977
  326   1HB   TRP  43          HB2       TRP  43  -2.469   0.121  -6.665
  327   2HB   TRP  43          HB1       TRP  43  -1.669   0.947  -5.341
  328    HD1  TRP  43           HD1      TRP  43  -5.356  -0.121  -5.062
  329    HE1  TRP  43           HE1      TRP  43  -5.521  -1.972  -3.294
  330    HE3  TRP  43           HE3      TRP  43  -0.413  -0.859  -4.125
  331    HZ2  TRP  43           HZ2      TRP  43  -3.789  -3.529  -1.653
  332    HZ3  TRP  43           HZ3      TRP  43   0.309  -2.524  -2.427
  333    HH2  TRP  43           HH2      TRP  43  -1.368  -3.853  -1.195
  334    H    THR  44           HN       THR  44  -1.738   3.489  -5.166
  335    HA   THR  44           HA       THR  44  -0.962   4.332  -7.899
  336    HB   THR  44           HB       THR  44  -1.336   6.704  -7.344
  337    HG1  THR  44           HG1      THR  44  -2.448   7.190  -5.422
  338   1HG2  THR  44          HG21      THR  44  -3.695   6.719  -7.613
  339   2HG2  THR  44          HG22      THR  44  -3.885   5.207  -6.724
  340   3HG2  THR  44          HG23      THR  44  -3.167   5.198  -8.335
  341    H    TYR  45           HN       TYR  45   1.225   4.607  -7.937
  342    HA   TYR  45           HA       TYR  45   2.690   4.577  -5.345
  343   1HB   TYR  45          HB2       TYR  45   3.156   2.897  -7.114
  344   2HB   TYR  45          HB1       TYR  45   3.590   4.194  -8.223
  345    HD1  TYR  45           HD1      TYR  45   4.370   3.499  -4.609
  346    HD2  TYR  45           HD2      TYR  45   5.886   4.279  -8.552
  347    HE1  TYR  45           HE1      TYR  45   6.686   3.505  -3.718
  348    HE2  TYR  45           HE2      TYR  45   8.198   4.282  -7.663
  349    HH   TYR  45           HH       TYR  45   9.367   4.594  -5.584
  350    H    ASP  46           HN       ASP  46   4.560   6.072  -5.117
  351    HA   ASP  46           HA       ASP  46   4.626   8.435  -6.909
  352   1HB   ASP  46          HB2       ASP  46   4.317   9.946  -4.941
  353   2HB   ASP  46          HB1       ASP  46   2.897   8.951  -5.254
  354    H    ASP  47           HN       ASP  47   6.754   8.778  -7.295
  355    HA   ASP  47           HA       ASP  47   8.865   7.557  -5.730
  356   1HB   ASP  47          HB2       ASP  47   8.902   8.006  -8.181
  357   2HB   ASP  47          HB1       ASP  47   8.948   9.736  -7.840
  358    H    ALA  48           HN       ALA  48   7.166  10.570  -5.433
  359    HA   ALA  48           HA       ALA  48   9.111  12.326  -4.380
  360   1HB   ALA  48          HB1       ALA  48   7.042  13.307  -4.675
  361   2HB   ALA  48          HB2       ALA  48   6.926  12.971  -2.947
  362   3HB   ALA  48          HB3       ALA  48   6.174  11.879  -4.110
  363    H    THR  49           HN       THR  49   7.440   9.623  -2.828
  364    HA   THR  49           HA       THR  49   9.408   9.658  -0.622
  365    HB   THR  49           HB       THR  49   7.665  11.224   0.089
  366    HG1  THR  49           HG1      THR  49   7.344   8.712   1.362
  367   1HG2  THR  49          HG21      THR  49   5.745  10.685  -1.140
  368   2HG2  THR  49          HG22      THR  49   5.329  10.131   0.482
  369   3HG2  THR  49          HG23      THR  49   5.853   8.971  -0.739
  370    H    LYS  50           HN       LYS  50   8.346   7.849  -2.886
  371    HA   LYS  50           HA       LYS  50   7.868   5.563  -3.214
  372   1HB   LYS  50          HB2       LYS  50   9.149   5.457  -0.466
  373   2HB   LYS  50          HB1       LYS  50   9.041   4.122  -1.606
  374   1HG   LYS  50          HG2       LYS  50  10.229   6.532  -2.793
  375   2HG   LYS  50          HG1       LYS  50  11.153   5.913  -1.425
  376   1HD   LYS  50          HD2       LYS  50  10.605   3.590  -2.730
  377   2HD   LYS  50          HD1       LYS  50  10.689   4.707  -4.092
  378   1HE   LYS  50          HE2       LYS  50  12.835   4.459  -1.952
  379   2HE   LYS  50          HE1       LYS  50  12.924   3.723  -3.565
  380   1HZ   LYS  50          HZ1       LYS  50  13.970   5.840  -3.704
  381   2HZ   LYS  50          HZ2       LYS  50  12.677   6.609  -2.914
  382   3HZ   LYS  50          HZ3       LYS  50  12.467   5.982  -4.479
  383    H    THR  51           HN       THR  51   5.800   7.237  -1.746
  384    HA   THR  51           HA       THR  51   4.584   5.374   0.184
  385    HB   THR  51           HB       THR  51   3.769   8.028  -1.050
  386    HG1  THR  51           HG1      THR  51   4.192   8.655   1.177
  387   1HG2  THR  51          HG21      THR  51   2.082   8.052   0.861
  388   2HG2  THR  51          HG22      THR  51   2.387   6.323   1.037
  389   3HG2  THR  51          HG23      THR  51   1.708   6.951  -0.465
  390    H    TRP  52           HN       TRP  52   2.220   4.747  -0.206
  391    HA   TRP  52           HA       TRP  52   1.698   4.152  -3.100
  392   1HB   TRP  52          HB2       TRP  52   1.756   2.405  -0.647
  393   2HB   TRP  52          HB1       TRP  52   0.786   1.958  -2.046
  394    HD1  TRP  52           HD1      TRP  52   4.345   2.138  -0.818
  395    HE1  TRP  52           HE1      TRP  52   5.907   1.120  -2.604
  396    HE3  TRP  52           HE3      TRP  52   1.045   1.632  -4.634
  397    HZ2  TRP  52           HZ2      TRP  52   5.752   0.199  -5.319
  398    HZ3  TRP  52           HZ3      TRP  52   1.752   0.676  -6.818
  399    HH2  TRP  52           HH2      TRP  52   4.103  -0.040  -7.162
  400    H    THR  53           HN       THR  53  -0.699   2.943  -2.945
  401    HA   THR  53           HA       THR  53  -2.512   4.315  -1.081
  402    HB   THR  53           HB       THR  53  -2.782   4.782  -4.060
  403    HG1  THR  53           HG1      THR  53  -1.967   6.902  -3.498
  404   1HG2  THR  53          HG21      THR  53  -4.848   5.268  -3.147
  405   2HG2  THR  53          HG22      THR  53  -4.051   6.828  -2.939
  406   3HG2  THR  53          HG23      THR  53  -4.168   5.709  -1.580
  407    H    VAL  54           HN       VAL  54  -4.851   3.666  -1.630
  408    HA   VAL  54           HA       VAL  54  -5.376   1.393  -3.344
  409    HB   VAL  54           HB       VAL  54  -4.020   0.181  -1.759
  410   1HG1  VAL  54          HG11      VAL  54  -3.734   1.469   0.121
  411   2HG1  VAL  54          HG12      VAL  54  -4.896   0.297   0.741
  412   3HG1  VAL  54          HG13      VAL  54  -5.440   1.893   0.225
  413   1HG2  VAL  54          HG21      VAL  54  -6.675  -0.390  -0.515
  414   2HG2  VAL  54          HG22      VAL  54  -5.470  -1.511  -1.155
  415   3HG2  VAL  54          HG23      VAL  54  -6.525  -0.617  -2.258
  416    H    THR  55           HN       THR  55  -7.129   2.906  -3.803
  417    HA   THR  55           HA       THR  55  -9.109   3.426  -1.656
  418    HB   THR  55           HB       THR  55  -9.113   4.209  -4.586
  419    HG1  THR  55           HG1      THR  55  -7.849   5.860  -4.063
  420   1HG2  THR  55          HG21      THR  55 -10.579   5.993  -3.861
  421   2HG2  THR  55          HG22      THR  55 -10.356   5.547  -2.169
  422   3HG2  THR  55          HG23      THR  55 -11.231   4.470  -3.258
  423    H    GLU  56           HN       GLU  56 -11.238   2.595  -1.725
  424    HA   GLU  56           HA       GLU  56 -11.621   0.195  -3.448
  425   1HB   GLU  56          HB2       GLU  56 -11.865   0.382  -0.855
  426   2HB   GLU  56          HB1       GLU  56 -13.409   1.152  -1.215
  427   1HG   GLU  56          HG2       GLU  56 -13.728  -1.258  -0.879
  428   2HG   GLU  56          HG1       GLU  56 -14.072  -0.828  -2.552
  Start of MODEL   19
    1   1H    THR   1          HT1       THR   1  13.236   6.012   6.990
    2   2H    THR   1          HT2       THR   1  12.275   7.357   7.381
    3   3H    THR   1          HT3       THR   1  12.628   7.005   5.756
    4    HA   THR   1           HA       THR   1  11.086   5.172   7.516
    5    HB   THR   1           HB       THR   1   9.997   7.370   7.324
    6    HG1  THR   1           HG1      THR   1   8.123   6.626   6.139
    7   1HG2  THR   1          HG21      THR   1  11.030   8.298   5.374
    8   2HG2  THR   1          HG22      THR   1   9.319   8.118   4.984
    9   3HG2  THR   1          HG23      THR   1  10.491   6.953   4.369
   10    H    THR   2           HN       THR   2  10.294   3.371   6.350
   11    HA   THR   2           HA       THR   2  11.653   2.816   3.773
   12    HB   THR   2           HB       THR   2   9.835   0.887   5.151
   13    HG1  THR   2           HG1      THR   2  11.105   0.654   6.864
   14   1HG2  THR   2          HG21      THR   2  12.232  -0.341   4.775
   15   2HG2  THR   2          HG22      THR   2  12.301   0.888   3.512
   16   3HG2  THR   2          HG23      THR   2  10.974  -0.271   3.543
   17    H    PHE   3           HN       PHE   3   9.740   1.015   2.717
   18    HA   PHE   3           HA       PHE   3   8.060   2.716   1.179
   19   1HB   PHE   3          HB2       PHE   3   7.704  -0.232   1.821
   20   2HB   PHE   3          HB1       PHE   3   7.092   0.607   0.399
   21    HD1  PHE   3           HD1      PHE   3   9.448   2.322  -0.301
   22    HD2  PHE   3           HD2      PHE   3   9.249  -1.789   0.943
   23    HE1  PHE   3           HE1      PHE   3  11.583   1.861  -1.474
   24    HE2  PHE   3           HE2      PHE   3  11.385  -2.244  -0.229
   25    HZ   PHE   3           HZ       PHE   3  12.552  -0.420  -1.435
   26    H    LYS   4           HN       LYS   4   6.056   3.563   1.572
   27    HA   LYS   4           HA       LYS   4   4.571   2.632   4.013
   28   1HB   LYS   4          HB2       LYS   4   5.771   4.950   3.894
   29   2HB   LYS   4          HB1       LYS   4   4.458   5.397   2.809
   30   1HG   LYS   4          HG2       LYS   4   2.858   4.572   4.620
   31   2HG   LYS   4          HG1       LYS   4   4.256   4.515   5.690
   32   1HD   LYS   4          HD2       LYS   4   3.804   6.685   6.133
   33   2HD   LYS   4          HD1       LYS   4   4.503   7.014   4.548
   34   1HE   LYS   4          HE2       LYS   4   2.476   7.550   3.655
   35   2HE   LYS   4          HE1       LYS   4   1.675   6.172   4.436
   36   1HZ   LYS   4          HZ1       LYS   4   0.951   8.315   5.368
   37   2HZ   LYS   4          HZ2       LYS   4   2.552   8.645   5.834
   38   3HZ   LYS   4          HZ3       LYS   4   1.714   7.340   6.527
   39    H    LEU   5           HN       LEU   5   2.228   2.718   3.829
   40    HA   LEU   5           HA       LEU   5   1.065   3.262   1.151
   41   1HB   LEU   5          HB2       LEU   5   1.886   0.760   1.622
   42   2HB   LEU   5          HB1       LEU   5   0.359   0.677   2.488
   43    HG   LEU   5           HG       LEU   5  -0.008   1.984  -0.085
   44   1HD1  LEU   5          HD11      LEU   5   1.993   0.326  -0.463
   45   2HD1  LEU   5          HD12      LEU   5   0.647   0.345  -1.608
   46   3HD1  LEU   5          HD13      LEU   5   0.737  -0.915  -0.365
   47   1HD2  LEU   5          HD21      LEU   5  -1.100  -0.507   1.254
   48   2HD2  LEU   5          HD22      LEU   5  -1.679   0.085  -0.304
   49   3HD2  LEU   5          HD23      LEU   5  -1.869   1.076   1.142
   50    H    ILE   6           HN       ILE   6  -1.199   3.695   1.281
   51    HA   ILE   6           HA       ILE   6  -2.296   3.891   4.069
   52    HB   ILE   6           HB       ILE   6  -2.509   5.749   1.680
   53   1HG1  ILE   6          HG12      ILE   6  -0.357   5.805   2.906
   54   2HG1  ILE   6          HG11      ILE   6  -1.259   7.306   3.117
   55   1HG2  ILE   6          HG21      ILE   6  -3.645   7.251   3.452
   56   2HG2  ILE   6          HG22      ILE   6  -3.907   5.758   4.354
   57   3HG2  ILE   6          HG23      ILE   6  -4.608   5.952   2.747
   58   1HD1  ILE   6          HD11      ILE   6  -2.147   5.664   5.203
   59   2HD1  ILE   6          HD12      ILE   6  -1.010   7.005   5.342
   60   3HD1  ILE   6          HD13      ILE   6  -0.413   5.362   5.113
   61    H    ILE   7           HN       ILE   7  -4.231   2.866   4.340
   62    HA   ILE   7           HA       ILE   7  -5.517   1.522   2.069
   63    HB   ILE   7           HB       ILE   7  -6.206   1.706   5.021
   64   1HG1  ILE   7          HG12      ILE   7  -4.788  -0.526   3.539
   65   2HG1  ILE   7          HG11      ILE   7  -3.927   0.748   4.403
   66   1HG2  ILE   7          HG21      ILE   7  -7.305  -0.567   4.403
   67   2HG2  ILE   7          HG22      ILE   7  -7.224   0.015   2.739
   68   3HG2  ILE   7          HG23      ILE   7  -8.151   0.912   3.942
   69   1HD1  ILE   7          HD11      ILE   7  -5.669   0.015   6.329
   70   2HD1  ILE   7          HD12      ILE   7  -4.087  -0.742   6.139
   71   3HD1  ILE   7          HD13      ILE   7  -5.523  -1.520   5.474
   72    H    ASN   8           HN       ASN   8  -6.994   2.595   0.832
   73    HA   ASN   8           HA       ASN   8  -8.644   4.750   2.111
   74   1HB   ASN   8          HB2       ASN   8  -7.422   4.311  -0.603
   75   2HB   ASN   8          HB1       ASN   8  -8.842   5.345  -0.452
   76   1HD2  ASN   8          HD21      ASN   8  -7.364   7.173  -1.086
   77   2HD2  ASN   8          HD22      ASN   8  -6.362   7.876   0.103
   78    H    GLY   9           HN       GLY   9  -9.626   2.261   2.574
   79   1HA   GLY   9          HA2       GLY   9 -11.439   1.447   0.403
   80   2HA   GLY   9          HA1       GLY   9 -11.297   0.667   1.983
   81    H    LYS  10           HN       LYS  10 -13.787   1.358   0.740
   82    HA   LYS  10           HA       LYS  10 -14.973   3.780   1.527
   83   1HB   LYS  10          HB2       LYS  10 -16.104   0.970   1.382
   84   2HB   LYS  10          HB1       LYS  10 -17.082   2.438   1.419
   85   1HG   LYS  10          HG2       LYS  10 -15.781   3.213  -0.628
   86   2HG   LYS  10          HG1       LYS  10 -15.124   1.579  -0.724
   87   1HD   LYS  10          HD2       LYS  10 -17.246   0.623  -1.134
   88   2HD   LYS  10          HD1       LYS  10 -18.098   2.058  -0.563
   89   1HE   LYS  10          HE2       LYS  10 -17.708   3.241  -2.536
   90   2HE   LYS  10          HE1       LYS  10 -16.258   2.296  -2.932
   91   1HZ   LYS  10          HZ1       LYS  10 -19.080   1.377  -3.005
   92   2HZ   LYS  10          HZ2       LYS  10 -17.750   0.326  -3.120
   93   3HZ   LYS  10          HZ3       LYS  10 -18.010   1.506  -4.314
   94    H    THR  11           HN       THR  11 -15.326   0.680   3.298
   95    HA   THR  11           HA       THR  11 -15.791   2.228   5.804
   96    HB   THR  11           HB       THR  11 -16.446  -0.336   6.370
   97    HG1  THR  11           HG1      THR  11 -17.294  -1.307   4.564
   98   1HG2  THR  11          HG21      THR  11 -18.660   0.361   6.219
   99   2HG2  THR  11          HG22      THR  11 -18.380   1.249   4.721
  100   3HG2  THR  11          HG23      THR  11 -17.808   1.904   6.255
  101    H    LEU  12           HN       LEU  12 -13.103   1.460   4.474
  102    HA   LEU  12           HA       LEU  12 -11.885   0.282   6.930
  103   1HB   LEU  12          HB2       LEU  12 -11.708  -0.674   4.071
  104   2HB   LEU  12          HB1       LEU  12 -10.473  -1.088   5.259
  105    HG   LEU  12           HG       LEU  12 -13.422  -1.586   5.715
  106   1HD1  LEU  12          HD11      LEU  12 -11.531  -3.805   5.075
  107   2HD1  LEU  12          HD12      LEU  12 -12.113  -2.820   3.733
  108   3HD1  LEU  12          HD13      LEU  12 -13.261  -3.678   4.759
  109   1HD2  LEU  12          HD21      LEU  12 -10.846  -2.299   7.101
  110   2HD2  LEU  12          HD22      LEU  12 -12.265  -3.329   7.292
  111   3HD2  LEU  12          HD23      LEU  12 -12.329  -1.638   7.791
  112    H    LYS  13           HN       LYS  13  -9.664   0.916   7.213
  113    HA   LYS  13           HA       LYS  13  -8.233   2.504   5.236
  114   1HB   LYS  13          HB2       LYS  13 -10.096   3.735   7.139
  115   2HB   LYS  13          HB1       LYS  13  -8.474   4.413   7.258
  116   1HG   LYS  13          HG2       LYS  13  -9.377   4.034   4.482
  117   2HG   LYS  13          HG1       LYS  13 -10.380   5.158   5.397
  118   1HD   LYS  13          HD2       LYS  13  -7.408   5.417   5.625
  119   2HD   LYS  13          HD1       LYS  13  -8.184   5.991   4.149
  120   1HE   LYS  13          HE2       LYS  13  -9.461   7.608   5.299
  121   2HE   LYS  13          HE1       LYS  13  -9.253   6.790   6.860
  122   1HZ   LYS  13          HZ1       LYS  13  -6.918   7.273   6.814
  123   2HZ   LYS  13          HZ2       LYS  13  -7.766   8.728   6.590
  124   3HZ   LYS  13          HZ3       LYS  13  -7.033   7.955   5.266
  125    H    GLY  14           HN       GLY  14  -6.339   3.726   6.579
  126   1HA   GLY  14          HA2       GLY  14  -5.197   3.385   8.889
  127   2HA   GLY  14          HA1       GLY  14  -5.258   1.678   8.454
  128    H    GLU  15           HN       GLU  15  -2.833   3.082   8.943
  129    HA   GLU  15           HA       GLU  15  -1.626   3.356   6.215
  130   1HB   GLU  15          HB2       GLU  15  -1.479   5.290   7.731
  131   2HB   GLU  15          HB1       GLU  15  -0.753   4.277   8.977
  132   1HG   GLU  15          HG2       GLU  15   0.694   4.051   6.453
  133   2HG   GLU  15          HG1       GLU  15   0.613   5.725   6.999
  134    H    THR  16           HN       THR  16   0.358   2.200   5.784
  135    HA   THR  16           HA       THR  16   1.314   0.255   7.817
  136    HB   THR  16           HB       THR  16  -0.564  -0.846   6.670
  137    HG1  THR  16           HG1      THR  16   0.540  -2.630   6.490
  138   1HG2  THR  16          HG21      THR  16  -0.311  -1.329   4.204
  139   2HG2  THR  16          HG22      THR  16   1.009  -0.158   4.171
  140   3HG2  THR  16          HG23      THR  16  -0.626   0.363   4.585
  141    H    THR  17           HN       THR  17   3.416  -0.594   7.306
  142    HA   THR  17           HA       THR  17   4.769   0.513   4.879
  143    HB   THR  17           HB       THR  17   6.620   1.273   6.315
  144    HG1  THR  17           HG1      THR  17   6.695   0.209   8.125
  145   1HG2  THR  17          HG21      THR  17   4.259   2.549   5.984
  146   2HG2  THR  17          HG22      THR  17   5.611   3.247   6.875
  147   3HG2  THR  17          HG23      THR  17   4.300   2.450   7.744
  148    H    THR  18           HN       THR  18   6.765  -0.674   4.367
  149    HA   THR  18           HA       THR  18   7.214  -3.191   5.864
  150    HB   THR  18           HB       THR  18   5.837  -2.833   3.290
  151    HG1  THR  18           HG1      THR  18   5.041  -4.100   4.937
  152   1HG2  THR  18          HG21      THR  18   8.137  -4.811   3.342
  153   2HG2  THR  18          HG22      THR  18   8.059  -3.348   2.358
  154   3HG2  THR  18          HG23      THR  18   6.915  -4.663   2.076
  155    H    GLU  19           HN       GLU  19   9.287  -4.238   5.044
  156    HA   GLU  19           HA       GLU  19  11.210  -2.196   3.970
  157   1HB   GLU  19          HB2       GLU  19  11.420  -2.613   6.409
  158   2HB   GLU  19          HB1       GLU  19  11.613  -4.337   6.090
  159   1HG   GLU  19          HG2       GLU  19  13.437  -2.545   4.584
  160   2HG   GLU  19          HG1       GLU  19  13.707  -2.621   6.326
  161    H    ALA  20           HN       ALA  20  11.970  -2.908   2.006
  162    HA   ALA  20           HA       ALA  20  12.772  -5.735   1.670
  163   1HB   ALA  20          HB1       ALA  20  10.350  -4.438   0.512
  164   2HB   ALA  20          HB2       ALA  20  10.608  -6.121   0.975
  165   3HB   ALA  20          HB3       ALA  20  11.260  -5.516  -0.548
  166    H    VAL  21           HN       VAL  21  13.462  -5.968  -0.807
  167    HA   VAL  21           HA       VAL  21  15.676  -4.264  -1.301
  168    HB   VAL  21           HB       VAL  21  15.659  -5.373  -3.524
  169   1HG1  VAL  21          HG11      VAL  21  14.731  -7.455  -1.570
  170   2HG1  VAL  21          HG12      VAL  21  16.198  -6.539  -1.226
  171   3HG1  VAL  21          HG13      VAL  21  16.088  -7.508  -2.695
  172   1HG2  VAL  21          HG21      VAL  21  12.837  -6.037  -2.676
  173   2HG2  VAL  21          HG22      VAL  21  13.705  -7.088  -3.793
  174   3HG2  VAL  21          HG23      VAL  21  13.408  -5.404  -4.219
  175    H    ASP  22           HN       ASP  22  12.353  -4.114  -2.558
  176    HA   ASP  22           HA       ASP  22  12.717  -1.258  -3.228
  177   1HB   ASP  22          HB2       ASP  22  13.547  -2.518  -5.190
  178   2HB   ASP  22          HB1       ASP  22  12.022  -3.401  -5.268
  179    H    ALA  23           HN       ALA  23  10.608  -0.240  -3.690
  180    HA   ALA  23           HA       ALA  23   8.469  -1.149  -2.033
  181   1HB   ALA  23          HB1       ALA  23   7.279   0.537  -3.816
  182   2HB   ALA  23          HB2       ALA  23   8.976   0.931  -4.090
  183   3HB   ALA  23          HB3       ALA  23   8.281   1.095  -2.477
  184    H    ALA  24           HN       ALA  24   9.261  -1.842  -5.387
  185    HA   ALA  24           HA       ALA  24   6.733  -2.777  -6.326
  186   1HB   ALA  24          HB1       ALA  24   8.273  -4.176  -7.838
  187   2HB   ALA  24          HB2       ALA  24   9.616  -3.492  -6.922
  188   3HB   ALA  24          HB3       ALA  24   8.552  -2.434  -7.848
  189    H    THR  25           HN       THR  25   9.408  -4.533  -4.734
  190    HA   THR  25           HA       THR  25   8.069  -7.089  -4.635
  191    HB   THR  25           HB       THR  25  10.362  -5.805  -3.111
  192    HG1  THR  25           HG1      THR  25  11.372  -6.385  -4.829
  193   1HG2  THR  25          HG21      THR  25   9.319  -7.599  -1.732
  194   2HG2  THR  25          HG22      THR  25  10.942  -8.033  -2.280
  195   3HG2  THR  25          HG23      THR  25   9.528  -8.723  -3.079
  196    H    ALA  26           HN       ALA  26   8.538  -4.507  -2.192
  197    HA   ALA  26           HA       ALA  26   7.109  -5.739  -0.070
  198   1HB   ALA  26          HB1       ALA  26   8.452  -3.821   0.374
  199   2HB   ALA  26          HB2       ALA  26   6.794  -3.260   0.617
  200   3HB   ALA  26          HB3       ALA  26   7.651  -2.873  -0.880
  201    H    GLU  27           HN       GLU  27   5.931  -3.213  -2.321
  202    HA   GLU  27           HA       GLU  27   3.284  -2.975  -1.625
  203   1HB   GLU  27          HB2       GLU  27   4.509  -1.804  -3.454
  204   2HB   GLU  27          HB1       GLU  27   4.364  -3.255  -4.447
  205   1HG   GLU  27          HG2       GLU  27   1.796  -3.016  -3.878
  206   2HG   GLU  27          HG1       GLU  27   2.232  -1.333  -3.580
  207    H    LYS  28           HN       LYS  28   4.663  -5.731  -3.411
  208    HA   LYS  28           HA       LYS  28   2.170  -6.982  -4.146
  209   1HB   LYS  28          HB2       LYS  28   4.901  -8.153  -3.478
  210   2HB   LYS  28          HB1       LYS  28   3.625  -8.994  -4.358
  211   1HG   LYS  28          HG2       LYS  28   3.864  -7.663  -6.253
  212   2HG   LYS  28          HG1       LYS  28   4.562  -6.321  -5.346
  213   1HD   LYS  28          HD2       LYS  28   6.510  -7.116  -6.263
  214   2HD   LYS  28          HD1       LYS  28   6.445  -8.195  -4.869
  215   1HE   LYS  28          HE2       LYS  28   5.427  -9.956  -6.192
  216   2HE   LYS  28          HE1       LYS  28   5.255  -8.867  -7.583
  217   1HZ   LYS  28          HZ1       LYS  28   7.798  -9.706  -6.295
  218   2HZ   LYS  28          HZ2       LYS  28   7.681  -8.531  -7.516
  219   3HZ   LYS  28          HZ3       LYS  28   7.260 -10.145  -7.842
  220    H    VAL  29           HN       VAL  29   4.314  -7.295  -1.322
  221    HA   VAL  29           HA       VAL  29   2.674  -9.208   0.117
  222    HB   VAL  29           HB       VAL  29   4.898  -7.248   0.764
  223   1HG1  VAL  29          HG11      VAL  29   3.579  -9.135   2.747
  224   2HG1  VAL  29          HG12      VAL  29   3.453  -7.373   2.782
  225   3HG1  VAL  29          HG13      VAL  29   5.015  -8.154   3.048
  226   1HG2  VAL  29          HG21      VAL  29   5.860  -9.636   1.439
  227   2HG2  VAL  29          HG22      VAL  29   5.848  -9.100  -0.241
  228   3HG2  VAL  29          HG23      VAL  29   4.594 -10.193   0.344
  229    H    LEU  30           HN       LEU  30   2.848  -5.655  -0.035
  230    HA   LEU  30           HA       LEU  30   1.050  -5.137   2.138
  231   1HB   LEU  30          HB2       LEU  30   1.962  -3.659  -0.336
  232   2HB   LEU  30          HB1       LEU  30   0.798  -2.933   0.759
  233    HG   LEU  30           HG       LEU  30   3.372  -2.443   1.043
  234   1HD1  LEU  30          HD11      LEU  30   3.044  -2.277   3.533
  235   2HD1  LEU  30          HD12      LEU  30   1.488  -3.089   3.310
  236   3HD1  LEU  30          HD13      LEU  30   1.779  -1.517   2.560
  237   1HD2  LEU  30          HD21      LEU  30   3.107  -5.128   2.407
  238   2HD2  LEU  30          HD22      LEU  30   4.313  -3.946   2.863
  239   3HD2  LEU  30          HD23      LEU  30   4.314  -4.603   1.238
  240    H    LYS  31           HN       LYS  31   0.609  -5.895  -1.273
  241    HA   LYS  31           HA       LYS  31  -2.198  -5.290  -1.530
  242   1HB   LYS  31          HB2       LYS  31  -0.272  -6.061  -3.222
  243   2HB   LYS  31          HB1       LYS  31  -0.871  -7.655  -2.830
  244   1HG   LYS  31          HG2       LYS  31  -2.744  -5.445  -3.679
  245   2HG   LYS  31          HG1       LYS  31  -1.936  -6.471  -4.862
  246   1HD   LYS  31          HD2       LYS  31  -3.750  -7.426  -2.622
  247   2HD   LYS  31          HD1       LYS  31  -4.158  -7.378  -4.336
  248   1HE   LYS  31          HE2       LYS  31  -1.711  -8.789  -4.189
  249   2HE   LYS  31          HE1       LYS  31  -2.726  -9.437  -2.880
  250   1HZ   LYS  31          HZ1       LYS  31  -4.582  -9.508  -4.528
  251   2HZ   LYS  31          HZ2       LYS  31  -3.316 -10.590  -4.868
  252   3HZ   LYS  31          HZ3       LYS  31  -3.460  -9.143  -5.746
  253    H    GLN  32           HN       GLN  32  -0.390  -8.196  -0.606
  254    HA   GLN  32           HA       GLN  32  -2.518 -10.015  -0.179
  255   1HB   GLN  32          HB2       GLN  32   0.269  -9.606   0.750
  256   2HB   GLN  32          HB1       GLN  32  -0.725 -10.704   1.707
  257   1HG   GLN  32          HG2       GLN  32  -1.379 -11.718  -0.619
  258   2HG   GLN  32          HG1       GLN  32   0.104 -10.937  -1.168
  259   1HE2  GLN  32          HE21      GLN  32   1.316 -12.911  -1.442
  260   2HE2  GLN  32          HE22      GLN  32   1.768 -13.889  -0.119
  261    H    TYR  33           HN       TYR  33  -1.118  -7.553   1.973
  262    HA   TYR  33           HA       TYR  33  -2.689  -8.135   4.325
  263   1HB   TYR  33          HB2       TYR  33  -0.658  -6.760   4.330
  264   2HB   TYR  33          HB1       TYR  33  -1.412  -5.591   3.247
  265    HD1  TYR  33           HD1      TYR  33  -1.617  -7.123   6.611
  266    HD2  TYR  33           HD2      TYR  33  -2.849  -3.883   4.082
  267    HE1  TYR  33           HE1      TYR  33  -2.588  -5.976   8.567
  268    HE2  TYR  33           HE2      TYR  33  -3.819  -2.723   6.045
  269    HH   TYR  33           HH       TYR  33  -4.571  -4.130   8.826
  270    H    ILE  34           HN       ILE  34  -3.168  -6.046   1.505
  271    HA   ILE  34           HA       ILE  34  -5.654  -4.837   2.346
  272    HB   ILE  34           HB       ILE  34  -4.438  -5.370  -0.383
  273   1HG1  ILE  34          HG12      ILE  34  -3.111  -4.054   1.417
  274   2HG1  ILE  34          HG11      ILE  34  -3.276  -3.328  -0.174
  275   1HG2  ILE  34          HG21      ILE  34  -6.794  -3.743   0.503
  276   2HG2  ILE  34          HG22      ILE  34  -6.611  -4.763  -0.924
  277   3HG2  ILE  34          HG23      ILE  34  -5.826  -3.185  -0.863
  278   1HD1  ILE  34          HD11      ILE  34  -4.901  -1.782   0.590
  279   2HD1  ILE  34          HD12      ILE  34  -3.699  -1.824   1.881
  280   3HD1  ILE  34          HD13      ILE  34  -5.214  -2.710   2.058
  281    H    ASN  35           HN       ASN  35  -4.800  -7.884   0.819
  282    HA   ASN  35           HA       ASN  35  -7.286  -8.627  -0.347
  283   1HB   ASN  35          HB2       ASN  35  -4.999  -9.721  -0.528
  284   2HB   ASN  35          HB1       ASN  35  -5.292 -10.426   1.062
  285   1HD2  ASN  35          HD21      ASN  35  -5.514 -12.629   0.360
  286   2HD2  ASN  35          HD22      ASN  35  -6.782 -13.147  -0.643
  287    H    ASP  36           HN       ASP  36  -6.168  -8.710   2.999
  288    HA   ASP  36           HA       ASP  36  -8.301 -10.381   4.036
  289   1HB   ASP  36          HB2       ASP  36  -5.918  -9.555   4.941
  290   2HB   ASP  36          HB1       ASP  36  -6.917  -8.311   5.694
  291    H    ASN  37           HN       ASN  37  -7.817  -6.869   3.726
  292    HA   ASN  37           HA       ASN  37 -10.350  -6.207   5.047
  293   1HB   ASN  37          HB2       ASN  37  -8.352  -4.612   3.404
  294   2HB   ASN  37          HB1       ASN  37  -9.674  -3.908   4.343
  295   1HD2  ASN  37          HD21      ASN  37  -9.101  -3.299   6.428
  296   2HD2  ASN  37          HD22      ASN  37  -7.805  -3.958   7.320
  297    H    GLY  38           HN       GLY  38  -9.200  -6.709   1.758
  298   1HA   GLY  38          HA2       GLY  38 -10.489  -7.078  -0.191
  299   2HA   GLY  38          HA1       GLY  38 -11.946  -6.778   0.757
  300    H    ILE  39           HN       ILE  39  -9.119  -4.655   0.383
  301    HA   ILE  39           HA       ILE  39 -10.920  -2.643  -0.933
  302    HB   ILE  39           HB       ILE  39  -8.681  -2.262   1.085
  303   1HG1  ILE  39          HG12      ILE  39 -10.726  -3.221   2.078
  304   2HG1  ILE  39          HG11      ILE  39 -10.503  -1.551   2.604
  305   1HG2  ILE  39          HG21      ILE  39  -8.844  -0.382  -0.497
  306   2HG2  ILE  39          HG22      ILE  39  -9.408   0.101   1.103
  307   3HG2  ILE  39          HG23      ILE  39 -10.573  -0.251  -0.174
  308   1HD1  ILE  39          HD11      ILE  39 -12.050  -0.891   0.669
  309   2HD1  ILE  39          HD12      ILE  39 -12.810  -1.731   2.020
  310   3HD1  ILE  39          HD13      ILE  39 -12.442  -2.605   0.534
  311    H    ASP  40           HN       ASP  40  -9.995  -3.633  -2.971
  312    HA   ASP  40           HA       ASP  40  -7.238  -2.586  -3.539
  313   1HB   ASP  40          HB2       ASP  40  -7.090  -4.506  -5.124
  314   2HB   ASP  40          HB1       ASP  40  -7.369  -5.041  -3.465
  315    H    GLY  41           HN       GLY  41  -7.197  -1.030  -5.112
  316   1HA   GLY  41          HA2       GLY  41  -9.088  -1.126  -7.363
  317   2HA   GLY  41          HA1       GLY  41  -9.267   0.274  -6.300
  318    H    GLU  42           HN       GLU  42  -7.539   1.816  -6.199
  319    HA   GLU  42           HA       GLU  42  -5.513   1.553  -8.398
  320   1HB   GLU  42          HB2       GLU  42  -7.430   3.708  -7.592
  321   2HB   GLU  42          HB1       GLU  42  -5.879   4.193  -8.279
  322   1HG   GLU  42          HG2       GLU  42  -7.019   3.950 -10.251
  323   2HG   GLU  42          HG1       GLU  42  -6.551   2.262 -10.041
  324    H    TRP  43           HN       TRP  43  -3.490   1.495  -7.538
  325    HA   TRP  43           HA       TRP  43  -2.995   2.725  -4.866
  326   1HB   TRP  43          HB2       TRP  43  -1.532   0.737  -6.623
  327   2HB   TRP  43          HB1       TRP  43  -0.828   1.398  -5.160
  328    HD1  TRP  43           HD1      TRP  43  -4.551   0.433  -5.377
  329    HE1  TRP  43           HE1      TRP  43  -4.948  -1.546  -3.789
  330    HE3  TRP  43           HE3      TRP  43   0.235  -0.491  -3.958
  331    HZ2  TRP  43           HZ2      TRP  43  -3.429  -3.271  -2.090
  332    HZ3  TRP  43           HZ3      TRP  43   0.748  -2.298  -2.332
  333    HH2  TRP  43           HH2      TRP  43  -1.078  -3.683  -1.398
  334    H    THR  44           HN       THR  44  -2.873   4.986  -5.722
  335    HA   THR  44           HA       THR  44  -1.081   5.761  -7.826
  336    HB   THR  44           HB       THR  44  -1.300   8.002  -6.769
  337    HG1  THR  44           HG1      THR  44  -2.882   6.744  -4.798
  338   1HG2  THR  44          HG21      THR  44  -3.987   7.728  -6.562
  339   2HG2  THR  44          HG22      THR  44  -3.589   6.215  -7.378
  340   3HG2  THR  44          HG23      THR  44  -3.137   7.756  -8.107
  341    H    TYR  45           HN       TYR  45   1.113   5.860  -7.814
  342    HA   TYR  45           HA       TYR  45   2.564   5.284  -5.279
  343   1HB   TYR  45          HB2       TYR  45   2.932   3.933  -7.325
  344   2HB   TYR  45          HB1       TYR  45   3.429   5.384  -8.193
  345    HD1  TYR  45           HD1      TYR  45   5.726   5.443  -8.527
  346    HD2  TYR  45           HD2      TYR  45   4.195   3.971  -4.795
  347    HE1  TYR  45           HE1      TYR  45   8.042   5.154  -7.691
  348    HE2  TYR  45           HE2      TYR  45   6.511   3.681  -3.959
  349    HH   TYR  45           HH       TYR  45   9.204   3.725  -5.954
  350    H    ASP  46           HN       ASP  46   4.540   6.591  -4.808
  351    HA   ASP  46           HA       ASP  46   4.817   9.206  -6.144
  352   1HB   ASP  46          HB2       ASP  46   4.398  10.430  -4.011
  353   2HB   ASP  46          HB1       ASP  46   2.971   9.560  -4.571
  354    H    ASP  47           HN       ASP  47   6.988   9.464  -6.314
  355    HA   ASP  47           HA       ASP  47   8.854   7.980  -4.607
  356   1HB   ASP  47          HB2       ASP  47   9.085   8.383  -7.078
  357   2HB   ASP  47          HB1       ASP  47   9.338  10.094  -6.729
  358    H    ALA  48           HN       ALA  48   7.432  11.156  -4.588
  359    HA   ALA  48           HA       ALA  48   9.432  12.748  -3.380
  360   1HB   ALA  48          HB1       ALA  48   6.476  12.653  -3.557
  361   2HB   ALA  48          HB2       ALA  48   7.577  13.990  -3.888
  362   3HB   ALA  48          HB3       ALA  48   7.115  13.619  -2.227
  363    H    THR  49           HN       THR  49   7.475  10.178  -1.997
  364    HA   THR  49           HA       THR  49   9.057  10.327   0.503
  365    HB   THR  49           HB       THR  49   7.154  11.846   0.846
  366    HG1  THR  49           HG1      THR  49   7.138  11.047   2.766
  367   1HG2  THR  49          HG21      THR  49   5.541  11.055  -0.725
  368   2HG2  THR  49          HG22      THR  49   4.833  10.778   0.867
  369   3HG2  THR  49          HG23      THR  49   5.552   9.437  -0.025
  370    H    LYS  50           HN       LYS  50   8.648   8.427  -1.786
  371    HA   LYS  50           HA       LYS  50   8.136   6.159  -2.227
  372   1HB   LYS  50          HB2       LYS  50   9.355   4.748  -0.640
  373   2HB   LYS  50          HB1       LYS  50  10.248   6.234  -0.948
  374   1HG   LYS  50          HG2       LYS  50   9.645   7.160   1.154
  375   2HG   LYS  50          HG1       LYS  50   8.370   5.966   1.403
  376   1HD   LYS  50          HD2       LYS  50  10.273   5.353   2.781
  377   2HD   LYS  50          HD1       LYS  50  10.134   4.183   1.468
  378   1HE   LYS  50          HE2       LYS  50  11.799   5.713   0.190
  379   2HE   LYS  50          HE1       LYS  50  12.145   6.414   1.784
  380   1HZ   LYS  50          HZ1       LYS  50  12.140   3.498   1.225
  381   2HZ   LYS  50          HZ2       LYS  50  12.643   4.268   2.653
  382   3HZ   LYS  50          HZ3       LYS  50  13.544   4.448   1.224
  383    H    THR  51           HN       THR  51   5.846   7.572  -0.976
  384    HA   THR  51           HA       THR  51   4.654   5.539   0.827
  385    HB   THR  51           HB       THR  51   3.668   8.203  -0.256
  386    HG1  THR  51           HG1      THR  51   4.836   7.443   2.212
  387   1HG2  THR  51          HG21      THR  51   2.111   8.016   1.751
  388   2HG2  THR  51          HG22      THR  51   2.584   6.319   1.847
  389   3HG2  THR  51          HG23      THR  51   1.759   6.925   0.411
  390    H    TRP  52           HN       TRP  52   2.343   4.863   0.273
  391    HA   TRP  52           HA       TRP  52   1.942   4.558  -2.685
  392   1HB   TRP  52          HB2       TRP  52   2.013   2.555  -0.442
  393   2HB   TRP  52          HB1       TRP  52   1.053   2.237  -1.880
  394    HD1  TRP  52           HD1      TRP  52   4.607   2.376  -0.637
  395    HE1  TRP  52           HE1      TRP  52   6.191   1.603  -2.524
  396    HE3  TRP  52           HE3      TRP  52   1.310   2.195  -4.487
  397    HZ2  TRP  52           HZ2      TRP  52   6.055   0.982  -5.326
  398    HZ3  TRP  52           HZ3      TRP  52   2.039   1.510  -6.764
  399    HH2  TRP  52           HH2      TRP  52   4.408   0.902  -7.184
  400    H    THR  53           HN       THR  53  -0.409   3.274  -2.759
  401    HA   THR  53           HA       THR  53  -2.327   4.401  -0.828
  402    HB   THR  53           HB       THR  53  -2.650   5.078  -3.749
  403    HG1  THR  53           HG1      THR  53  -1.002   6.343  -3.540
  404   1HG2  THR  53          HG21      THR  53  -3.784   7.093  -2.467
  405   2HG2  THR  53          HG22      THR  53  -3.824   5.939  -1.134
  406   3HG2  THR  53          HG23      THR  53  -4.635   5.559  -2.653
  407    H    VAL  54           HN       VAL  54  -4.649   3.782  -1.637
  408    HA   VAL  54           HA       VAL  54  -5.021   1.622  -3.507
  409    HB   VAL  54           HB       VAL  54  -3.700   0.307  -1.977
  410   1HG1  VAL  54          HG11      VAL  54  -4.725   0.203   0.490
  411   2HG1  VAL  54          HG12      VAL  54  -5.207   1.846   0.070
  412   3HG1  VAL  54          HG13      VAL  54  -3.506   1.389   0.027
  413   1HG2  VAL  54          HG21      VAL  54  -6.173  -0.489  -2.644
  414   2HG2  VAL  54          HG22      VAL  54  -6.381  -0.438  -0.893
  415   3HG2  VAL  54          HG23      VAL  54  -5.131  -1.463  -1.601
  416    H    THR  55           HN       THR  55  -6.816   3.071  -3.932
  417    HA   THR  55           HA       THR  55  -8.888   3.370  -1.825
  418    HB   THR  55           HB       THR  55  -8.868   4.391  -4.676
  419    HG1  THR  55           HG1      THR  55  -7.728   5.540  -2.347
  420   1HG2  THR  55          HG21      THR  55 -10.040   5.608  -2.167
  421   2HG2  THR  55          HG22      THR  55 -10.952   4.532  -3.226
  422   3HG2  THR  55          HG23      THR  55 -10.354   6.074  -3.839
  423    H    GLU  56           HN       GLU  56 -10.991   2.488  -2.060
  424    HA   GLU  56           HA       GLU  56 -11.204   0.102  -3.771
  425   1HB   GLU  56          HB2       GLU  56 -11.996   0.589  -1.300
  426   2HB   GLU  56          HB1       GLU  56 -13.417   1.263  -2.099
  427   1HG   GLU  56          HG2       GLU  56 -12.377  -1.469  -2.837
  428   2HG   GLU  56          HG1       GLU  56 -13.464  -1.252  -1.464
  Start of MODEL   20
    1   1H    THR   1          HT1       THR   1  15.431   2.905   2.911
    2   2H    THR   1          HT2       THR   1  14.937   3.720   4.317
    3   3H    THR   1          HT3       THR   1  15.864   4.528   3.146
    4    HA   THR   1           HA       THR   1  13.605   5.254   2.904
    5    HB   THR   1           HB       THR   1  13.296   4.225   0.541
    6    HG1  THR   1           HG1      THR   1  14.344   2.290   0.895
    7   1HG2  THR   1          HG21      THR   1  15.763   5.177  -0.009
    8   2HG2  THR   1          HG22      THR   1  15.565   5.801   1.628
    9   3HG2  THR   1          HG23      THR   1  14.397   6.223   0.376
   10    H    THR   2           HN       THR   2  12.015   4.469   4.345
   11    HA   THR   2           HA       THR   2  11.016   1.692   4.051
   12    HB   THR   2           HB       THR   2  10.084   3.923   5.879
   13    HG1  THR   2           HG1      THR   2  11.703   3.414   7.206
   14   1HG2  THR   2          HG21      THR   2  10.168   1.017   6.582
   15   2HG2  THR   2          HG22      THR   2   8.891   1.582   5.504
   16   3HG2  THR   2          HG23      THR   2   9.048   2.269   7.121
   17    H    PHE   3           HN       PHE   3   9.381   1.292   2.631
   18    HA   PHE   3           HA       PHE   3   7.889   3.396   1.300
   19   1HB   PHE   3          HB2       PHE   3   7.437   0.393   1.471
   20   2HB   PHE   3          HB1       PHE   3   6.754   1.466   0.251
   21    HD1  PHE   3           HD1      PHE   3   8.863   3.196  -0.594
   22    HD2  PHE   3           HD2      PHE   3   9.115  -0.944   0.541
   23    HE1  PHE   3           HE1      PHE   3  10.921   2.945  -1.955
   24    HE2  PHE   3           HE2      PHE   3  11.171  -1.190  -0.821
   25    HZ   PHE   3           HZ       PHE   3  12.074   0.754  -2.068
   26    H    LYS   4           HN       LYS   4   5.525   3.684   1.457
   27    HA   LYS   4           HA       LYS   4   4.281   2.686   3.989
   28   1HB   LYS   4          HB2       LYS   4   5.391   4.948   4.247
   29   2HB   LYS   4          HB1       LYS   4   4.265   5.565   3.051
   30   1HG   LYS   4          HG2       LYS   4   2.366   4.845   4.473
   31   2HG   LYS   4          HG1       LYS   4   3.512   4.297   5.695
   32   1HD   LYS   4          HD2       LYS   4   3.872   6.397   6.455
   33   2HD   LYS   4          HD1       LYS   4   4.039   7.046   4.825
   34   1HE   LYS   4          HE2       LYS   4   1.748   7.497   4.627
   35   2HE   LYS   4          HE1       LYS   4   1.305   6.282   5.841
   36   1HZ   LYS   4          HZ1       LYS   4   1.164   8.379   6.907
   37   2HZ   LYS   4          HZ2       LYS   4   2.668   8.879   6.294
   38   3HZ   LYS   4          HZ3       LYS   4   2.591   7.657   7.473
   39    H    LEU   5           HN       LEU   5   1.990   2.587   3.897
   40    HA   LEU   5           HA       LEU   5   0.626   3.467   1.404
   41   1HB   LEU   5          HB2       LEU   5   1.598   0.970   1.507
   42   2HB   LEU   5          HB1       LEU   5   0.117   0.692   2.415
   43    HG   LEU   5           HG       LEU   5  -0.419   2.298   0.044
   44   1HD1  LEU   5          HD11      LEU   5   0.235   0.879  -1.698
   45   2HD1  LEU   5          HD12      LEU   5   0.453  -0.506  -0.616
   46   3HD1  LEU   5          HD13      LEU   5   1.635   0.808  -0.620
   47   1HD2  LEU   5          HD21      LEU   5  -2.249   1.221   1.055
   48   2HD2  LEU   5          HD22      LEU   5  -1.371  -0.296   1.248
   49   3HD2  LEU   5          HD23      LEU   5  -1.925   0.205  -0.349
   50    H    ILE   6           HN       ILE   6  -1.511   4.056   1.818
   51    HA   ILE   6           HA       ILE   6  -2.452   3.753   4.646
   52    HB   ILE   6           HB       ILE   6  -2.959   5.795   2.465
   53   1HG1  ILE   6          HG12      ILE   6  -0.766   5.908   3.619
   54   2HG1  ILE   6          HG11      ILE   6  -1.768   7.312   3.982
   55   1HG2  ILE   6          HG21      ILE   6  -4.337   7.020   4.056
   56   2HG2  ILE   6          HG22      ILE   6  -4.056   5.794   5.292
   57   3HG2  ILE   6          HG23      ILE   6  -5.001   5.398   3.856
   58   1HD1  ILE   6          HD11      ILE   6  -2.511   6.100   6.087
   59   2HD1  ILE   6          HD12      ILE   6  -0.815   6.578   6.064
   60   3HD1  ILE   6          HD13      ILE   6  -1.263   4.903   5.745
   61    H    ILE   7           HN       ILE   7  -4.130   2.366   4.913
   62    HA   ILE   7           HA       ILE   7  -5.552   1.196   2.653
   63    HB   ILE   7           HB       ILE   7  -5.982   1.045   5.658
   64   1HG1  ILE   7          HG12      ILE   7  -4.567  -0.945   3.869
   65   2HG1  ILE   7          HG11      ILE   7  -3.704   0.348   4.703
   66   1HG2  ILE   7          HG21      ILE   7  -7.930   0.102   4.841
   67   2HG2  ILE   7          HG22      ILE   7  -6.872  -1.307   4.765
   68   3HG2  ILE   7          HG23      ILE   7  -7.188  -0.361   3.310
   69   1HD1  ILE   7          HD11      ILE   7  -3.541  -1.364   6.269
   70   2HD1  ILE   7          HD12      ILE   7  -5.118  -2.033   5.853
   71   3HD1  ILE   7          HD13      ILE   7  -5.012  -0.557   6.811
   72    H    ASN   8           HN       ASN   8  -7.067   2.451   1.613
   73    HA   ASN   8           HA       ASN   8  -8.806   4.264   3.233
   74   1HB   ASN   8          HB2       ASN   8  -7.885   4.093   0.370
   75   2HB   ASN   8          HB1       ASN   8  -9.333   5.017   0.768
   76   1HD2  ASN   8          HD21      ASN   8  -8.070   6.988   0.117
   77   2HD2  ASN   8          HD22      ASN   8  -6.963   7.669   1.223
   78    H    GLY   9           HN       GLY   9  -9.515   1.663   3.604
   79   1HA   GLY   9          HA2       GLY   9 -11.482   0.803   1.602
   80   2HA   GLY   9          HA1       GLY   9 -11.133  -0.010   3.133
   81    H    LYS  10           HN       LYS  10 -13.759   0.731   1.973
   82    HA   LYS  10           HA       LYS  10 -14.975   2.979   3.135
   83   1HB   LYS  10          HB2       LYS  10 -16.053   0.189   2.635
   84   2HB   LYS  10          HB1       LYS  10 -17.054   1.620   2.886
   85   1HG   LYS  10          HG2       LYS  10 -15.623   2.635   0.938
   86   2HG   LYS  10          HG1       LYS  10 -15.266   0.948   0.564
   87   1HD   LYS  10          HD2       LYS  10 -17.721   0.483   0.520
   88   2HD   LYS  10          HD1       LYS  10 -18.018   2.206   0.758
   89   1HE   LYS  10          HE2       LYS  10 -16.291   2.304  -1.350
   90   2HE   LYS  10          HE1       LYS  10 -17.130   0.775  -1.681
   91   1HZ   LYS  10          HZ1       LYS  10 -19.233   1.850  -1.449
   92   2HZ   LYS  10          HZ2       LYS  10 -18.314   2.764  -2.546
   93   3HZ   LYS  10          HZ3       LYS  10 -18.511   3.299  -0.946
   94    H    THR  11           HN       THR  11 -14.154  -0.126   4.596
   95    HA   THR  11           HA       THR  11 -15.193   0.886   7.226
   96    HB   THR  11           HB       THR  11 -14.964  -1.987   6.284
   97    HG1  THR  11           HG1      THR  11 -16.565  -1.379   5.055
   98   1HG2  THR  11          HG21      THR  11 -16.823  -0.956   8.398
   99   2HG2  THR  11          HG22      THR  11 -15.125  -1.214   8.799
  100   3HG2  THR  11          HG23      THR  11 -16.110  -2.560   8.224
  101    H    LEU  12           HN       LEU  12 -12.718  -1.090   5.590
  102    HA   LEU  12           HA       LEU  12 -11.083  -1.264   8.047
  103   1HB   LEU  12          HB2       LEU  12 -10.721  -2.215   5.187
  104   2HB   LEU  12          HB1       LEU  12  -9.635  -2.618   6.517
  105    HG   LEU  12           HG       LEU  12 -12.539  -3.122   6.951
  106   1HD1  LEU  12          HD11      LEU  12 -11.717  -3.921   4.559
  107   2HD1  LEU  12          HD12      LEU  12 -12.707  -4.977   5.566
  108   3HD1  LEU  12          HD13      LEU  12 -10.960  -5.211   5.494
  109   1HD2  LEU  12          HD21      LEU  12 -11.228  -3.781   8.765
  110   2HD2  LEU  12          HD22      LEU  12  -9.884  -4.285   7.740
  111   3HD2  LEU  12          HD23      LEU  12 -11.330  -5.288   7.855
  112    H    LYS  13           HN       LYS  13  -9.195  -0.089   8.384
  113    HA   LYS  13           HA       LYS  13  -8.032   1.554   6.216
  114   1HB   LYS  13          HB2       LYS  13  -9.546   2.592   8.612
  115   2HB   LYS  13          HB1       LYS  13  -8.302   3.575   7.839
  116   1HG   LYS  13          HG2       LYS  13  -9.523   3.126   5.634
  117   2HG   LYS  13          HG1       LYS  13 -10.853   2.512   6.617
  118   1HD   LYS  13          HD2       LYS  13 -11.108   4.633   7.735
  119   2HD   LYS  13          HD1       LYS  13  -9.633   5.258   6.995
  120   1HE   LYS  13          HE2       LYS  13 -10.659   5.658   4.971
  121   2HE   LYS  13          HE1       LYS  13 -11.750   4.268   5.136
  122   1HZ   LYS  13          HZ1       LYS  13 -11.903   6.691   6.844
  123   2HZ   LYS  13          HZ2       LYS  13 -13.017   5.410   6.772
  124   3HZ   LYS  13          HZ3       LYS  13 -12.851   6.469   5.455
  125    H    GLY  14           HN       GLY  14  -6.236   3.035   7.457
  126   1HA   GLY  14          HA2       GLY  14  -4.832   2.883   9.603
  127   2HA   GLY  14          HA1       GLY  14  -4.773   1.154   9.260
  128    H    GLU  15           HN       GLU  15  -2.436   2.714   9.455
  129    HA   GLU  15           HA       GLU  15  -1.528   3.128   6.643
  130   1HB   GLU  15          HB2       GLU  15  -1.201   4.920   8.305
  131   2HB   GLU  15          HB1       GLU  15  -0.328   3.803   9.353
  132   1HG   GLU  15          HG2       GLU  15   1.410   3.523   7.640
  133   2HG   GLU  15          HG1       GLU  15   0.530   4.597   6.554
  134    H    THR  16           HN       THR  16   0.622   2.209   6.060
  135    HA   THR  16           HA       THR  16   1.703   0.028   7.718
  136    HB   THR  16           HB       THR  16  -0.260  -1.004   6.664
  137    HG1  THR  16           HG1      THR  16   0.811  -2.730   5.934
  138   1HG2  THR  16          HG21      THR  16  -0.255  -1.225   4.139
  139   2HG2  THR  16          HG22      THR  16   1.005   0.009   4.103
  140   3HG2  THR  16          HG23      THR  16  -0.593   0.396   4.741
  141    H    THR  17           HN       THR  17   3.824  -0.473   7.116
  142    HA   THR  17           HA       THR  17   4.882   0.766   4.600
  143    HB   THR  17           HB       THR  17   6.889   1.386   6.007
  144    HG1  THR  17           HG1      THR  17   6.605   1.318   8.237
  145   1HG2  THR  17          HG21      THR  17   5.594   3.219   7.296
  146   2HG2  THR  17          HG22      THR  17   4.152   2.522   6.559
  147   3HG2  THR  17          HG23      THR  17   5.432   3.181   5.541
  148    H    THR  18           HN       THR  18   6.863  -0.301   3.827
  149    HA   THR  18           HA       THR  18   7.475  -2.921   5.090
  150    HB   THR  18           HB       THR  18   5.997  -2.361   2.614
  151    HG1  THR  18           HG1      THR  18   6.682  -4.690   4.082
  152   1HG2  THR  18          HG21      THR  18   8.361  -4.249   2.363
  153   2HG2  THR  18          HG22      THR  18   8.215  -2.684   1.562
  154   3HG2  THR  18          HG23      THR  18   7.094  -3.987   1.163
  155    H    GLU  19           HN       GLU  19   9.586  -3.762   4.350
  156    HA   GLU  19           HA       GLU  19  11.417  -1.595   3.366
  157   1HB   GLU  19          HB2       GLU  19  11.615  -2.387   5.766
  158   2HB   GLU  19          HB1       GLU  19  12.042  -3.980   5.137
  159   1HG   GLU  19          HG2       GLU  19  13.769  -2.474   3.712
  160   2HG   GLU  19          HG1       GLU  19  13.626  -1.462   5.150
  161    H    ALA  20           HN       ALA  20  12.030  -2.056   1.284
  162    HA   ALA  20           HA       ALA  20  12.880  -4.824   0.610
  163   1HB   ALA  20          HB1       ALA  20  10.481  -3.351  -0.360
  164   2HB   ALA  20          HB2       ALA  20  10.722  -5.086  -0.150
  165   3HB   ALA  20          HB3       ALA  20  11.383  -4.269  -1.567
  166    H    VAL  21           HN       VAL  21  13.564  -4.724  -1.887
  167    HA   VAL  21           HA       VAL  21  15.788  -2.943  -2.125
  168    HB   VAL  21           HB       VAL  21  15.498  -5.132  -3.273
  169   1HG1  VAL  21          HG11      VAL  21  13.619  -3.746  -5.174
  170   2HG1  VAL  21          HG12      VAL  21  13.036  -4.699  -3.809
  171   3HG1  VAL  21          HG13      VAL  21  13.995  -5.466  -5.075
  172   1HG2  VAL  21          HG21      VAL  21  17.176  -3.827  -4.274
  173   2HG2  VAL  21          HG22      VAL  21  16.013  -2.656  -4.896
  174   3HG2  VAL  21          HG23      VAL  21  16.136  -4.253  -5.633
  175    H    ASP  22           HN       ASP  22  12.509  -2.820  -3.410
  176    HA   ASP  22           HA       ASP  22  12.757   0.084  -3.934
  177   1HB   ASP  22          HB2       ASP  22  12.187  -2.091  -5.968
  178   2HB   ASP  22          HB1       ASP  22  11.981  -0.364  -6.300
  179    H    ALA  23           HN       ALA  23  10.592   1.028  -4.377
  180    HA   ALA  23           HA       ALA  23   8.523   0.000  -2.689
  181   1HB   ALA  23          HB1       ALA  23   8.289   2.260  -3.069
  182   2HB   ALA  23          HB2       ALA  23   7.224   1.697  -4.357
  183   3HB   ALA  23          HB3       ALA  23   8.891   2.145  -4.722
  184    H    ALA  24           HN       ALA  24   9.175  -0.403  -6.144
  185    HA   ALA  24           HA       ALA  24   6.704  -1.468  -7.032
  186   1HB   ALA  24          HB1       ALA  24   9.605  -1.869  -7.746
  187   2HB   ALA  24          HB2       ALA  24   8.354  -1.018  -8.652
  188   3HB   ALA  24          HB3       ALA  24   8.354  -2.781  -8.591
  189    H    THR  25           HN       THR  25   9.511  -3.191  -5.636
  190    HA   THR  25           HA       THR  25   8.310  -5.806  -5.656
  191    HB   THR  25           HB       THR  25  10.550  -4.493  -4.084
  192    HG1  THR  25           HG1      THR  25  11.241  -4.746  -6.079
  193   1HG2  THR  25          HG21      THR  25   9.872  -7.448  -4.214
  194   2HG2  THR  25          HG22      THR  25   9.631  -6.419  -2.799
  195   3HG2  THR  25          HG23      THR  25  11.263  -6.734  -3.397
  196    H    ALA  26           HN       ALA  26   8.645  -3.351  -3.052
  197    HA   ALA  26           HA       ALA  26   7.327  -4.814  -1.005
  198   1HB   ALA  26          HB1       ALA  26   7.620  -1.860  -1.614
  199   2HB   ALA  26          HB2       ALA  26   8.562  -2.829  -0.480
  200   3HB   ALA  26          HB3       ALA  26   6.876  -2.441  -0.119
  201    H    GLU  27           HN       GLU  27   5.932  -2.174  -2.980
  202    HA   GLU  27           HA       GLU  27   3.292  -2.184  -2.273
  203   1HB   GLU  27          HB2       GLU  27   4.740  -1.056  -4.207
  204   2HB   GLU  27          HB1       GLU  27   3.917  -2.256  -5.201
  205   1HG   GLU  27          HG2       GLU  27   2.220  -0.737  -3.293
  206   2HG   GLU  27          HG1       GLU  27   2.862   0.170  -4.661
  207    H    LYS  28           HN       LYS  28   4.801  -4.701  -4.301
  208    HA   LYS  28           HA       LYS  28   2.363  -6.033  -5.087
  209   1HB   LYS  28          HB2       LYS  28   5.172  -7.102  -4.587
  210   2HB   LYS  28          HB1       LYS  28   3.923  -7.920  -5.525
  211   1HG   LYS  28          HG2       LYS  28   4.061  -6.406  -7.288
  212   2HG   LYS  28          HG1       LYS  28   4.708  -5.120  -6.267
  213   1HD   LYS  28          HD2       LYS  28   6.668  -5.736  -7.307
  214   2HD   LYS  28          HD1       LYS  28   6.697  -6.903  -5.985
  215   1HE   LYS  28          HE2       LYS  28   6.996  -8.344  -7.791
  216   2HE   LYS  28          HE1       LYS  28   5.223  -8.327  -7.721
  217   1HZ   LYS  28          HZ1       LYS  28   5.175  -6.521  -9.288
  218   2HZ   LYS  28          HZ2       LYS  28   6.081  -7.794  -9.955
  219   3HZ   LYS  28          HZ3       LYS  28   6.869  -6.432  -9.313
  220    H    VAL  29           HN       VAL  29   4.639  -6.520  -2.389
  221    HA   VAL  29           HA       VAL  29   3.173  -8.633  -1.074
  222    HB   VAL  29           HB       VAL  29   5.268  -6.578  -0.307
  223   1HG1  VAL  29          HG11      VAL  29   5.531  -7.683   1.875
  224   2HG1  VAL  29          HG12      VAL  29   4.159  -8.735   1.522
  225   3HG1  VAL  29          HG13      VAL  29   3.909  -6.998   1.728
  226   1HG2  VAL  29          HG21      VAL  29   6.734  -8.496  -0.253
  227   2HG2  VAL  29          HG22      VAL  29   5.809  -8.571  -1.752
  228   3HG2  VAL  29          HG23      VAL  29   5.370  -9.604  -0.393
  229    H    LEU  30           HN       LEU  30   3.076  -5.078  -0.910
  230    HA   LEU  30           HA       LEU  30   1.337  -4.900   1.362
  231   1HB   LEU  30          HB2       LEU  30   2.050  -3.134  -0.990
  232   2HB   LEU  30          HB1       LEU  30   0.877  -2.598   0.203
  233    HG   LEU  30           HG       LEU  30   3.409  -1.941   0.469
  234   1HD1  LEU  30          HD11      LEU  30   1.682  -2.985   2.713
  235   2HD1  LEU  30          HD12      LEU  30   1.814  -1.323   2.135
  236   3HD1  LEU  30          HD13      LEU  30   3.177  -2.078   2.972
  237   1HD2  LEU  30          HD21      LEU  30   4.501  -4.043   0.373
  238   2HD2  LEU  30          HD22      LEU  30   3.411  -4.763   1.556
  239   3HD2  LEU  30          HD23      LEU  30   4.561  -3.540   2.049
  240    H    LYS  31           HN       LYS  31   0.807  -5.346  -2.092
  241    HA   LYS  31           HA       LYS  31  -2.051  -4.955  -2.179
  242   1HB   LYS  31          HB2       LYS  31  -0.135  -5.392  -4.012
  243   2HB   LYS  31          HB1       LYS  31  -0.616  -7.056  -3.779
  244   1HG   LYS  31          HG2       LYS  31  -2.652  -4.892  -4.319
  245   2HG   LYS  31          HG1       LYS  31  -1.840  -5.747  -5.630
  246   1HD   LYS  31          HD2       LYS  31  -3.493  -7.026  -3.428
  247   2HD   LYS  31          HD1       LYS  31  -3.984  -6.833  -5.110
  248   1HE   LYS  31          HE2       LYS  31  -1.457  -8.098  -5.210
  249   2HE   LYS  31          HE1       LYS  31  -2.367  -8.933  -3.930
  250   1HZ   LYS  31          HZ1       LYS  31  -4.287  -8.996  -5.477
  251   2HZ   LYS  31          HZ2       LYS  31  -2.962  -9.905  -6.027
  252   3HZ   LYS  31          HZ3       LYS  31  -3.291  -8.382  -6.705
  253    H    GLN  32           HN       GLN  32   0.023  -7.784  -1.644
  254    HA   GLN  32           HA       GLN  32  -1.937  -9.806  -1.335
  255   1HB   GLN  32          HB2       GLN  32   0.843  -9.265  -0.411
  256   2HB   GLN  32          HB1       GLN  32  -0.031 -10.586   0.366
  257   1HG   GLN  32          HG2       GLN  32  -0.641 -11.222  -2.130
  258   2HG   GLN  32          HG1       GLN  32   0.824 -10.306  -2.487
  259   1HE2  GLN  32          HE21      GLN  32   2.118 -12.168  -3.045
  260   2HE2  GLN  32          HE22      GLN  32   2.574 -13.335  -1.886
  261    H    TYR  33           HN       TYR  33  -0.627  -7.481   1.017
  262    HA   TYR  33           HA       TYR  33  -2.039  -8.431   3.348
  263   1HB   TYR  33          HB2       TYR  33  -0.116  -6.907   3.419
  264   2HB   TYR  33          HB1       TYR  33  -1.013  -5.691   2.509
  265    HD1  TYR  33           HD1      TYR  33  -0.927  -7.597   5.683
  266    HD2  TYR  33           HD2      TYR  33  -2.526  -4.208   3.594
  267    HE1  TYR  33           HE1      TYR  33  -1.882  -6.754   7.797
  268    HE2  TYR  33           HE2      TYR  33  -3.479  -3.353   5.715
  269    HH   TYR  33           HH       TYR  33  -3.642  -5.266   8.562
  270    H    ILE  34           HN       ILE  34  -2.806  -6.097   0.794
  271    HA   ILE  34           HA       ILE  34  -5.335  -5.189   1.857
  272    HB   ILE  34           HB       ILE  34  -4.196  -5.327  -0.952
  273   1HG1  ILE  34          HG12      ILE  34  -2.916  -4.097   0.936
  274   2HG1  ILE  34          HG11      ILE  34  -3.207  -3.220  -0.560
  275   1HG2  ILE  34          HG21      ILE  34  -5.767  -3.392  -1.376
  276   2HG2  ILE  34          HG22      ILE  34  -6.534  -3.767   0.167
  277   3HG2  ILE  34          HG23      ILE  34  -6.559  -4.950  -1.140
  278   1HD1  ILE  34          HD11      ILE  34  -5.208  -3.009   1.668
  279   2HD1  ILE  34          HD12      ILE  34  -4.796  -1.830   0.422
  280   3HD1  ILE  34          HD13      ILE  34  -3.703  -2.094   1.782
  281    H    ASN  35           HN       ASN  35  -4.323  -7.944  -0.085
  282    HA   ASN  35           HA       ASN  35  -6.810  -8.768  -1.191
  283   1HB   ASN  35          HB2       ASN  35  -4.462  -9.615  -1.649
  284   2HB   ASN  35          HB1       ASN  35  -4.571 -10.526  -0.143
  285   1HD2  ASN  35          HD21      ASN  35  -5.862 -12.445  -0.126
  286   2HD2  ASN  35          HD22      ASN  35  -6.641 -13.046  -1.510
  287    H    ASP  36           HN       ASP  36  -5.497  -9.101   2.059
  288    HA   ASP  36           HA       ASP  36  -7.473 -11.068   2.951
  289   1HB   ASP  36          HB2       ASP  36  -5.009 -10.265   3.765
  290   2HB   ASP  36          HB1       ASP  36  -6.016  -9.336   4.878
  291    H    ASN  37           HN       ASN  37  -6.915  -7.593   3.635
  292    HA   ASN  37           HA       ASN  37  -9.279  -7.167   5.185
  293   1HB   ASN  37          HB2       ASN  37  -7.681  -5.301   3.396
  294   2HB   ASN  37          HB1       ASN  37  -8.813  -4.780   4.649
  295   1HD2  ASN  37          HD21      ASN  37  -7.799  -4.290   6.589
  296   2HD2  ASN  37          HD22      ASN  37  -6.356  -5.006   7.152
  297    H    GLY  38           HN       GLY  38  -8.694  -7.081   1.693
  298   1HA   GLY  38          HA2       GLY  38 -10.336  -7.416  -0.006
  299   2HA   GLY  38          HA1       GLY  38 -11.599  -7.218   1.210
  300    H    ILE  39           HN       ILE  39  -8.917  -4.972   0.724
  301    HA   ILE  39           HA       ILE  39 -10.909  -2.914  -0.179
  302    HB   ILE  39           HB       ILE  39  -8.387  -2.642   1.494
  303   1HG1  ILE  39          HG12      ILE  39 -10.216  -3.761   2.712
  304   2HG1  ILE  39          HG11      ILE  39  -9.956  -2.133   3.343
  305   1HG2  ILE  39          HG21      ILE  39 -10.474  -0.623   0.625
  306   2HG2  ILE  39          HG22      ILE  39  -8.756  -0.615   0.228
  307   3HG2  ILE  39          HG23      ILE  39  -9.279  -0.318   1.886
  308   1HD1  ILE  39          HD11      ILE  39 -11.812  -1.695   1.347
  309   2HD1  ILE  39          HD12      ILE  39 -12.193  -1.869   3.060
  310   3HD1  ILE  39          HD13      ILE  39 -12.310  -3.262   1.985
  311    H    ASP  40           HN       ASP  40 -10.245  -3.796  -2.399
  312    HA   ASP  40           HA       ASP  40  -7.654  -2.568  -3.290
  313   1HB   ASP  40          HB2       ASP  40  -7.666  -4.377  -5.008
  314   2HB   ASP  40          HB1       ASP  40  -7.673  -5.026  -3.366
  315    H    GLY  41           HN       GLY  41  -8.095  -0.736  -4.449
  316   1HA   GLY  41          HA2       GLY  41 -10.201  -0.852  -6.535
  317   2HA   GLY  41          HA1       GLY  41 -10.318   0.439  -5.335
  318    H    GLU  42           HN       GLU  42  -8.603   2.037  -5.265
  319    HA   GLU  42           HA       GLU  42  -6.885   2.113  -7.724
  320   1HB   GLU  42          HB2       GLU  42  -9.038   3.869  -6.767
  321   2HB   GLU  42          HB1       GLU  42  -7.552   4.747  -7.124
  322   1HG   GLU  42          HG2       GLU  42  -7.652   4.291  -9.366
  323   2HG   GLU  42          HG1       GLU  42  -8.381   2.704  -9.117
  324    H    TRP  43           HN       TRP  43  -4.775   2.216  -7.088
  325    HA   TRP  43           HA       TRP  43  -4.096   3.302  -4.396
  326   1HB   TRP  43          HB2       TRP  43  -2.591   1.723  -6.507
  327   2HB   TRP  43          HB1       TRP  43  -1.848   2.300  -5.027
  328    HD1  TRP  43           HD1      TRP  43  -5.427   0.888  -4.999
  329    HE1  TRP  43           HE1      TRP  43  -5.407  -1.321  -3.698
  330    HE3  TRP  43           HE3      TRP  43  -0.423   0.374  -4.253
  331    HZ2  TRP  43           HZ2      TRP  43  -3.522  -3.061  -2.455
  332    HZ3  TRP  43           HZ3      TRP  43   0.462  -1.566  -2.977
  333    HH2  TRP  43           HH2      TRP  43  -1.075  -3.274  -2.080
  334    H    THR  44           HN       THR  44  -2.155   4.751  -4.297
  335    HA   THR  44           HA       THR  44  -1.469   6.217  -6.779
  336    HB   THR  44           HB       THR  44  -2.088   8.376  -5.757
  337    HG1  THR  44           HG1      THR  44  -3.387   8.236  -3.820
  338   1HG2  THR  44          HG21      THR  44  -3.744   6.949  -7.095
  339   2HG2  THR  44          HG22      THR  44  -4.438   8.208  -6.075
  340   3HG2  THR  44          HG23      THR  44  -4.467   6.527  -5.543
  341    H    TYR  45           HN       TYR  45   0.675   6.728  -6.704
  342    HA   TYR  45           HA       TYR  45   2.204   6.152  -4.251
  343   1HB   TYR  45          HB2       TYR  45   2.925   5.387  -6.482
  344   2HB   TYR  45          HB1       TYR  45   2.978   7.055  -7.051
  345    HD1  TYR  45           HD1      TYR  45   5.100   7.986  -7.166
  346    HD2  TYR  45           HD2      TYR  45   4.241   5.131  -4.076
  347    HE1  TYR  45           HE1      TYR  45   7.419   8.208  -6.318
  348    HE2  TYR  45           HE2      TYR  45   6.560   5.350  -3.227
  349    HH   TYR  45           HH       TYR  45   8.988   6.316  -4.747
  350    H    ASP  46           HN       ASP  46   3.865   7.800  -3.513
  351    HA   ASP  46           HA       ASP  46   3.092  10.635  -4.075
  352   1HB   ASP  46          HB2       ASP  46   3.519   9.429  -1.316
  353   2HB   ASP  46          HB1       ASP  46   3.054  11.090  -1.671
  354    H    ASP  47           HN       ASP  47   4.908  11.801  -4.519
  355    HA   ASP  47           HA       ASP  47   7.567  10.669  -4.280
  356   1HB   ASP  47          HB2       ASP  47   6.799  12.249  -6.038
  357   2HB   ASP  47          HB1       ASP  47   6.626  13.506  -4.812
  358    H    ALA  48           HN       ALA  48   5.556  12.201  -1.981
  359    HA   ALA  48           HA       ALA  48   7.284  13.856  -0.478
  360   1HB   ALA  48          HB1       ALA  48   4.905  12.104   0.048
  361   2HB   ALA  48          HB2       ALA  48   5.048  13.859   0.176
  362   3HB   ALA  48          HB3       ALA  48   5.737  12.825   1.428
  363    H    THR  49           HN       THR  49   6.433  10.544   0.535
  364    HA   THR  49           HA       THR  49   9.296  10.055   1.271
  365    HB   THR  49           HB       THR  49   7.999  10.838   3.230
  366    HG1  THR  49           HG1      THR  49   9.555   9.195   3.527
  367   1HG2  THR  49          HG21      THR  49   6.111   9.379   4.040
  368   2HG2  THR  49          HG22      THR  49   6.185   8.525   2.497
  369   3HG2  THR  49          HG23      THR  49   5.758  10.236   2.538
  370    H    LYS  50           HN       LYS  50   7.816   9.099  -1.031
  371    HA   LYS  50           HA       LYS  50   7.347   7.102  -2.176
  372   1HB   LYS  50          HB2       LYS  50   8.975   5.974   0.126
  373   2HB   LYS  50          HB1       LYS  50   8.668   5.160  -1.406
  374   1HG   LYS  50          HG2       LYS  50   9.668   7.680  -2.139
  375   2HG   LYS  50          HG1       LYS  50  10.658   7.192  -0.764
  376   1HD   LYS  50          HD2       LYS  50  10.454   4.859  -2.277
  377   2HD   LYS  50          HD1       LYS  50  10.608   6.127  -3.492
  378   1HE   LYS  50          HE2       LYS  50  12.471   5.819  -1.109
  379   2HE   LYS  50          HE1       LYS  50  12.835   5.255  -2.753
  380   1HZ   LYS  50          HZ1       LYS  50  12.160   8.041  -1.964
  381   2HZ   LYS  50          HZ2       LYS  50  12.404   7.512  -3.560
  382   3HZ   LYS  50          HZ3       LYS  50  13.688   7.485  -2.447
  383    H    THR  51           HN       THR  51   5.279   7.983  -0.538
  384    HA   THR  51           HA       THR  51   4.308   5.738   1.116
  385    HB   THR  51           HB       THR  51   2.607   8.071   0.312
  386    HG1  THR  51           HG1      THR  51   3.981   9.481   0.986
  387   1HG2  THR  51          HG21      THR  51   2.498   6.099   2.266
  388   2HG2  THR  51          HG22      THR  51   1.551   7.588   2.247
  389   3HG2  THR  51          HG23      THR  51   3.067   7.519   3.144
  390    H    TRP  52           HN       TRP  52   1.644   5.611   0.556
  391    HA   TRP  52           HA       TRP  52   1.204   5.241  -2.343
  392   1HB   TRP  52          HB2       TRP  52   1.528   3.040  -0.309
  393   2HB   TRP  52          HB1       TRP  52   0.543   2.805  -1.747
  394    HD1  TRP  52           HD1      TRP  52   4.118   3.023  -0.591
  395    HE1  TRP  52           HE1      TRP  52   5.684   2.565  -2.592
  396    HE3  TRP  52           HE3      TRP  52   0.718   3.082  -4.350
  397    HZ2  TRP  52           HZ2      TRP  52   5.495   2.258  -5.441
  398    HZ3  TRP  52           HZ3      TRP  52   1.411   2.703  -6.708
  399    HH2  TRP  52           HH2      TRP  52   3.797   2.289  -7.255
  400    H    THR  53           HN       THR  53  -1.068   3.809  -2.364
  401    HA   THR  53           HA       THR  53  -2.900   4.573  -0.196
  402    HB   THR  53           HB       THR  53  -3.332   5.671  -2.986
  403    HG1  THR  53           HG1      THR  53  -1.737   6.931  -2.393
  404   1HG2  THR  53          HG21      THR  53  -5.400   5.685  -1.928
  405   2HG2  THR  53          HG22      THR  53  -4.770   7.263  -1.457
  406   3HG2  THR  53          HG23      THR  53  -4.693   5.910  -0.328
  407    H    VAL  54           HN       VAL  54  -5.202   3.838  -0.819
  408    HA   VAL  54           HA       VAL  54  -5.574   1.959  -2.997
  409    HB   VAL  54           HB       VAL  54  -4.075   0.568  -1.717
  410   1HG1  VAL  54          HG11      VAL  54  -4.195   1.838   0.385
  411   2HG1  VAL  54          HG12      VAL  54  -4.400   0.111   0.668
  412   3HG1  VAL  54          HG13      VAL  54  -5.800   1.181   0.689
  413   1HG2  VAL  54          HG21      VAL  54  -6.641  -0.510  -0.633
  414   2HG2  VAL  54          HG22      VAL  54  -5.353  -1.343  -1.508
  415   3HG2  VAL  54          HG23      VAL  54  -6.507  -0.330  -2.383
  416    H    THR  55           HN       THR  55  -7.410   3.523  -3.000
  417    HA   THR  55           HA       THR  55  -9.386   3.381  -0.828
  418    HB   THR  55           HB       THR  55  -9.723   4.564  -3.590
  419    HG1  THR  55           HG1      THR  55  -8.329   5.629  -1.361
  420   1HG2  THR  55          HG21      THR  55 -11.684   4.655  -2.176
  421   2HG2  THR  55          HG22      THR  55 -10.986   6.273  -2.246
  422   3HG2  THR  55          HG23      THR  55 -10.732   5.264  -0.822
  423    H    GLU  56           HN       GLU  56 -11.139   2.011  -0.796
  424    HA   GLU  56           HA       GLU  56 -11.373  -0.187  -2.641
  425   1HB   GLU  56          HB2       GLU  56 -12.141   0.156  -0.165
  426   2HB   GLU  56          HB1       GLU  56 -13.599   0.840  -0.885
  427   1HG   GLU  56          HG2       GLU  56 -12.504  -1.871  -1.665
  428   2HG   GLU  56          HG1       GLU  56 -13.700  -1.654  -0.387
  Start of MODEL   21
    1   1H    THR   1          HT1       THR   1  13.825   7.544   5.874
    2   2H    THR   1          HT2       THR   1  14.058   6.541   4.522
    3   3H    THR   1          HT3       THR   1  14.260   5.919   6.090
    4    HA   THR   1           HA       THR   1  11.948   6.044   6.554
    5    HB   THR   1           HB       THR   1  11.675   8.262   5.542
    6    HG1  THR   1           HG1      THR   1   9.703   7.543   5.610
    7   1HG2  THR   1          HG21      THR   1  11.188   7.810   2.846
    8   2HG2  THR   1          HG22      THR   1  12.627   6.844   3.165
    9   3HG2  THR   1          HG23      THR   1  12.629   8.571   3.518
   10    H    THR   2           HN       THR   2  10.567   4.335   5.908
   11    HA   THR   2           HA       THR   2  11.669   2.564   3.782
   12    HB   THR   2           HB       THR   2  11.374   1.722   6.082
   13    HG1  THR   2           HG1      THR   2  11.103   0.140   4.634
   14   1HG2  THR   2          HG21      THR   2   9.632   2.558   7.247
   15   2HG2  THR   2          HG22      THR   2   8.638   1.381   6.389
   16   3HG2  THR   2          HG23      THR   2   8.775   3.030   5.780
   17    H    PHE   3           HN       PHE   3   9.415   1.090   3.158
   18    HA   PHE   3           HA       PHE   3   8.033   2.851   1.284
   19   1HB   PHE   3          HB2       PHE   3   7.543  -0.048   2.055
   20   2HB   PHE   3          HB1       PHE   3   6.990   0.741   0.580
   21    HD1  PHE   3           HD1      PHE   3   9.228   2.252  -0.395
   22    HD2  PHE   3           HD2      PHE   3   9.235  -1.578   1.551
   23    HE1  PHE   3           HE1      PHE   3  11.380   1.698  -1.495
   24    HE2  PHE   3           HE2      PHE   3  11.387  -2.131   0.451
   25    HZ   PHE   3           HZ       PHE   3  12.459  -0.494  -1.071
   26    H    LYS   4           HN       LYS   4   5.771   3.355   1.311
   27    HA   LYS   4           HA       LYS   4   4.263   2.706   3.811
   28   1HB   LYS   4          HB2       LYS   4   5.496   4.921   3.933
   29   2HB   LYS   4          HB1       LYS   4   4.497   5.471   2.596
   30   1HG   LYS   4          HG2       LYS   4   2.465   5.063   3.905
   31   2HG   LYS   4          HG1       LYS   4   3.436   4.465   5.249
   32   1HD   LYS   4          HD2       LYS   4   4.199   6.566   5.818
   33   2HD   LYS   4          HD1       LYS   4   4.086   7.169   4.165
   34   1HE   LYS   4          HE2       LYS   4   2.201   8.227   4.937
   35   2HE   LYS   4          HE1       LYS   4   1.442   6.634   4.739
   36   1HZ   LYS   4          HZ1       LYS   4   2.824   7.618   7.182
   37   2HZ   LYS   4          HZ2       LYS   4   2.162   6.065   6.987
   38   3HZ   LYS   4          HZ3       LYS   4   1.148   7.428   7.000
   39    H    LEU   5           HN       LEU   5   1.966   2.814   3.534
   40    HA   LEU   5           HA       LEU   5   0.901   3.444   0.832
   41   1HB   LEU   5          HB2       LEU   5   1.661   0.928   1.303
   42   2HB   LEU   5          HB1       LEU   5   0.106   0.857   2.123
   43    HG   LEU   5           HG       LEU   5  -0.137   2.194  -0.458
   44   1HD1  LEU   5          HD11      LEU   5   1.819   0.479  -0.775
   45   2HD1  LEU   5          HD12      LEU   5   0.504   0.516  -1.956
   46   3HD1  LEU   5          HD13      LEU   5   0.532  -0.731  -0.697
   47   1HD2  LEU   5          HD21      LEU   5  -1.911   0.461  -0.735
   48   2HD2  LEU   5          HD22      LEU   5  -2.034   1.315   0.804
   49   3HD2  LEU   5          HD23      LEU   5  -1.352  -0.311   0.749
   50    H    ILE   6           HN       ILE   6  -1.174   4.270   0.969
   51    HA   ILE   6           HA       ILE   6  -2.414   4.368   3.693
   52    HB   ILE   6           HB       ILE   6  -2.595   6.149   1.245
   53   1HG1  ILE   6          HG12      ILE   6  -0.450   6.252   2.479
   54   2HG1  ILE   6          HG11      ILE   6  -1.356   7.755   2.641
   55   1HG2  ILE   6          HG21      ILE   6  -4.670   6.523   2.221
   56   2HG2  ILE   6          HG22      ILE   6  -3.682   7.687   3.105
   57   3HG2  ILE   6          HG23      ILE   6  -4.092   6.138   3.843
   58   1HD1  ILE   6          HD11      ILE   6  -0.508   5.885   4.703
   59   2HD1  ILE   6          HD12      ILE   6  -2.248   6.162   4.770
   60   3HD1  ILE   6          HD13      ILE   6  -1.134   7.524   4.876
   61    H    ILE   7           HN       ILE   7  -4.439   3.484   3.952
   62    HA   ILE   7           HA       ILE   7  -5.647   2.009   1.708
   63    HB   ILE   7           HB       ILE   7  -6.402   2.358   4.630
   64   1HG1  ILE   7          HG12      ILE   7  -5.023   0.027   3.268
   65   2HG1  ILE   7          HG11      ILE   7  -4.152   1.304   4.118
   66   1HG2  ILE   7          HG21      ILE   7  -7.732   0.290   4.269
   67   2HG2  ILE   7          HG22      ILE   7  -7.332   0.350   2.552
   68   3HG2  ILE   7          HG23      ILE   7  -8.315   1.625   3.274
   69   1HD1  ILE   7          HD11      ILE   7  -4.402  -0.187   5.861
   70   2HD1  ILE   7          HD12      ILE   7  -5.902  -0.853   5.215
   71   3HD1  ILE   7          HD13      ILE   7  -5.911   0.707   6.039
   72    H    ASN   8           HN       ASN   8  -7.239   2.871   0.448
   73    HA   ASN   8           HA       ASN   8  -8.823   5.183   1.524
   74   1HB   ASN   8          HB2       ASN   8  -7.603   4.559  -1.165
   75   2HB   ASN   8          HB1       ASN   8  -8.937   5.704  -1.028
   76   1HD2  ASN   8          HD21      ASN   8  -7.458   7.482  -1.649
   77   2HD2  ASN   8          HD22      ASN   8  -6.334   8.097  -0.523
   78    H    GLY   9           HN       GLY   9  -9.852   2.743   2.106
   79   1HA   GLY   9          HA2       GLY   9 -11.603   1.792  -0.054
   80   2HA   GLY   9          HA1       GLY   9 -11.539   1.149   1.591
   81    H    LYS  10           HN       LYS  10 -13.961   1.781   0.178
   82    HA   LYS  10           HA       LYS  10 -15.114   4.287   0.749
   83   1HB   LYS  10          HB2       LYS  10 -16.324   1.507   0.682
   84   2HB   LYS  10          HB1       LYS  10 -17.252   3.003   0.577
   85   1HG   LYS  10          HG2       LYS  10 -15.807   3.625  -1.422
   86   2HG   LYS  10          HG1       LYS  10 -15.189   1.974  -1.384
   87   1HD   LYS  10          HD2       LYS  10 -16.950   1.537  -2.763
   88   2HD   LYS  10          HD1       LYS  10 -17.877   1.509  -1.263
   89   1HE   LYS  10          HE2       LYS  10 -17.479   4.223  -2.362
   90   2HE   LYS  10          HE1       LYS  10 -18.454   3.153  -3.388
   91   1HZ   LYS  10          HZ1       LYS  10 -19.832   4.220  -1.708
   92   2HZ   LYS  10          HZ2       LYS  10 -18.848   3.591  -0.474
   93   3HZ   LYS  10          HZ3       LYS  10 -19.766   2.545  -1.449
   94    H    THR  11           HN       THR  11 -14.764   1.425   2.816
   95    HA   THR  11           HA       THR  11 -15.693   3.076   5.142
   96    HB   THR  11           HB       THR  11 -16.160   0.109   4.794
   97    HG1  THR  11           HG1      THR  11 -18.073   0.582   3.853
   98   1HG2  THR  11          HG21      THR  11 -16.424   0.911   7.058
   99   2HG2  THR  11          HG22      THR  11 -18.034   0.642   6.389
  100   3HG2  THR  11          HG23      THR  11 -17.391   2.280   6.509
  101    H    LEU  12           HN       LEU  12 -12.963   1.994   3.925
  102    HA   LEU  12           HA       LEU  12 -11.849   1.182   6.570
  103   1HB   LEU  12          HB2       LEU  12 -11.707  -0.268   3.924
  104   2HB   LEU  12          HB1       LEU  12 -10.510  -0.541   5.190
  105    HG   LEU  12           HG       LEU  12 -13.488  -0.777   5.666
  106   1HD1  LEU  12          HD11      LEU  12 -11.609  -3.108   5.329
  107   2HD1  LEU  12          HD12      LEU  12 -12.430  -2.405   3.935
  108   3HD1  LEU  12          HD13      LEU  12 -13.371  -3.093   5.259
  109   1HD2  LEU  12          HD21      LEU  12 -10.985  -1.508   7.199
  110   2HD2  LEU  12          HD22      LEU  12 -12.557  -2.207   7.588
  111   3HD2  LEU  12          HD23      LEU  12 -12.311  -0.465   7.715
  112    H    LYS  13           HN       LYS  13  -9.998   2.343   6.973
  113    HA   LYS  13           HA       LYS  13  -8.314   3.259   4.694
  114   1HB   LYS  13          HB2       LYS  13  -9.742   4.971   6.740
  115   2HB   LYS  13          HB1       LYS  13  -8.368   5.570   5.810
  116   1HG   LYS  13          HG2       LYS  13  -9.583   4.977   3.710
  117   2HG   LYS  13          HG1       LYS  13 -10.979   4.518   4.685
  118   1HD   LYS  13          HD2       LYS  13  -9.750   7.237   5.039
  119   2HD   LYS  13          HD1       LYS  13 -10.852   6.944   3.693
  120   1HE   LYS  13          HE2       LYS  13 -12.317   5.831   5.662
  121   2HE   LYS  13          HE1       LYS  13 -11.428   7.035   6.617
  122   1HZ   LYS  13          HZ1       LYS  13 -12.043   8.730   5.029
  123   2HZ   LYS  13          HZ2       LYS  13 -13.445   7.978   5.623
  124   3HZ   LYS  13          HZ3       LYS  13 -12.862   7.593   4.074
  125    H    GLY  14           HN       GLY  14  -6.432   4.690   5.889
  126   1HA   GLY  14          HA2       GLY  14  -5.275   4.678   8.199
  127   2HA   GLY  14          HA1       GLY  14  -5.394   2.924   8.059
  128    H    GLU  15           HN       GLU  15  -2.883   3.896   8.342
  129    HA   GLU  15           HA       GLU  15  -1.730   3.895   5.570
  130   1HB   GLU  15          HB2       GLU  15   0.163   5.106   6.650
  131   2HB   GLU  15          HB1       GLU  15  -1.366   5.958   6.857
  132   1HG   GLU  15          HG2       GLU  15  -1.583   5.208   9.122
  133   2HG   GLU  15          HG1       GLU  15  -0.274   4.041   8.930
  134    H    THR  16           HN       THR  16   0.496   2.845   5.486
  135    HA   THR  16           HA       THR  16   1.187   0.902   7.572
  136    HB   THR  16           HB       THR  16  -0.742  -0.172   6.490
  137    HG1  THR  16           HG1      THR  16   0.837  -1.586   7.094
  138   1HG2  THR  16          HG21      THR  16  -0.454  -0.854   4.046
  139   2HG2  THR  16          HG22      THR  16   0.855   0.326   3.965
  140   3HG2  THR  16          HG23      THR  16  -0.788   0.853   4.332
  141    H    THR  17           HN       THR  17   3.294   0.070   7.252
  142    HA   THR  17           HA       THR  17   4.690   0.851   4.717
  143    HB   THR  17           HB       THR  17   6.622   1.481   6.213
  144    HG1  THR  17           HG1      THR  17   6.434   1.090   8.251
  145   1HG2  THR  17          HG21      THR  17   5.448   3.584   7.115
  146   2HG2  THR  17          HG22      THR  17   3.976   2.919   6.407
  147   3HG2  THR  17          HG23      THR  17   5.355   3.301   5.377
  148    H    THR  18           HN       THR  18   6.591  -0.488   4.273
  149    HA   THR  18           HA       THR  18   6.861  -2.943   5.921
  150    HB   THR  18           HB       THR  18   5.601  -2.613   3.284
  151    HG1  THR  18           HG1      THR  18   5.934  -4.778   5.089
  152   1HG2  THR  18          HG21      THR  18   6.601  -4.547   2.178
  153   2HG2  THR  18          HG22      THR  18   7.755  -4.742   3.499
  154   3HG2  THR  18          HG23      THR  18   7.828  -3.312   2.467
  155    H    GLU  19           HN       GLU  19   8.953  -3.979   5.594
  156    HA   GLU  19           HA       GLU  19  11.017  -2.141   4.435
  157   1HB   GLU  19          HB2       GLU  19  10.767  -3.088   6.959
  158   2HB   GLU  19          HB1       GLU  19  11.724  -4.391   6.253
  159   1HG   GLU  19          HG2       GLU  19  13.082  -2.294   5.257
  160   2HG   GLU  19          HG1       GLU  19  12.460  -1.546   6.730
  161    H    ALA  20           HN       ALA  20  11.919  -2.860   2.548
  162    HA   ALA  20           HA       ALA  20  12.506  -5.724   2.153
  163   1HB   ALA  20          HB1       ALA  20  10.244  -4.230   0.917
  164   2HB   ALA  20          HB2       ALA  20  10.370  -5.943   1.319
  165   3HB   ALA  20          HB3       ALA  20  11.141  -5.322  -0.140
  166    H    VAL  21           HN       VAL  21  13.257  -5.893  -0.349
  167    HA   VAL  21           HA       VAL  21  15.611  -4.283  -0.633
  168    HB   VAL  21           HB       VAL  21  15.234  -6.554  -1.581
  169   1HG1  VAL  21          HG11      VAL  21  13.807  -6.969  -3.430
  170   2HG1  VAL  21          HG12      VAL  21  13.542  -5.247  -3.702
  171   3HG1  VAL  21          HG13      VAL  21  12.835  -6.036  -2.291
  172   1HG2  VAL  21          HG21      VAL  21  15.979  -4.284  -3.405
  173   2HG2  VAL  21          HG22      VAL  21  16.051  -5.954  -3.968
  174   3HG2  VAL  21          HG23      VAL  21  17.039  -5.441  -2.600
  175    H    ASP  22           HN       ASP  22  12.405  -4.100  -2.092
  176    HA   ASP  22           HA       ASP  22  12.851  -1.277  -2.864
  177   1HB   ASP  22          HB2       ASP  22  12.255  -3.598  -4.721
  178   2HB   ASP  22          HB1       ASP  22  12.169  -1.900  -5.219
  179    H    ALA  23           HN       ALA  23  10.738  -0.333  -3.677
  180    HA   ALA  23           HA       ALA  23   8.529  -1.094  -1.973
  181   1HB   ALA  23          HB1       ALA  23   9.315   1.040  -3.732
  182   2HB   ALA  23          HB2       ALA  23   8.044   1.050  -2.511
  183   3HB   ALA  23          HB3       ALA  23   7.677   0.545  -4.160
  184    H    ALA  24           HN       ALA  24   9.457  -1.899  -5.265
  185    HA   ALA  24           HA       ALA  24   6.957  -2.825  -6.286
  186   1HB   ALA  24          HB1       ALA  24   9.505  -2.574  -7.194
  187   2HB   ALA  24          HB2       ALA  24   8.286  -3.541  -8.024
  188   3HB   ALA  24          HB3       ALA  24   9.445  -4.319  -6.946
  189    H    THR  25           HN       THR  25   9.530  -4.559  -4.514
  190    HA   THR  25           HA       THR  25   8.159  -7.099  -4.411
  191    HB   THR  25           HB       THR  25  10.394  -5.797  -2.818
  192    HG1  THR  25           HG1      THR  25  10.355  -7.842  -4.778
  193   1HG2  THR  25          HG21      THR  25   9.523  -8.704  -2.748
  194   2HG2  THR  25          HG22      THR  25   9.270  -7.543  -1.441
  195   3HG2  THR  25          HG23      THR  25  10.909  -8.010  -1.904
  196    H    ALA  26           HN       ALA  26   8.551  -4.464  -2.003
  197    HA   ALA  26           HA       ALA  26   6.996  -5.632   0.067
  198   1HB   ALA  26          HB1       ALA  26   7.646  -2.797  -0.764
  199   2HB   ALA  26          HB2       ALA  26   8.343  -3.733   0.558
  200   3HB   ALA  26          HB3       ALA  26   6.688  -3.128   0.683
  201    H    GLU  27           HN       GLU  27   5.984  -3.144  -2.302
  202    HA   GLU  27           HA       GLU  27   3.310  -2.833  -1.750
  203   1HB   GLU  27          HB2       GLU  27   4.644  -1.735  -3.542
  204   2HB   GLU  27          HB1       GLU  27   4.542  -3.213  -4.498
  205   1HG   GLU  27          HG2       GLU  27   1.950  -2.936  -4.109
  206   2HG   GLU  27          HG1       GLU  27   2.378  -1.251  -3.811
  207    H    LYS  28           HN       LYS  28   4.717  -5.662  -3.402
  208    HA   LYS  28           HA       LYS  28   2.237  -6.887  -4.217
  209   1HB   LYS  28          HB2       LYS  28   4.910  -8.090  -3.390
  210   2HB   LYS  28          HB1       LYS  28   3.660  -8.931  -4.306
  211   1HG   LYS  28          HG2       LYS  28   4.021  -7.665  -6.224
  212   2HG   LYS  28          HG1       LYS  28   4.691  -6.305  -5.324
  213   1HD   LYS  28          HD2       LYS  28   6.668  -7.158  -6.128
  214   2HD   LYS  28          HD1       LYS  28   6.524  -8.173  -4.692
  215   1HE   LYS  28          HE2       LYS  28   6.043 -10.056  -5.916
  216   2HE   LYS  28          HE1       LYS  28   5.107  -9.151  -7.122
  217   1HZ   LYS  28          HZ1       LYS  28   8.059  -9.004  -6.815
  218   2HZ   LYS  28          HZ2       LYS  28   7.128  -8.236  -8.011
  219   3HZ   LYS  28          HZ3       LYS  28   7.264  -9.929  -7.993
  220    H    VAL  29           HN       VAL  29   4.241  -7.159  -1.288
  221    HA   VAL  29           HA       VAL  29   2.508  -9.006   0.124
  222    HB   VAL  29           HB       VAL  29   4.710  -7.043   0.837
  223   1HG1  VAL  29          HG11      VAL  29   3.287  -8.894   2.780
  224   2HG1  VAL  29          HG12      VAL  29   3.161  -7.132   2.778
  225   3HG1  VAL  29          HG13      VAL  29   4.707  -7.909   3.139
  226   1HG2  VAL  29          HG21      VAL  29   4.611 -10.047   1.165
  227   2HG2  VAL  29          HG22      VAL  29   6.033  -9.004   1.140
  228   3HG2  VAL  29          HG23      VAL  29   5.114  -9.277  -0.340
  229    H    LEU  30           HN       LEU  30   2.728  -5.463  -0.128
  230    HA   LEU  30           HA       LEU  30   0.841  -4.863   1.944
  231   1HB   LEU  30          HB2       LEU  30   1.885  -3.465  -0.526
  232   2HB   LEU  30          HB1       LEU  30   0.682  -2.694   0.494
  233    HG   LEU  30           HG       LEU  30   3.255  -2.237   0.882
  234   1HD1  LEU  30          HD11      LEU  30   1.613  -1.224   2.284
  235   2HD1  LEU  30          HD12      LEU  30   2.810  -1.978   3.345
  236   3HD1  LEU  30          HD13      LEU  30   1.248  -2.762   3.072
  237   1HD2  LEU  30          HD21      LEU  30   4.063  -3.688   2.806
  238   2HD2  LEU  30          HD22      LEU  30   4.153  -4.395   1.207
  239   3HD2  LEU  30          HD23      LEU  30   2.869  -4.870   2.314
  240    H    LYS  31           HN       LYS  31   0.538  -5.738  -1.451
  241    HA   LYS  31           HA       LYS  31  -2.253  -5.112  -1.846
  242   1HB   LYS  31          HB2       LYS  31  -0.258  -5.951  -3.431
  243   2HB   LYS  31          HB1       LYS  31  -0.900  -7.524  -3.024
  244   1HG   LYS  31          HG2       LYS  31  -2.691  -5.305  -4.017
  245   2HG   LYS  31          HG1       LYS  31  -1.858  -6.388  -5.131
  246   1HD   LYS  31          HD2       LYS  31  -3.783  -7.228  -2.937
  247   2HD   LYS  31          HD1       LYS  31  -4.121  -7.229  -4.667
  248   1HE   LYS  31          HE2       LYS  31  -1.715  -8.685  -4.376
  249   2HE   LYS  31          HE1       LYS  31  -2.793  -9.267  -3.087
  250   1HZ   LYS  31          HZ1       LYS  31  -3.585  -8.922  -5.936
  251   2HZ   LYS  31          HZ2       LYS  31  -4.554  -9.552  -4.690
  252   3HZ   LYS  31          HZ3       LYS  31  -3.187 -10.409  -5.224
  253    H    GLN  32           HN       GLN  32  -0.502  -8.001  -0.759
  254    HA   GLN  32           HA       GLN  32  -2.661  -9.792  -0.366
  255   1HB   GLN  32          HB2       GLN  32   0.085  -9.370   0.674
  256   2HB   GLN  32          HB1       GLN  32  -0.959 -10.435   1.616
  257   1HG   GLN  32          HG2       GLN  32  -0.943 -10.835  -1.331
  258   2HG   GLN  32          HG1       GLN  32   0.499 -11.339  -0.450
  259   1HE2  GLN  32          HE21      GLN  32   0.371 -13.258   0.792
  260   2HE2  GLN  32          HE22      GLN  32  -1.059 -14.171   0.974
  261    H    TYR  33           HN       TYR  33  -1.342  -7.265   1.755
  262    HA   TYR  33           HA       TYR  33  -3.013  -7.760   4.058
  263   1HB   TYR  33          HB2       TYR  33  -0.973  -6.401   4.108
  264   2HB   TYR  33          HB1       TYR  33  -1.666  -5.264   2.953
  265    HD1  TYR  33           HD1      TYR  33  -2.041  -6.681   6.354
  266    HD2  TYR  33           HD2      TYR  33  -3.115  -3.514   3.665
  267    HE1  TYR  33           HE1      TYR  33  -3.088  -5.457   8.224
  268    HE2  TYR  33           HE2      TYR  33  -4.159  -2.277   5.540
  269    HH   TYR  33           HH       TYR  33  -3.847  -2.240   8.123
  270    H    ILE  34           HN       ILE  34  -3.344  -5.730   1.168
  271    HA   ILE  34           HA       ILE  34  -5.853  -4.484   1.848
  272    HB   ILE  34           HB       ILE  34  -4.523  -5.146  -0.799
  273   1HG1  ILE  34          HG12      ILE  34  -3.283  -3.744   0.991
  274   2HG1  ILE  34          HG11      ILE  34  -3.385  -3.080  -0.634
  275   1HG2  ILE  34          HG21      ILE  34  -5.892  -2.992  -1.450
  276   2HG2  ILE  34          HG22      ILE  34  -6.924  -3.489  -0.109
  277   3HG2  ILE  34          HG23      ILE  34  -6.669  -4.575  -1.475
  278   1HD1  ILE  34          HD11      ILE  34  -3.969  -1.605   1.501
  279   2HD1  ILE  34          HD12      ILE  34  -5.541  -2.385   1.325
  280   3HD1  ILE  34          HD13      ILE  34  -4.879  -1.428   0.000
  281    H    ASN  35           HN       ASN  35  -4.968  -7.590   0.450
  282    HA   ASN  35           HA       ASN  35  -7.419  -8.374  -0.751
  283   1HB   ASN  35          HB2       ASN  35  -5.121  -9.476  -0.793
  284   2HB   ASN  35          HB1       ASN  35  -5.503 -10.138   0.796
  285   1HD2  ASN  35          HD21      ASN  35  -5.125 -11.698  -1.695
  286   2HD2  ASN  35          HD22      ASN  35  -6.590 -12.506  -1.979
  287    H    ASP  36           HN       ASP  36  -6.450  -8.240   2.628
  288    HA   ASP  36           HA       ASP  36  -8.622  -9.890   3.652
  289   1HB   ASP  36          HB2       ASP  36  -6.435  -9.500   4.778
  290   2HB   ASP  36          HB1       ASP  36  -6.862  -7.801   4.981
  291    H    ASN  37           HN       ASN  37  -7.986  -6.362   3.827
  292    HA   ASN  37           HA       ASN  37 -10.551  -5.629   4.860
  293   1HB   ASN  37          HB2       ASN  37  -8.521  -4.138   3.161
  294   2HB   ASN  37          HB1       ASN  37  -9.861  -3.366   4.017
  295   1HD2  ASN  37          HD21      ASN  37  -8.399  -2.185   5.450
  296   2HD2  ASN  37          HD22      ASN  37  -7.531  -2.986   6.682
  297    H    GLY  38           HN       GLY  38  -9.416  -6.248   1.584
  298   1HA   GLY  38          HA2       GLY  38 -10.741  -6.720  -0.326
  299   2HA   GLY  38          HA1       GLY  38 -12.181  -6.308   0.607
  300    H    ILE  39           HN       ILE  39  -9.388  -4.186   0.396
  301    HA   ILE  39           HA       ILE  39 -11.073  -2.237  -1.142
  302    HB   ILE  39           HB       ILE  39  -8.813  -1.830   0.848
  303   1HG1  ILE  39          HG12      ILE  39 -10.878  -2.671   1.904
  304   2HG1  ILE  39          HG11      ILE  39 -10.606  -0.981   2.335
  305   1HG2  ILE  39          HG21      ILE  39 -10.613   0.140  -0.591
  306   2HG2  ILE  39          HG22      ILE  39  -8.862  -0.002  -0.747
  307   3HG2  ILE  39          HG23      ILE  39  -9.569   0.563   0.766
  308   1HD1  ILE  39          HD11      ILE  39 -12.802  -2.189   0.798
  309   2HD1  ILE  39          HD12      ILE  39 -12.105  -0.767   0.023
  310   3HD1  ILE  39          HD13      ILE  39 -12.747  -0.652   1.661
  311    H    ASP  40           HN       ASP  40 -10.159  -3.443  -3.096
  312    HA   ASP  40           HA       ASP  40  -7.406  -2.444  -3.758
  313   1HB   ASP  40          HB2       ASP  40  -7.246  -4.503  -5.160
  314   2HB   ASP  40          HB1       ASP  40  -7.511  -4.882  -3.455
  315    H    GLY  41           HN       GLY  41  -7.634  -0.784  -5.209
  316   1HA   GLY  41          HA2       GLY  41  -9.421  -1.200  -7.544
  317   2HA   GLY  41          HA1       GLY  41  -9.642   0.268  -6.588
  318    H    GLU  42           HN       GLU  42  -7.891   1.827  -6.538
  319    HA   GLU  42           HA       GLU  42  -5.897   1.481  -8.754
  320   1HB   GLU  42          HB2       GLU  42  -8.015   3.452  -8.257
  321   2HB   GLU  42          HB1       GLU  42  -6.445   4.205  -8.537
  322   1HG   GLU  42          HG2       GLU  42  -6.322   3.473 -10.708
  323   2HG   GLU  42          HG1       GLU  42  -7.202   1.983 -10.367
  324    H    TRP  43           HN       TRP  43  -3.869   1.524  -7.908
  325    HA   TRP  43           HA       TRP  43  -3.368   2.919  -5.320
  326   1HB   TRP  43          HB2       TRP  43  -1.801   0.968  -7.039
  327   2HB   TRP  43          HB1       TRP  43  -1.160   1.688  -5.573
  328    HD1  TRP  43           HD1      TRP  43  -4.833   0.560  -5.718
  329    HE1  TRP  43           HE1      TRP  43  -5.114  -1.462  -4.164
  330    HE3  TRP  43           HE3      TRP  43   0.031  -0.244  -4.455
  331    HZ2  TRP  43           HZ2      TRP  43  -3.499  -3.172  -2.555
  332    HZ3  TRP  43           HZ3      TRP  43   0.634  -2.069  -2.882
  333    HH2  TRP  43           HH2      TRP  43  -1.118  -3.527  -1.934
  334    H    THR  44           HN       THR  44  -1.293   4.198  -5.219
  335    HA   THR  44           HA       THR  44  -0.279   5.265  -7.787
  336    HB   THR  44           HB       THR  44  -0.773   7.585  -7.104
  337    HG1  THR  44           HG1      THR  44  -2.166   7.867  -5.299
  338   1HG2  THR  44          HG21      THR  44  -3.326   5.983  -6.904
  339   2HG2  THR  44          HG22      THR  44  -2.432   6.140  -8.416
  340   3HG2  THR  44          HG23      THR  44  -3.093   7.573  -7.629
  341    H    TYR  45           HN       TYR  45   1.889   5.586  -7.574
  342    HA   TYR  45           HA       TYR  45   3.135   5.250  -4.920
  343   1HB   TYR  45          HB2       TYR  45   3.948   4.054  -6.914
  344   2HB   TYR  45          HB1       TYR  45   4.230   5.587  -7.738
  345    HD1  TYR  45           HD1      TYR  45   6.458   6.222  -7.827
  346    HD2  TYR  45           HD2      TYR  45   5.021   4.141  -4.357
  347    HE1  TYR  45           HE1      TYR  45   8.714   6.362  -6.810
  348    HE2  TYR  45           HE2      TYR  45   7.278   4.278  -3.340
  349    HH   TYR  45           HH       TYR  45   9.616   6.333  -4.329
  350    H    ASP  46           HN       ASP  46   4.844   6.820  -4.219
  351    HA   ASP  46           HA       ASP  46   4.511   9.584  -5.319
  352   1HB   ASP  46          HB2       ASP  46   4.479   8.812  -2.378
  353   2HB   ASP  46          HB1       ASP  46   4.285  10.435  -3.032
  354    H    ASP  47           HN       ASP  47   6.492  10.492  -5.671
  355    HA   ASP  47           HA       ASP  47   8.947   9.122  -4.941
  356   1HB   ASP  47          HB2       ASP  47   8.579  10.454  -7.006
  357   2HB   ASP  47          HB1       ASP  47   8.437  11.912  -6.023
  358    H    ALA  48           HN       ALA  48   6.911  11.180  -3.148
  359    HA   ALA  48           HA       ALA  48   8.648  12.899  -1.728
  360   1HB   ALA  48          HB1       ALA  48   6.826  12.308   0.129
  361   2HB   ALA  48          HB2       ALA  48   6.057  11.476  -1.225
  362   3HB   ALA  48          HB3       ALA  48   6.379  13.209  -1.320
  363    H    THR  49           HN       THR  49   7.369   9.876  -0.333
  364    HA   THR  49           HA       THR  49  10.085   9.265   0.776
  365    HB   THR  49           HB       THR  49   8.681  10.452   2.441
  366    HG1  THR  49           HG1      THR  49   9.586   9.138   3.776
  367   1HG2  THR  49          HG21      THR  49   6.747   8.183   1.897
  368   2HG2  THR  49          HG22      THR  49   6.475   9.897   1.580
  369   3HG2  THR  49          HG23      THR  49   6.594   9.316   3.242
  370    H    LYS  50           HN       LYS  50   8.755   8.093  -1.512
  371    HA   LYS  50           HA       LYS  50   8.199   5.993  -2.402
  372   1HB   LYS  50          HB2       LYS  50   9.499   5.126   0.201
  373   2HB   LYS  50          HB1       LYS  50   9.227   4.083  -1.194
  374   1HG   LYS  50          HG2       LYS  50  10.621   5.624  -2.574
  375   2HG   LYS  50          HG1       LYS  50  10.962   6.568  -1.124
  376   1HD   LYS  50          HD2       LYS  50  12.447   5.041  -0.327
  377   2HD   LYS  50          HD1       LYS  50  11.449   3.673  -0.818
  378   1HE   LYS  50          HE2       LYS  50  13.101   3.368  -2.383
  379   2HE   LYS  50          HE1       LYS  50  12.242   4.651  -3.258
  380   1HZ   LYS  50          HZ1       LYS  50  13.606   6.298  -2.277
  381   2HZ   LYS  50          HZ2       LYS  50  14.663   5.095  -2.844
  382   3HZ   LYS  50          HZ3       LYS  50  14.296   5.196  -1.188
  383    H    THR  51           HN       THR  51   6.062   7.266  -1.171
  384    HA   THR  51           HA       THR  51   4.730   5.362   0.661
  385    HB   THR  51           HB       THR  51   3.368   7.721  -0.597
  386    HG1  THR  51           HG1      THR  51   4.941   8.976  -0.055
  387   1HG2  THR  51          HG21      THR  51   3.435   7.524   2.307
  388   2HG2  THR  51          HG22      THR  51   2.877   6.023   1.569
  389   3HG2  THR  51          HG23      THR  51   2.048   7.540   1.219
  390    H    TRP  52           HN       TRP  52   2.136   5.363  -0.145
  391    HA   TRP  52           HA       TRP  52   1.929   4.687  -3.016
  392   1HB   TRP  52          HB2       TRP  52   1.890   2.729  -0.727
  393   2HB   TRP  52          HB1       TRP  52   0.992   2.399  -2.202
  394    HD1  TRP  52           HD1      TRP  52   4.482   2.479  -0.795
  395    HE1  TRP  52           HE1      TRP  52   6.140   1.653  -2.595
  396    HE3  TRP  52           HE3      TRP  52   1.374   2.331  -4.795
  397    HZ2  TRP  52           HZ2      TRP  52   6.125   1.007  -5.394
  398    HZ3  TRP  52           HZ3      TRP  52   2.195   1.607  -7.029
  399    HH2  TRP  52           HH2      TRP  52   4.567   0.943  -7.329
  400    H    THR  53           HN       THR  53  -0.462   3.438  -3.090
  401    HA   THR  53           HA       THR  53  -2.390   4.629  -1.218
  402    HB   THR  53           HB       THR  53  -2.490   5.376  -4.152
  403    HG1  THR  53           HG1      THR  53  -0.758   6.465  -3.488
  404   1HG2  THR  53          HG21      THR  53  -4.031   6.072  -1.682
  405   2HG2  THR  53          HG22      THR  53  -4.620   5.728  -3.309
  406   3HG2  THR  53          HG23      THR  53  -3.871   7.285  -2.953
  407    H    VAL  54           HN       VAL  54  -4.694   4.021  -1.963
  408    HA   VAL  54           HA       VAL  54  -5.068   1.896  -3.903
  409    HB   VAL  54           HB       VAL  54  -3.813   0.595  -2.295
  410   1HG1  VAL  54          HG11      VAL  54  -5.121   0.543   0.103
  411   2HG1  VAL  54          HG12      VAL  54  -5.333   2.227  -0.371
  412   3HG1  VAL  54          HG13      VAL  54  -3.715   1.545  -0.244
  413   1HG2  VAL  54          HG21      VAL  54  -6.232  -0.203  -3.122
  414   2HG2  VAL  54          HG22      VAL  54  -6.564  -0.142  -1.391
  415   3HG2  VAL  54          HG23      VAL  54  -5.269  -1.175  -2.003
  416    H    THR  55           HN       THR  55  -6.859   3.281  -4.439
  417    HA   THR  55           HA       THR  55  -8.976   3.686  -2.389
  418    HB   THR  55           HB       THR  55  -8.880   4.617  -5.269
  419    HG1  THR  55           HG1      THR  55  -7.012   5.360  -4.405
  420   1HG2  THR  55          HG21      THR  55 -10.408   6.285  -4.563
  421   2HG2  THR  55          HG22      THR  55 -10.061   5.997  -2.858
  422   3HG2  THR  55          HG23      THR  55 -10.976   4.807  -3.784
  423    H    GLU  56           HN       GLU  56 -10.990   2.678  -2.541
  424    HA   GLU  56           HA       GLU  56 -11.207   0.308  -4.255
  425   1HB   GLU  56          HB2       GLU  56 -12.025   0.894  -1.780
  426   2HB   GLU  56          HB1       GLU  56 -13.471   1.420  -2.642
  427   1HG   GLU  56          HG2       GLU  56 -12.353  -1.210  -3.456
  428   2HG   GLU  56          HG1       GLU  56 -13.078  -1.140  -1.850
  Start of MODEL   22
    1   1H    THR   1          HT1       THR   1  14.165   7.541   4.336
    2   2H    THR   1          HT2       THR   1  14.025   6.063   5.162
    3   3H    THR   1          HT3       THR   1  12.647   7.015   4.879
    4    HA   THR   1           HA       THR   1  12.940   6.684   2.460
    5    HB   THR   1           HB       THR   1  15.030   4.691   3.373
    6    HG1  THR   1           HG1      THR   1  16.208   6.392   3.686
    7   1HG2  THR   1          HG21      THR   1  15.436   4.333   1.126
    8   2HG2  THR   1          HG22      THR   1  14.894   5.947   0.664
    9   3HG2  THR   1          HG23      THR   1  13.712   4.701   1.065
   10    H    THR   2           HN       THR   2  11.003   5.968   4.210
   11    HA   THR   2           HA       THR   2  10.737   2.989   4.009
   12    HB   THR   2           HB       THR   2   9.127   4.877   5.735
   13    HG1  THR   2           HG1      THR   2  11.110   5.313   6.444
   14   1HG2  THR   2          HG21      THR   2   8.369   2.526   5.468
   15   2HG2  THR   2          HG22      THR   2   8.862   2.880   7.124
   16   3HG2  THR   2          HG23      THR   2   9.936   1.974   6.058
   17    H    PHE   3           HN       PHE   3   8.977   2.153   2.888
   18    HA   PHE   3           HA       PHE   3   7.507   3.918   1.086
   19   1HB   PHE   3          HB2       PHE   3   7.258   0.960   1.743
   20   2HB   PHE   3          HB1       PHE   3   6.529   1.755   0.348
   21    HD1  PHE   3           HD1      PHE   3   8.488   3.491  -0.754
   22    HD2  PHE   3           HD2      PHE   3   9.094  -0.334   1.111
   23    HE1  PHE   3           HE1      PHE   3  10.603   3.208  -2.017
   24    HE2  PHE   3           HE2      PHE   3  11.208  -0.614  -0.152
   25    HZ   PHE   3           HZ       PHE   3  11.963   1.157  -1.715
   26    H    LYS   4           HN       LYS   4   5.095   3.941   1.011
   27    HA   LYS   4           HA       LYS   4   3.753   3.384   3.623
   28   1HB   LYS   4          HB2       LYS   4   4.674   5.764   3.391
   29   2HB   LYS   4          HB1       LYS   4   3.491   5.991   2.110
   30   1HG   LYS   4          HG2       LYS   4   1.664   5.469   3.639
   31   2HG   LYS   4          HG1       LYS   4   2.811   5.132   4.934
   32   1HD   LYS   4          HD2       LYS   4   3.275   7.353   5.293
   33   2HD   LYS   4          HD1       LYS   4   3.036   7.782   3.599
   34   1HE   LYS   4          HE2       LYS   4   1.066   8.677   4.369
   35   2HE   LYS   4          HE1       LYS   4   0.500   6.995   4.315
   36   1HZ   LYS   4          HZ1       LYS   4   0.169   7.909   6.521
   37   2HZ   LYS   4          HZ2       LYS   4   1.812   8.326   6.628
   38   3HZ   LYS   4          HZ3       LYS   4   1.349   6.692   6.572
   39    H    LEU   5           HN       LEU   5   1.431   3.223   3.420
   40    HA   LEU   5           HA       LEU   5   0.218   3.398   0.727
   41   1HB   LEU   5          HB2       LEU   5   1.371   1.064   1.332
   42   2HB   LEU   5          HB1       LEU   5  -0.128   0.822   2.221
   43    HG   LEU   5           HG       LEU   5  -0.646   1.922  -0.433
   44   1HD1  LEU   5          HD11      LEU   5   0.187   0.254  -1.840
   45   2HD1  LEU   5          HD12      LEU   5   0.407  -0.894  -0.509
   46   3HD1  LEU   5          HD13      LEU   5   1.523   0.463  -0.700
   47   1HD2  LEU   5          HD21      LEU   5  -2.475   0.955   0.648
   48   2HD2  LEU   5          HD22      LEU   5  -1.528  -0.406   1.250
   49   3HD2  LEU   5          HD23      LEU   5  -1.986  -0.336  -0.452
   50    H    ILE   6           HN       ILE   6  -1.890   4.061   0.949
   51    HA   ILE   6           HA       ILE   6  -3.033   4.142   3.708
   52    HB   ILE   6           HB       ILE   6  -3.569   5.670   1.146
   53   1HG1  ILE   6          HG12      ILE   6  -1.413   6.162   2.264
   54   2HG1  ILE   6          HG11      ILE   6  -2.511   7.538   2.346
   55   1HG2  ILE   6          HG21      ILE   6  -4.738   6.106   3.913
   56   2HG2  ILE   6          HG22      ILE   6  -5.619   5.464   2.526
   57   3HG2  ILE   6          HG23      ILE   6  -5.020   7.122   2.499
   58   1HD1  ILE   6          HD11      ILE   6  -2.201   7.536   4.580
   59   2HD1  ILE   6          HD12      ILE   6  -1.329   6.005   4.510
   60   3HD1  ILE   6          HD13      ILE   6  -3.087   6.013   4.636
   61    H    ILE   7           HN       ILE   7  -4.677   2.751   4.154
   62    HA   ILE   7           HA       ILE   7  -5.869   1.057   2.101
   63    HB   ILE   7           HB       ILE   7  -6.525   1.506   5.035
   64   1HG1  ILE   7          HG12      ILE   7  -4.871  -0.700   3.778
   65   2HG1  ILE   7          HG11      ILE   7  -4.156   0.768   4.446
   66   1HG2  ILE   7          HG21      ILE   7  -7.426  -0.493   2.980
   67   2HG2  ILE   7          HG22      ILE   7  -8.373   0.336   4.216
   68   3HG2  ILE   7          HG23      ILE   7  -7.295  -0.984   4.669
   69   1HD1  ILE   7          HD11      ILE   7  -4.072  -0.610   6.309
   70   2HD1  ILE   7          HD12      ILE   7  -5.539  -1.479   5.861
   71   3HD1  ILE   7          HD13      ILE   7  -5.650   0.142   6.546
   72    H    ASN   8           HN       ASN   8  -7.528   1.745   0.814
   73    HA   ASN   8           HA       ASN   8  -9.400   3.831   1.884
   74   1HB   ASN   8          HB2       ASN   8  -8.256   3.185  -0.831
   75   2HB   ASN   8          HB1       ASN   8  -9.743   4.123  -0.692
   76   1HD2  ASN   8          HD21      ASN   8  -8.563   6.033  -1.547
   77   2HD2  ASN   8          HD22      ASN   8  -7.504   6.906  -0.533
   78    H    GLY   9           HN       GLY   9 -10.019   1.309   2.684
   79   1HA   GLY   9          HA2       GLY   9 -11.793   0.014   0.723
   80   2HA   GLY   9          HA1       GLY   9 -11.478  -0.548   2.370
   81    H    LYS  10           HN       LYS  10 -14.067  -0.088   0.939
   82    HA   LYS  10           HA       LYS  10 -15.443   2.215   1.788
   83   1HB   LYS  10          HB2       LYS  10 -16.381  -0.650   1.457
   84   2HB   LYS  10          HB1       LYS  10 -17.449   0.753   1.509
   85   1HG   LYS  10          HG2       LYS  10 -15.801   1.623  -0.398
   86   2HG   LYS  10          HG1       LYS  10 -15.553  -0.107  -0.635
   87   1HD   LYS  10          HD2       LYS  10 -17.884  -0.480  -1.034
   88   2HD   LYS  10          HD1       LYS  10 -18.305   1.142  -0.482
   89   1HE   LYS  10          HE2       LYS  10 -18.282   1.609  -2.736
   90   2HE   LYS  10          HE1       LYS  10 -16.529   1.731  -2.481
   91   1HZ   LYS  10          HZ1       LYS  10 -17.936  -0.814  -3.082
   92   2HZ   LYS  10          HZ2       LYS  10 -16.258  -0.557  -3.023
   93   3HZ   LYS  10          HZ3       LYS  10 -17.184   0.140  -4.265
   94    H    THR  11           HN       THR  11 -14.688  -0.747   3.569
   95    HA   THR  11           HA       THR  11 -16.064   0.382   5.985
   96    HB   THR  11           HB       THR  11 -15.278  -2.468   5.292
   97    HG1  THR  11           HG1      THR  11 -17.776  -1.129   5.186
   98   1HG2  THR  11          HG21      THR  11 -15.436  -2.164   7.683
   99   2HG2  THR  11          HG22      THR  11 -16.900  -2.988   7.146
  100   3HG2  THR  11          HG23      THR  11 -16.943  -1.264   7.516
  101    H    LEU  12           HN       LEU  12 -13.054  -0.933   4.705
  102    HA   LEU  12           HA       LEU  12 -11.735  -0.608   7.370
  103   1HB   LEU  12          HB2       LEU  12 -10.977  -2.017   4.791
  104   2HB   LEU  12          HB1       LEU  12  -9.944  -1.960   6.219
  105    HG   LEU  12           HG       LEU  12 -12.753  -2.835   6.655
  106   1HD1  LEU  12          HD11      LEU  12 -11.670  -5.229   6.047
  107   2HD1  LEU  12          HD12      LEU  12 -10.826  -4.229   4.865
  108   3HD1  LEU  12          HD13      LEU  12 -12.589  -4.280   4.879
  109   1HD2  LEU  12          HD21      LEU  12 -10.562  -2.692   8.221
  110   2HD2  LEU  12          HD22      LEU  12 -10.353  -4.328   7.598
  111   3HD2  LEU  12          HD23      LEU  12 -11.823  -3.899   8.472
  112    H    LYS  13           HN       LYS  13  -9.723   0.594   7.467
  113    HA   LYS  13           HA       LYS  13  -8.740   2.091   5.160
  114   1HB   LYS  13          HB2       LYS  13 -10.993   3.077   6.373
  115   2HB   LYS  13          HB1       LYS  13  -9.727   3.921   7.265
  116   1HG   LYS  13          HG2       LYS  13  -8.773   4.787   5.212
  117   2HG   LYS  13          HG1       LYS  13  -9.879   3.815   4.240
  118   1HD   LYS  13          HD2       LYS  13 -10.802   6.027   4.298
  119   2HD   LYS  13          HD1       LYS  13 -11.785   5.049   5.389
  120   1HE   LYS  13          HE2       LYS  13 -11.380   6.810   6.827
  121   2HE   LYS  13          HE1       LYS  13  -9.876   5.916   7.126
  122   1HZ   LYS  13          HZ1       LYS  13  -8.871   7.126   5.254
  123   2HZ   LYS  13          HZ2       LYS  13  -9.349   8.172   6.504
  124   3HZ   LYS  13          HZ3       LYS  13 -10.287   8.046   5.093
  125    H    GLY  14           HN       GLY  14  -7.164   3.915   6.114
  126   1HA   GLY  14          HA2       GLY  14  -5.884   4.393   8.287
  127   2HA   GLY  14          HA1       GLY  14  -5.660   2.645   8.363
  128    H    GLU  15           HN       GLU  15  -3.323   3.676   8.380
  129    HA   GLU  15           HA       GLU  15  -2.346   3.751   5.541
  130   1HB   GLU  15          HB2       GLU  15  -0.619   5.329   6.400
  131   2HB   GLU  15          HB1       GLU  15  -2.251   5.947   6.648
  132   1HG   GLU  15          HG2       GLU  15  -2.220   5.256   8.977
  133   2HG   GLU  15          HG1       GLU  15  -0.664   4.455   8.758
  134    H    THR  16           HN       THR  16   0.028   3.064   5.413
  135    HA   THR  16           HA       THR  16   1.084   1.413   7.600
  136    HB   THR  16           HB       THR  16  -0.679  -0.023   6.670
  137    HG1  THR  16           HG1      THR  16   1.856  -0.888   5.755
  138   1HG2  THR  16          HG21      THR  16   0.735   0.568   4.061
  139   2HG2  THR  16          HG22      THR  16  -0.972   0.785   4.454
  140   3HG2  THR  16          HG23      THR  16  -0.313  -0.838   4.261
  141    H    THR  17           HN       THR  17   3.278   0.866   7.248
  142    HA   THR  17           HA       THR  17   4.481   1.692   4.629
  143    HB   THR  17           HB       THR  17   6.321   2.707   5.995
  144    HG1  THR  17           HG1      THR  17   6.194   2.707   8.130
  145   1HG2  THR  17          HG21      THR  17   3.493   3.703   6.375
  146   2HG2  THR  17          HG22      THR  17   4.676   4.231   5.178
  147   3HG2  THR  17          HG23      THR  17   4.903   4.633   6.880
  148    H    THR  18           HN       THR  18   6.556   0.620   4.209
  149    HA   THR  18           HA       THR  18   7.191  -1.681   5.979
  150    HB   THR  18           HB       THR  18   5.868  -1.691   3.363
  151    HG1  THR  18           HG1      THR  18   6.646  -3.801   5.093
  152   1HG2  THR  18          HG21      THR  18   8.380  -3.383   3.588
  153   2HG2  THR  18          HG22      THR  18   8.150  -2.026   2.485
  154   3HG2  THR  18          HG23      THR  18   7.168  -3.482   2.308
  155    H    GLU  19           HN       GLU  19   9.373  -2.622   5.324
  156    HA   GLU  19           HA       GLU  19  11.174  -0.487   4.221
  157   1HB   GLU  19          HB2       GLU  19  11.329  -0.869   6.677
  158   2HB   GLU  19          HB1       GLU  19  11.688  -2.570   6.373
  159   1HG   GLU  19          HG2       GLU  19  13.824  -2.137   5.672
  160   2HG   GLU  19          HG1       GLU  19  13.378  -0.603   4.924
  161    H    ALA  20           HN       ALA  20  11.991  -1.165   2.276
  162    HA   ALA  20           HA       ALA  20  13.027  -3.927   2.004
  163   1HB   ALA  20          HB1       ALA  20  11.598  -3.920  -0.235
  164   2HB   ALA  20          HB2       ALA  20  10.599  -2.780   0.669
  165   3HB   ALA  20          HB3       ALA  20  10.864  -4.410   1.292
  166    H    VAL  21           HN       VAL  21  13.593  -4.033  -0.618
  167    HA   VAL  21           HA       VAL  21  15.726  -2.099  -0.982
  168    HB   VAL  21           HB       VAL  21  15.694  -4.494  -1.735
  169   1HG1  VAL  21          HG11      VAL  21  13.900  -3.559  -3.971
  170   2HG1  VAL  21          HG12      VAL  21  13.297  -4.417  -2.553
  171   3HG1  VAL  21          HG13      VAL  21  14.442  -5.204  -3.640
  172   1HG2  VAL  21          HG21      VAL  21  16.022  -3.002  -4.268
  173   2HG2  VAL  21          HG22      VAL  21  17.165  -4.043  -3.422
  174   3HG2  VAL  21          HG23      VAL  21  16.927  -2.379  -2.890
  175    H    ASP  22           HN       ASP  22  12.532  -2.585  -2.380
  176    HA   ASP  22           HA       ASP  22  12.481   0.202  -3.384
  177   1HB   ASP  22          HB2       ASP  22  12.235  -2.335  -5.023
  178   2HB   ASP  22          HB1       ASP  22  11.855  -0.723  -5.652
  179    H    ALA  23           HN       ALA  23  10.264   0.859  -3.915
  180    HA   ALA  23           HA       ALA  23   8.242  -0.161  -2.174
  181   1HB   ALA  23          HB1       ALA  23   7.679   1.950  -2.835
  182   2HB   ALA  23          HB2       ALA  23   6.901   1.147  -4.199
  183   3HB   ALA  23          HB3       ALA  23   8.535   1.790  -4.368
  184    H    ALA  24           HN       ALA  24   9.179  -1.067  -5.439
  185    HA   ALA  24           HA       ALA  24   6.818  -2.444  -6.273
  186   1HB   ALA  24          HB1       ALA  24   9.674  -3.276  -6.844
  187   2HB   ALA  24          HB2       ALA  24   8.970  -1.820  -7.548
  188   3HB   ALA  24          HB3       ALA  24   8.276  -3.400  -7.912
  189    H    THR  25           HN       THR  25   9.697  -3.597  -4.503
  190    HA   THR  25           HA       THR  25   8.761  -6.311  -4.160
  191    HB   THR  25           HB       THR  25  10.824  -4.556  -2.787
  192    HG1  THR  25           HG1      THR  25  11.910  -5.140  -4.457
  193   1HG2  THR  25          HG21      THR  25  10.050  -6.340  -1.228
  194   2HG2  THR  25          HG22      THR  25  11.723  -6.580  -1.743
  195   3HG2  THR  25          HG23      THR  25  10.434  -7.548  -2.458
  196    H    ALA  26           HN       ALA  26   8.832  -3.472  -1.959
  197    HA   ALA  26           HA       ALA  26   7.557  -4.709   0.260
  198   1HB   ALA  26          HB1       ALA  26   6.894  -2.249   0.735
  199   2HB   ALA  26          HB2       ALA  26   7.713  -1.873  -0.787
  200   3HB   ALA  26          HB3       ALA  26   8.617  -2.593   0.545
  201    H    GLU  27           HN       GLU  27   6.091  -2.588  -2.223
  202    HA   GLU  27           HA       GLU  27   3.422  -2.639  -1.571
  203   1HB   GLU  27          HB2       GLU  27   4.502  -1.492  -3.495
  204   2HB   GLU  27          HB1       GLU  27   4.610  -3.038  -4.337
  205   1HG   GLU  27          HG2       GLU  27   2.039  -3.173  -3.927
  206   2HG   GLU  27          HG1       GLU  27   2.156  -1.435  -3.649
  207    H    LYS  28           HN       LYS  28   5.188  -5.347  -3.073
  208    HA   LYS  28           HA       LYS  28   2.896  -6.990  -3.683
  209   1HB   LYS  28          HB2       LYS  28   5.753  -7.702  -2.901
  210   2HB   LYS  28          HB1       LYS  28   4.615  -8.801  -3.680
  211   1HG   LYS  28          HG2       LYS  28   4.695  -7.666  -5.709
  212   2HG   LYS  28          HG1       LYS  28   5.179  -6.146  -4.955
  213   1HD   LYS  28          HD2       LYS  28   7.231  -6.757  -5.796
  214   2HD   LYS  28          HD1       LYS  28   7.307  -7.645  -4.274
  215   1HE   LYS  28          HE2       LYS  28   6.008  -9.480  -5.784
  216   2HE   LYS  28          HE1       LYS  28   6.969  -8.680  -7.042
  217   1HZ   LYS  28          HZ1       LYS  28   8.064  -9.590  -4.435
  218   2HZ   LYS  28          HZ2       LYS  28   8.942  -8.967  -5.750
  219   3HZ   LYS  28          HZ3       LYS  28   8.184 -10.482  -5.872
  220    H    VAL  29           HN       VAL  29   5.025  -6.733  -0.843
  221    HA   VAL  29           HA       VAL  29   3.644  -8.696   0.782
  222    HB   VAL  29           HB       VAL  29   5.552  -6.382   1.242
  223   1HG1  VAL  29          HG11      VAL  29   4.498  -8.263   3.382
  224   2HG1  VAL  29          HG12      VAL  29   4.109  -6.544   3.260
  225   3HG1  VAL  29          HG13      VAL  29   5.766  -7.055   3.598
  226   1HG2  VAL  29          HG21      VAL  29   5.773  -9.394   1.500
  227   2HG2  VAL  29          HG22      VAL  29   7.066  -8.260   1.889
  228   3HG2  VAL  29          HG23      VAL  29   6.480  -8.395   0.231
  229    H    LEU  30           HN       LEU  30   3.324  -5.184   0.280
  230    HA   LEU  30           HA       LEU  30   1.440  -4.721   2.391
  231   1HB   LEU  30          HB2       LEU  30   2.179  -3.362  -0.208
  232   2HB   LEU  30          HB1       LEU  30   0.912  -2.705   0.814
  233    HG   LEU  30           HG       LEU  30   3.392  -1.844   1.059
  234   1HD1  LEU  30          HD11      LEU  30   3.014  -1.510   3.525
  235   2HD1  LEU  30          HD12      LEU  30   1.581  -2.538   3.371
  236   3HD1  LEU  30          HD13      LEU  30   1.672  -1.012   2.488
  237   1HD2  LEU  30          HD21      LEU  30   3.474  -4.403   2.666
  238   2HD2  LEU  30          HD22      LEU  30   4.512  -3.033   2.994
  239   3HD2  LEU  30          HD23      LEU  30   4.607  -3.838   1.442
  240    H    LYS  31           HN       LYS  31   1.157  -5.856  -0.930
  241    HA   LYS  31           HA       LYS  31  -1.709  -5.679  -1.240
  242   1HB   LYS  31          HB2       LYS  31   0.332  -6.316  -2.857
  243   2HB   LYS  31          HB1       LYS  31  -0.043  -7.936  -2.323
  244   1HG   LYS  31          HG2       LYS  31  -2.194  -6.093  -3.369
  245   2HG   LYS  31          HG1       LYS  31  -1.239  -7.103  -4.453
  246   1HD   LYS  31          HD2       LYS  31  -2.930  -8.088  -2.132
  247   2HD   LYS  31          HD1       LYS  31  -3.321  -8.256  -3.842
  248   1HE   LYS  31          HE2       LYS  31  -0.706  -9.296  -3.571
  249   2HE   LYS  31          HE1       LYS  31  -1.633  -9.951  -2.201
  250   1HZ   LYS  31          HZ1       LYS  31  -3.447 -10.436  -3.825
  251   2HZ   LYS  31          HZ2       LYS  31  -2.040 -11.358  -4.068
  252   3HZ   LYS  31          HZ3       LYS  31  -2.378 -10.034  -5.079
  253    H    GLN  32           HN       GLN  32   0.492  -8.197  -0.054
  254    HA   GLN  32           HA       GLN  32  -1.359 -10.257   0.538
  255   1HB   GLN  32          HB2       GLN  32   1.322  -9.363   1.453
  256   2HB   GLN  32          HB1       GLN  32   0.478 -10.525   2.477
  257   1HG   GLN  32          HG2       GLN  32   0.331 -12.128   0.733
  258   2HG   GLN  32          HG1       GLN  32   0.746 -10.936  -0.499
  259   1HE2  GLN  32          HE21      GLN  32   3.011 -10.269  -0.672
  260   2HE2  GLN  32          HE22      GLN  32   4.255 -11.180   0.059
  261    H    TYR  33           HN       TYR  33  -0.373  -7.420   2.440
  262    HA   TYR  33           HA       TYR  33  -1.884  -8.006   4.834
  263   1HB   TYR  33          HB2       TYR  33  -0.070  -6.362   4.731
  264   2HB   TYR  33          HB1       TYR  33  -0.950  -5.419   3.528
  265    HD1  TYR  33           HD1      TYR  33  -1.039  -6.644   7.022
  266    HD2  TYR  33           HD2      TYR  33  -2.618  -3.850   4.175
  267    HE1  TYR  33           HE1      TYR  33  -2.211  -5.462   8.844
  268    HE2  TYR  33           HE2      TYR  33  -3.790  -2.654   6.002
  269    HH   TYR  33           HH       TYR  33  -3.198  -2.555   8.816
  270    H    ILE  34           HN       ILE  34  -2.595  -6.244   1.837
  271    HA   ILE  34           HA       ILE  34  -5.243  -5.341   2.532
  272    HB   ILE  34           HB       ILE  34  -3.899  -5.971  -0.115
  273   1HG1  ILE  34          HG12      ILE  34  -2.833  -4.287   1.529
  274   2HG1  ILE  34          HG11      ILE  34  -3.098  -3.744  -0.123
  275   1HG2  ILE  34          HG21      ILE  34  -6.372  -4.326   0.481
  276   2HG2  ILE  34          HG22      ILE  34  -6.303  -5.827  -0.442
  277   3HG2  ILE  34          HG23      ILE  34  -5.549  -4.366  -1.079
  278   1HD1  ILE  34          HD11      ILE  34  -3.811  -2.217   1.903
  279   2HD1  ILE  34          HD12      ILE  34  -5.224  -3.273   1.947
  280   3HD1  ILE  34          HD13      ILE  34  -4.861  -2.347   0.490
  281    H    ASN  35           HN       ASN  35  -3.940  -8.363   1.283
  282    HA   ASN  35           HA       ASN  35  -6.285  -9.576   0.234
  283   1HB   ASN  35          HB2       ASN  35  -3.854 -10.324   0.140
  284   2HB   ASN  35          HB1       ASN  35  -4.060 -10.930   1.784
  285   1HD2  ASN  35          HD21      ASN  35  -5.854 -11.119  -1.355
  286   2HD2  ASN  35          HD22      ASN  35  -6.221 -12.770  -1.207
  287    H    ASP  36           HN       ASP  36  -5.184  -9.163   3.559
  288    HA   ASP  36           HA       ASP  36  -7.143 -11.001   4.719
  289   1HB   ASP  36          HB2       ASP  36  -4.801 -10.156   5.554
  290   2HB   ASP  36          HB1       ASP  36  -5.718  -8.781   6.172
  291    H    ASN  37           HN       ASN  37  -6.808  -7.451   4.466
  292    HA   ASN  37           HA       ASN  37  -9.267  -6.820   5.841
  293   1HB   ASN  37          HB2       ASN  37  -7.592  -5.317   3.799
  294   2HB   ASN  37          HB1       ASN  37  -8.862  -4.585   4.786
  295   1HD2  ASN  37          HD21      ASN  37  -7.686  -3.315   6.264
  296   2HD2  ASN  37          HD22      ASN  37  -6.446  -3.919   7.267
  297    H    GLY  38           HN       GLY  38  -8.478  -7.628   2.507
  298   1HA   GLY  38          HA2       GLY  38  -9.966  -8.323   0.799
  299   2HA   GLY  38          HA1       GLY  38 -11.317  -7.972   1.877
  300    H    ILE  39           HN       ILE  39  -8.756  -5.667   1.135
  301    HA   ILE  39           HA       ILE  39 -10.790  -3.984  -0.296
  302    HB   ILE  39           HB       ILE  39  -8.402  -3.199   1.412
  303   1HG1  ILE  39          HG12      ILE  39 -10.223  -4.191   2.747
  304   2HG1  ILE  39          HG11      ILE  39 -10.112  -2.454   3.044
  305   1HG2  ILE  39          HG21      ILE  39  -8.899  -1.537  -0.324
  306   2HG2  ILE  39          HG22      ILE  39  -9.369  -0.919   1.259
  307   3HG2  ILE  39          HG23      ILE  39 -10.597  -1.528   0.150
  308   1HD1  ILE  39          HD11      ILE  39 -11.867  -2.589   0.907
  309   2HD1  ILE  39          HD12      ILE  39 -12.335  -2.409   2.598
  310   3HD1  ILE  39          HD13      ILE  39 -12.304  -4.009   1.858
  311    H    ASP  40           HN       ASP  40  -9.926  -5.252  -2.242
  312    HA   ASP  40           HA       ASP  40  -7.344  -4.075  -3.224
  313   1HB   ASP  40          HB2       ASP  40  -7.765  -6.647  -2.736
  314   2HB   ASP  40          HB1       ASP  40  -8.575  -6.592  -4.306
  315    H    GLY  41           HN       GLY  41  -8.033  -2.359  -4.505
  316   1HA   GLY  41          HA2       GLY  41  -9.900  -3.033  -6.732
  317   2HA   GLY  41          HA1       GLY  41 -10.171  -1.567  -5.784
  318    H    GLU  42           HN       GLU  42  -8.592   0.150  -5.929
  319    HA   GLU  42           HA       GLU  42  -6.720  -0.085  -8.262
  320   1HB   GLU  42          HB2       GLU  42  -9.065   1.581  -7.820
  321   2HB   GLU  42          HB1       GLU  42  -7.636   2.583  -8.065
  322   1HG   GLU  42          HG2       GLU  42  -8.027   2.258 -10.276
  323   2HG   GLU  42          HG1       GLU  42  -7.305   0.671 -10.013
  324    H    TRP  43           HN       TRP  43  -4.662   0.300  -7.585
  325    HA   TRP  43           HA       TRP  43  -4.198   1.860  -5.084
  326   1HB   TRP  43          HB2       TRP  43  -2.492   0.057  -6.831
  327   2HB   TRP  43          HB1       TRP  43  -1.857   0.935  -5.453
  328    HD1  TRP  43           HD1      TRP  43  -5.330  -0.715  -5.307
  329    HE1  TRP  43           HE1      TRP  43  -5.223  -2.655  -3.630
  330    HE3  TRP  43           HE3      TRP  43  -0.347  -0.706  -4.296
  331    HZ2  TRP  43           HZ2      TRP  43  -3.286  -4.000  -2.026
  332    HZ3  TRP  43           HZ3      TRP  43   0.607  -2.318  -2.662
  333    HH2  TRP  43           HH2      TRP  43  -0.850  -3.957  -1.532
  334    H    THR  44           HN       THR  44  -2.369   3.449  -5.162
  335    HA   THR  44           HA       THR  44  -1.660   4.506  -7.839
  336    HB   THR  44           HB       THR  44  -2.443   6.758  -7.238
  337    HG1  THR  44           HG1      THR  44  -3.792   6.881  -5.326
  338   1HG2  THR  44          HG21      THR  44  -4.726   4.851  -6.718
  339   2HG2  THR  44          HG22      THR  44  -3.979   4.997  -8.309
  340   3HG2  THR  44          HG23      THR  44  -4.764   6.394  -7.572
  341    H    TYR  45           HN       TYR  45   0.448   5.114  -7.792
  342    HA   TYR  45           HA       TYR  45   1.860   5.177  -5.185
  343   1HB   TYR  45          HB2       TYR  45   2.677   3.800  -7.064
  344   2HB   TYR  45          HB1       TYR  45   2.792   5.236  -8.079
  345    HD1  TYR  45           HD1      TYR  45   4.969   5.978  -8.377
  346    HD2  TYR  45           HD2      TYR  45   3.821   4.349  -4.573
  347    HE1  TYR  45           HE1      TYR  45   7.243   6.429  -7.499
  348    HE2  TYR  45           HE2      TYR  45   6.097   4.796  -3.695
  349    HH   TYR  45           HH       TYR  45   8.190   6.842  -4.976
  350    H    ASP  46           HN       ASP  46   3.429   6.981  -4.791
  351    HA   ASP  46           HA       ASP  46   2.806   9.519  -6.247
  352   1HB   ASP  46          HB2       ASP  46   2.912   9.188  -3.227
  353   2HB   ASP  46          HB1       ASP  46   2.543  10.669  -4.103
  354    H    ASP  47           HN       ASP  47   4.699  10.484  -6.832
  355    HA   ASP  47           HA       ASP  47   7.280   9.482  -5.972
  356   1HB   ASP  47          HB2       ASP  47   6.765  10.438  -8.202
  357   2HB   ASP  47          HB1       ASP  47   6.481  12.010  -7.453
  358    H    ALA  48           HN       ALA  48   5.094  11.647  -4.484
  359    HA   ALA  48           HA       ALA  48   6.692  13.691  -3.378
  360   1HB   ALA  48          HB1       ALA  48   4.250  12.140  -2.579
  361   2HB   ALA  48          HB2       ALA  48   4.403  13.854  -2.974
  362   3HB   ALA  48          HB3       ALA  48   4.955  13.258  -1.408
  363    H    THR  49           HN       THR  49   5.711  10.806  -1.522
  364    HA   THR  49           HA       THR  49   8.476  10.638  -0.377
  365    HB   THR  49           HB       THR  49   6.988  11.877   1.147
  366    HG1  THR  49           HG1      THR  49   8.184  10.751   2.459
  367   1HG2  THR  49          HG21      THR  49   4.797  11.385   1.267
  368   2HG2  THR  49          HG22      THR  49   5.183   9.796   1.926
  369   3HG2  THR  49          HG23      THR  49   5.048  10.017   0.181
  370    H    LYS  50           HN       LYS  50   7.205   9.050  -2.467
  371    HA   LYS  50           HA       LYS  50   6.885   6.805  -3.074
  372   1HB   LYS  50          HB2       LYS  50   8.396   6.432  -0.468
  373   2HB   LYS  50          HB1       LYS  50   8.217   5.210  -1.725
  374   1HG   LYS  50          HG2       LYS  50   9.335   6.743  -3.337
  375   2HG   LYS  50          HG1       LYS  50   9.587   7.898  -2.028
  376   1HD   LYS  50          HD2       LYS  50  11.285   6.687  -1.111
  377   2HD   LYS  50          HD1       LYS  50  10.491   5.145  -1.434
  378   1HE   LYS  50          HE2       LYS  50  12.092   4.902  -3.048
  379   2HE   LYS  50          HE1       LYS  50  11.100   6.037  -3.985
  380   1HZ   LYS  50          HZ1       LYS  50  12.279   7.866  -2.845
  381   2HZ   LYS  50          HZ2       LYS  50  13.310   6.922  -3.810
  382   3HZ   LYS  50          HZ3       LYS  50  13.309   6.729  -2.122
  383    H    THR  51           HN       THR  51   4.624   7.898  -1.876
  384    HA   THR  51           HA       THR  51   3.682   5.946   0.164
  385    HB   THR  51           HB       THR  51   2.461   8.446  -1.068
  386    HG1  THR  51           HG1      THR  51   3.011   9.320   0.966
  387   1HG2  THR  51          HG21      THR  51   1.023   8.230   1.092
  388   2HG2  THR  51          HG22      THR  51   1.515   6.536   1.060
  389   3HG2  THR  51          HG23      THR  51   0.612   7.218  -0.293
  390    H    TRP  52           HN       TRP  52   1.404   5.046  -0.260
  391    HA   TRP  52           HA       TRP  52   0.932   4.516  -3.173
  392   1HB   TRP  52          HB2       TRP  52   1.283   2.646  -0.837
  393   2HB   TRP  52          HB1       TRP  52   0.373   2.153  -2.258
  394    HD1  TRP  52           HD1      TRP  52   3.888   2.794  -1.044
  395    HE1  TRP  52           HE1      TRP  52   5.552   2.126  -2.903
  396    HE3  TRP  52           HE3      TRP  52   0.629   1.996  -4.838
  397    HZ2  TRP  52           HZ2      TRP  52   5.484   1.342  -5.666
  398    HZ3  TRP  52           HZ3      TRP  52   1.426   1.285  -7.085
  399    HH2  TRP  52           HH2      TRP  52   3.852   0.956  -7.499
  400    H    THR  53           HN       THR  53  -1.257   2.965  -3.065
  401    HA   THR  53           HA       THR  53  -3.225   3.939  -1.106
  402    HB   THR  53           HB       THR  53  -3.624   4.531  -4.048
  403    HG1  THR  53           HG1      THR  53  -3.090   6.711  -3.383
  404   1HG2  THR  53          HG21      THR  53  -5.160   6.294  -2.867
  405   2HG2  THR  53          HG22      THR  53  -5.018   5.215  -1.479
  406   3HG2  THR  53          HG23      THR  53  -5.702   4.620  -2.992
  407    H    VAL  54           HN       VAL  54  -5.465   2.985  -1.730
  408    HA   VAL  54           HA       VAL  54  -5.597   0.743  -3.567
  409    HB   VAL  54           HB       VAL  54  -4.125  -0.323  -1.984
  410   1HG1  VAL  54          HG11      VAL  54  -4.574  -0.378   0.424
  411   2HG1  VAL  54          HG12      VAL  54  -6.021   0.598   0.183
  412   3HG1  VAL  54          HG13      VAL  54  -4.432   1.282  -0.147
  413   1HG2  VAL  54          HG21      VAL  54  -6.449  -1.472  -2.615
  414   2HG2  VAL  54          HG22      VAL  54  -6.715  -1.332  -0.878
  415   3HG2  VAL  54          HG23      VAL  54  -5.324  -2.237  -1.486
  416    H    THR  55           HN       THR  55  -7.520   2.095  -3.990
  417    HA   THR  55           HA       THR  55  -9.626   2.241  -1.933
  418    HB   THR  55           HB       THR  55  -9.812   2.920  -4.874
  419    HG1  THR  55           HG1      THR  55  -8.445   4.470  -4.579
  420   1HG2  THR  55          HG21      THR  55 -11.054   4.055  -2.352
  421   2HG2  THR  55          HG22      THR  55 -11.875   3.104  -3.590
  422   3HG2  THR  55          HG23      THR  55 -11.283   4.721  -3.969
  423    H    GLU  56           HN       GLU  56 -11.377   0.863  -1.816
  424    HA   GLU  56           HA       GLU  56 -11.385  -1.684  -3.108
  425   1HB   GLU  56          HB2       GLU  56 -12.628  -0.555  -0.996
  426   2HB   GLU  56          HB1       GLU  56 -13.944  -0.475  -2.168
  427   1HG   GLU  56          HG2       GLU  56 -12.375  -3.017  -1.722
  428   2HG   GLU  56          HG1       GLU  56 -13.782  -2.613  -0.738
  Start of MODEL   23
    1   1H    THR   1          HT1       THR   1  15.176   3.709   4.052
    2   2H    THR   1          HT2       THR   1  15.979   4.254   2.658
    3   3H    THR   1          HT3       THR   1  15.313   2.692   2.702
    4    HA   THR   1           HA       THR   1  13.722   5.203   2.859
    5    HB   THR   1           HB       THR   1  13.131   4.369   0.484
    6    HG1  THR   1           HG1      THR   1  14.076   2.333   0.670
    7   1HG2  THR   1          HG21      THR   1  14.895   5.641  -0.465
    8   2HG2  THR   1          HG22      THR   1  16.009   5.210   0.832
    9   3HG2  THR   1          HG23      THR   1  14.671   6.314   1.150
   10    H    THR   2           HN       THR   2  12.146   4.483   4.309
   11    HA   THR   2           HA       THR   2  11.103   1.738   4.220
   12    HB   THR   2           HB       THR   2  10.095   4.182   5.707
   13    HG1  THR   2           HG1      THR   2  11.865   4.070   6.794
   14   1HG2  THR   2          HG21      THR   2   8.518   2.555   6.133
   15   2HG2  THR   2          HG22      THR   2   9.698   2.136   7.375
   16   3HG2  THR   2          HG23      THR   2   9.654   1.234   5.860
   17    H    PHE   3           HN       PHE   3   9.435   1.112   2.918
   18    HA   PHE   3           HA       PHE   3   8.065   2.983   1.166
   19   1HB   PHE   3          HB2       PHE   3   7.569   0.063   1.849
   20   2HB   PHE   3          HB1       PHE   3   6.883   0.911   0.463
   21    HD1  PHE   3           HD1      PHE   3   8.970   2.468  -0.681
   22    HD2  PHE   3           HD2      PHE   3   9.264  -1.397   1.178
   23    HE1  PHE   3           HE1      PHE   3  11.026   1.996  -1.984
   24    HE2  PHE   3           HE2      PHE   3  11.320  -1.865  -0.126
   25    HZ   PHE   3           HZ       PHE   3  12.201  -0.169  -1.706
   26    H    LYS   4           HN       LYS   4   5.751   3.414   1.180
   27    HA   LYS   4           HA       LYS   4   4.333   2.879   3.762
   28   1HB   LYS   4          HB2       LYS   4   5.527   5.130   3.667
   29   2HB   LYS   4          HB1       LYS   4   4.439   5.559   2.354
   30   1HG   LYS   4          HG2       LYS   4   2.496   5.166   3.813
   31   2HG   LYS   4          HG1       LYS   4   3.575   4.732   5.137
   32   1HD   LYS   4          HD2       LYS   4   4.140   6.897   5.565
   33   2HD   LYS   4          HD1       LYS   4   4.170   7.329   3.856
   34   1HE   LYS   4          HE2       LYS   4   2.000   8.042   3.881
   35   2HE   LYS   4          HE1       LYS   4   1.475   6.689   4.903
   36   1HZ   LYS   4          HZ1       LYS   4   3.096   8.992   5.852
   37   2HZ   LYS   4          HZ2       LYS   4   2.483   7.726   6.805
   38   3HZ   LYS   4          HZ3       LYS   4   1.423   8.840   6.083
   39    H    LEU   5           HN       LEU   5   1.994   3.067   3.552
   40    HA   LEU   5           HA       LEU   5   0.820   3.510   0.883
   41   1HB   LEU   5          HB2       LEU   5   1.736   1.032   1.321
   42   2HB   LEU   5          HB1       LEU   5   0.207   0.878   2.176
   43    HG   LEU   5           HG       LEU   5  -0.136   2.212  -0.404
   44   1HD1  LEU   5          HD11      LEU   5   1.848   0.526  -0.740
   45   2HD1  LEU   5          HD12      LEU   5   0.516   0.541  -1.902
   46   3HD1  LEU   5          HD13      LEU   5   0.580  -0.701  -0.638
   47   1HD2  LEU   5          HD21      LEU   5  -1.976   1.295   0.934
   48   2HD2  LEU   5          HD22      LEU   5  -1.273  -0.320   0.824
   49   3HD2  LEU   5          HD23      LEU   5  -1.894   0.473  -0.624
   50    H    ILE   6           HN       ILE   6  -1.238   4.321   1.147
   51    HA   ILE   6           HA       ILE   6  -2.384   4.301   3.910
   52    HB   ILE   6           HB       ILE   6  -2.742   6.091   1.490
   53   1HG1  ILE   6          HG12      ILE   6  -0.559   6.275   2.645
   54   2HG1  ILE   6          HG11      ILE   6  -1.522   7.737   2.853
   55   1HG2  ILE   6          HG21      ILE   6  -4.812   6.262   2.600
   56   2HG2  ILE   6          HG22      ILE   6  -3.873   7.583   3.296
   57   3HG2  ILE   6          HG23      ILE   6  -4.076   6.079   4.193
   58   1HD1  ILE   6          HD11      ILE   6  -0.521   5.889   4.866
   59   2HD1  ILE   6          HD12      ILE   6  -2.267   6.095   4.999
   60   3HD1  ILE   6          HD13      ILE   6  -1.205   7.501   5.075
   61    H    ILE   7           HN       ILE   7  -4.318   3.277   4.255
   62    HA   ILE   7           HA       ILE   7  -5.592   1.808   2.044
   63    HB   ILE   7           HB       ILE   7  -6.223   2.041   5.007
   64   1HG1  ILE   7          HG12      ILE   7  -4.768  -0.189   3.561
   65   2HG1  ILE   7          HG11      ILE   7  -3.923   1.145   4.347
   66   1HG2  ILE   7          HG21      ILE   7  -7.228   0.257   2.792
   67   2HG2  ILE   7          HG22      ILE   7  -8.160   1.155   3.990
   68   3HG2  ILE   7          HG23      ILE   7  -7.256  -0.280   4.472
   69   1HD1  ILE   7          HD11      ILE   7  -3.977  -0.326   6.119
   70   2HD1  ILE   7          HD12      ILE   7  -5.458  -1.105   5.562
   71   3HD1  ILE   7          HD13      ILE   7  -5.535   0.460   6.372
   72    H    ASN   8           HN       ASN   8  -7.067   2.883   0.794
   73    HA   ASN   8           HA       ASN   8  -8.760   5.003   2.065
   74   1HB   ASN   8          HB2       ASN   8  -7.659   4.468  -0.686
   75   2HB   ASN   8          HB1       ASN   8  -9.077   5.499  -0.499
   76   1HD2  ASN   8          HD21      ASN   8  -7.235   7.043  -1.454
   77   2HD2  ASN   8          HD22      ASN   8  -6.348   7.911  -0.284
   78    H    GLY   9           HN       GLY   9  -9.666   2.522   2.681
   79   1HA   GLY   9          HA2       GLY   9 -11.502   1.494   0.643
   80   2HA   GLY   9          HA1       GLY   9 -11.359   0.907   2.304
   81    H    LYS  10           HN       LYS  10 -13.838   1.482   0.916
   82    HA   LYS  10           HA       LYS  10 -15.020   3.970   1.487
   83   1HB   LYS  10          HB2       LYS  10 -16.156   1.159   1.471
   84   2HB   LYS  10          HB1       LYS  10 -17.142   2.622   1.426
   85   1HG   LYS  10          HG2       LYS  10 -15.930   3.322  -0.646
   86   2HG   LYS  10          HG1       LYS  10 -15.074   1.780  -0.626
   87   1HD   LYS  10          HD2       LYS  10 -17.059   0.543  -1.008
   88   2HD   LYS  10          HD1       LYS  10 -18.089   1.910  -0.581
   89   1HE   LYS  10          HE2       LYS  10 -16.695   3.008  -2.642
   90   2HE   LYS  10          HE1       LYS  10 -16.737   1.308  -3.153
   91   1HZ   LYS  10          HZ1       LYS  10 -18.744   2.532  -3.835
   92   2HZ   LYS  10          HZ2       LYS  10 -19.091   2.856  -2.204
   93   3HZ   LYS  10          HZ3       LYS  10 -19.102   1.256  -2.777
   94    H    THR  11           HN       THR  11 -14.349   1.257   3.622
   95    HA   THR  11           HA       THR  11 -15.468   2.838   5.914
   96    HB   THR  11           HB       THR  11 -15.450  -0.177   5.698
   97    HG1  THR  11           HG1      THR  11 -17.647   0.096   5.018
   98   1HG2  THR  11          HG21      THR  11 -15.807   1.076   7.902
   99   2HG2  THR  11          HG22      THR  11 -17.058  -0.082   7.449
  100   3HG2  THR  11          HG23      THR  11 -17.326   1.644   7.209
  101    H    LEU  12           HN       LEU  12 -13.163   0.302   4.910
  102    HA   LEU  12           HA       LEU  12 -11.642   0.536   7.430
  103   1HB   LEU  12          HB2       LEU  12 -11.251  -1.042   4.865
  104   2HB   LEU  12          HB1       LEU  12 -10.293  -1.255   6.331
  105    HG   LEU  12           HG       LEU  12 -13.281  -1.401   6.524
  106   1HD1  LEU  12          HD11      LEU  12 -13.261  -3.762   5.958
  107   2HD1  LEU  12          HD12      LEU  12 -11.516  -3.728   5.707
  108   3HD1  LEU  12          HD13      LEU  12 -12.582  -2.862   4.602
  109   1HD2  LEU  12          HD21      LEU  12 -10.953  -2.754   7.926
  110   2HD2  LEU  12          HD22      LEU  12 -12.652  -3.045   8.302
  111   3HD2  LEU  12          HD23      LEU  12 -11.949  -1.450   8.572
  112    H    LYS  13           HN       LYS  13  -9.818   1.785   7.659
  113    HA   LYS  13           HA       LYS  13  -8.370   2.742   5.236
  114   1HB   LYS  13          HB2       LYS  13  -9.717   4.417   7.371
  115   2HB   LYS  13          HB1       LYS  13  -8.486   5.069   6.290
  116   1HG   LYS  13          HG2       LYS  13 -10.298   5.549   4.978
  117   2HG   LYS  13          HG1       LYS  13 -10.098   3.870   4.474
  118   1HD   LYS  13          HD2       LYS  13 -12.300   3.733   5.093
  119   2HD   LYS  13          HD1       LYS  13 -11.595   3.493   6.692
  120   1HE   LYS  13          HE2       LYS  13 -11.632   6.178   6.693
  121   2HE   LYS  13          HE1       LYS  13 -12.989   5.890   5.586
  122   1HZ   LYS  13          HZ1       LYS  13 -13.901   4.310   7.183
  123   2HZ   LYS  13          HZ2       LYS  13 -13.745   5.852   7.881
  124   3HZ   LYS  13          HZ3       LYS  13 -12.625   4.630   8.254
  125    H    GLY  14           HN       GLY  14  -6.558   4.404   6.363
  126   1HA   GLY  14          HA2       GLY  14  -5.229   4.471   8.556
  127   2HA   GLY  14          HA1       GLY  14  -5.231   2.711   8.439
  128    H    GLU  15           HN       GLU  15  -2.779   3.523   8.554
  129    HA   GLU  15           HA       GLU  15  -1.791   3.715   5.725
  130   1HB   GLU  15          HB2       GLU  15   0.097   5.016   6.705
  131   2HB   GLU  15          HB1       GLU  15  -1.458   5.788   7.005
  132   1HG   GLU  15          HG2       GLU  15  -1.520   4.900   9.270
  133   2HG   GLU  15          HG1       GLU  15  -0.049   3.970   8.982
  134    H    THR  16           HN       THR  16   0.483   2.776   5.515
  135    HA   THR  16           HA       THR  16   1.349   0.847   7.555
  136    HB   THR  16           HB       THR  16  -0.555  -0.307   6.516
  137    HG1  THR  16           HG1      THR  16   1.877  -1.357   5.517
  138   1HG2  THR  16          HG21      THR  16   0.939   0.290   3.948
  139   2HG2  THR  16          HG22      THR  16  -0.708   0.760   4.377
  140   3HG2  THR  16          HG23      THR  16  -0.329  -0.933   4.060
  141    H    THR  17           HN       THR  17   3.481   0.148   7.177
  142    HA   THR  17           HA       THR  17   4.772   1.016   4.615
  143    HB   THR  17           HB       THR  17   6.720   1.682   6.107
  144    HG1  THR  17           HG1      THR  17   4.729   1.538   8.117
  145   1HG2  THR  17          HG21      THR  17   4.053   3.036   6.061
  146   2HG2  THR  17          HG22      THR  17   5.578   3.542   5.336
  147   3HG2  THR  17          HG23      THR  17   5.326   3.719   7.072
  148    H    THR  18           HN       THR  18   6.734  -0.230   4.119
  149    HA   THR  18           HA       THR  18   7.146  -2.687   5.732
  150    HB   THR  18           HB       THR  18   5.773  -2.401   3.154
  151    HG1  THR  18           HG1      THR  18   4.868  -3.662   4.645
  152   1HG2  THR  18          HG21      THR  18   6.829  -4.253   1.966
  153   2HG2  THR  18          HG22      THR  18   8.046  -4.412   3.234
  154   3HG2  THR  18          HG23      THR  18   8.002  -2.961   2.230
  155    H    GLU  19           HN       GLU  19   9.224  -3.752   5.129
  156    HA   GLU  19           HA       GLU  19  11.197  -1.817   3.955
  157   1HB   GLU  19          HB2       GLU  19  11.259  -2.313   6.453
  158   2HB   GLU  19          HB1       GLU  19  11.676  -3.974   6.032
  159   1HG   GLU  19          HG2       GLU  19  13.478  -2.641   4.504
  160   2HG   GLU  19          HG1       GLU  19  13.317  -1.508   5.847
  161    H    ALA  20           HN       ALA  20  11.844  -2.586   1.975
  162    HA   ALA  20           HA       ALA  20  12.579  -5.454   1.711
  163   1HB   ALA  20          HB1       ALA  20  10.251  -4.050   0.517
  164   2HB   ALA  20          HB2       ALA  20  10.457  -5.761   0.898
  165   3HB   ALA  20          HB3       ALA  20  11.157  -5.096  -0.578
  166    H    VAL  21           HN       VAL  21  13.261  -5.691  -0.813
  167    HA   VAL  21           HA       VAL  21  15.602  -4.086  -1.202
  168    HB   VAL  21           HB       VAL  21  15.194  -6.376  -2.090
  169   1HG1  VAL  21          HG11      VAL  21  12.776  -5.870  -2.740
  170   2HG1  VAL  21          HG12      VAL  21  13.713  -6.826  -3.889
  171   3HG1  VAL  21          HG13      VAL  21  13.441  -5.109  -4.186
  172   1HG2  VAL  21          HG21      VAL  21  15.809  -5.660  -4.600
  173   2HG2  VAL  21          HG22      VAL  21  16.959  -5.505  -3.272
  174   3HG2  VAL  21          HG23      VAL  21  16.035  -4.101  -3.807
  175    H    ASP  22           HN       ASP  22  12.355  -3.932  -2.562
  176    HA   ASP  22           HA       ASP  22  12.773  -1.126  -3.407
  177   1HB   ASP  22          HB2       ASP  22  12.119  -3.485  -5.197
  178   2HB   ASP  22          HB1       ASP  22  12.016  -1.798  -5.726
  179    H    ALA  23           HN       ALA  23  10.671  -0.123  -3.992
  180    HA   ALA  23           HA       ALA  23   8.518  -0.860  -2.255
  181   1HB   ALA  23          HB1       ALA  23   9.129   1.098  -4.367
  182   2HB   ALA  23          HB2       ALA  23   8.261   1.326  -2.848
  183   3HB   ALA  23          HB3       ALA  23   7.414   0.698  -4.262
  184    H    ALA  24           HN       ALA  24   9.232  -1.684  -5.617
  185    HA   ALA  24           HA       ALA  24   6.722  -2.690  -6.468
  186   1HB   ALA  24          HB1       ALA  24   9.237  -4.153  -7.154
  187   2HB   ALA  24          HB2       ALA  24   9.167  -2.434  -7.542
  188   3HB   ALA  24          HB3       ALA  24   7.974  -3.541  -8.222
  189    H    THR  25           HN       THR  25   9.382  -4.421  -4.819
  190    HA   THR  25           HA       THR  25   8.009  -6.938  -4.575
  191    HB   THR  25           HB       THR  25  10.308  -5.604  -3.108
  192    HG1  THR  25           HG1      THR  25  10.127  -7.642  -5.066
  193   1HG2  THR  25          HG21      THR  25   9.241  -7.308  -1.638
  194   2HG2  THR  25          HG22      THR  25  10.858  -7.793  -2.158
  195   3HG2  THR  25          HG23      THR  25   9.436  -8.505  -2.922
  196    H    ALA  26           HN       ALA  26   8.469  -4.229  -2.263
  197    HA   ALA  26           HA       ALA  26   7.033  -5.353  -0.087
  198   1HB   ALA  26          HB1       ALA  26   7.536  -2.522  -1.037
  199   2HB   ALA  26          HB2       ALA  26   8.381  -3.404   0.235
  200   3HB   ALA  26          HB3       ALA  26   6.719  -2.861   0.493
  201    H    GLU  27           HN       GLU  27   5.831  -2.882  -2.384
  202    HA   GLU  27           HA       GLU  27   3.186  -2.644  -1.736
  203   1HB   GLU  27          HB2       GLU  27   4.706  -1.814  -3.742
  204   2HB   GLU  27          HB1       GLU  27   3.890  -3.109  -4.617
  205   1HG   GLU  27          HG2       GLU  27   2.168  -1.314  -2.986
  206   2HG   GLU  27          HG1       GLU  27   2.881  -0.616  -4.439
  207    H    LYS  28           HN       LYS  28   4.555  -5.460  -3.449
  208    HA   LYS  28           HA       LYS  28   2.057  -6.736  -4.118
  209   1HB   LYS  28          HB2       LYS  28   4.785  -7.901  -3.423
  210   2HB   LYS  28          HB1       LYS  28   3.506  -8.750  -4.288
  211   1HG   LYS  28          HG2       LYS  28   3.768  -7.466  -6.214
  212   2HG   LYS  28          HG1       LYS  28   4.477  -6.110  -5.336
  213   1HD   LYS  28          HD2       LYS  28   6.415  -6.957  -6.236
  214   2HD   LYS  28          HD1       LYS  28   6.340  -7.979  -4.800
  215   1HE   LYS  28          HE2       LYS  28   5.682  -9.852  -5.998
  216   2HE   LYS  28          HE1       LYS  28   4.875  -8.891  -7.254
  217   1HZ   LYS  28          HZ1       LYS  28   7.802  -9.132  -6.804
  218   2HZ   LYS  28          HZ2       LYS  28   7.090  -8.040  -7.895
  219   3HZ   LYS  28          HZ3       LYS  28   6.931  -9.714  -8.138
  220    H    VAL  29           HN       VAL  29   4.246  -7.038  -1.318
  221    HA   VAL  29           HA       VAL  29   2.611  -8.885   0.192
  222    HB   VAL  29           HB       VAL  29   4.835  -6.904   0.767
  223   1HG1  VAL  29          HG11      VAL  29   3.532  -8.729   2.816
  224   2HG1  VAL  29          HG12      VAL  29   3.409  -6.966   2.799
  225   3HG1  VAL  29          HG13      VAL  29   4.972  -7.742   3.076
  226   1HG2  VAL  29          HG21      VAL  29   6.184  -8.846   0.994
  227   2HG2  VAL  29          HG22      VAL  29   5.153  -9.169  -0.400
  228   3HG2  VAL  29          HG23      VAL  29   4.779  -9.898   1.161
  229    H    LEU  30           HN       LEU  30   2.754  -5.341  -0.076
  230    HA   LEU  30           HA       LEU  30   0.992  -4.765   2.108
  231   1HB   LEU  30          HB2       LEU  30   1.864  -3.364  -0.425
  232   2HB   LEU  30          HB1       LEU  30   0.704  -2.607   0.656
  233    HG   LEU  30           HG       LEU  30   3.271  -2.087   0.909
  234   1HD1  LEU  30          HD11      LEU  30   1.696  -1.143   2.428
  235   2HD1  LEU  30          HD12      LEU  30   2.972  -1.884   3.404
  236   3HD1  LEU  30          HD13      LEU  30   1.416  -2.703   3.207
  237   1HD2  LEU  30          HD21      LEU  30   4.265  -3.536   2.733
  238   2HD2  LEU  30          HD22      LEU  30   4.228  -4.243   1.132
  239   3HD2  LEU  30          HD23      LEU  30   3.053  -4.739   2.345
  240    H    LYS  31           HN       LYS  31   0.486  -5.671  -1.253
  241    HA   LYS  31           HA       LYS  31  -2.338  -5.091  -1.467
  242   1HB   LYS  31          HB2       LYS  31  -0.435  -5.898  -3.180
  243   2HB   LYS  31          HB1       LYS  31  -1.021  -7.481  -2.728
  244   1HG   LYS  31          HG2       LYS  31  -2.915  -5.298  -3.603
  245   2HG   LYS  31          HG1       LYS  31  -2.137  -6.367  -4.769
  246   1HD   LYS  31          HD2       LYS  31  -3.894  -7.240  -2.452
  247   2HD   LYS  31          HD1       LYS  31  -4.348  -7.249  -4.154
  248   1HE   LYS  31          HE2       LYS  31  -1.901  -8.658  -4.028
  249   2HE   LYS  31          HE1       LYS  31  -2.877  -9.259  -2.669
  250   1HZ   LYS  31          HZ1       LYS  31  -3.382 -10.402  -4.793
  251   2HZ   LYS  31          HZ2       LYS  31  -3.890  -8.919  -5.447
  252   3HZ   LYS  31          HZ3       LYS  31  -4.729  -9.606  -4.138
  253    H    GLN  32           HN       GLN  32  -0.469  -7.946  -0.504
  254    HA   GLN  32           HA       GLN  32  -2.561  -9.776   0.034
  255   1HB   GLN  32          HB2       GLN  32   0.240  -9.295   0.910
  256   2HB   GLN  32          HB1       GLN  32  -0.722 -10.413   1.879
  257   1HG   GLN  32          HG2       GLN  32  -1.373 -11.479  -0.402
  258   2HG   GLN  32          HG1       GLN  32   0.036 -10.620  -1.026
  259   1HE2  GLN  32          HE21      GLN  32   2.133 -11.009   0.326
  260   2HE2  GLN  32          HE22      GLN  32   2.368 -12.588   0.927
  261    H    TYR  33           HN       TYR  33  -1.138  -7.238   2.075
  262    HA   TYR  33           HA       TYR  33  -2.616  -7.767   4.492
  263   1HB   TYR  33          HB2       TYR  33  -0.620  -6.346   4.368
  264   2HB   TYR  33          HB1       TYR  33  -1.449  -5.229   3.283
  265    HD1  TYR  33           HD1      TYR  33  -1.473  -6.666   6.697
  266    HD2  TYR  33           HD2      TYR  33  -2.890  -3.532   4.131
  267    HE1  TYR  33           HE1      TYR  33  -2.391  -5.483   8.659
  268    HE2  TYR  33           HE2      TYR  33  -3.806  -2.337   6.098
  269    HH   TYR  33           HH       TYR  33  -4.628  -3.183   8.546
  270    H    ILE  34           HN       ILE  34  -3.257  -5.796   1.621
  271    HA   ILE  34           HA       ILE  34  -5.736  -4.612   2.522
  272    HB   ILE  34           HB       ILE  34  -4.612  -5.201  -0.235
  273   1HG1  ILE  34          HG12      ILE  34  -3.248  -3.804   1.483
  274   2HG1  ILE  34          HG11      ILE  34  -3.475  -3.143  -0.128
  275   1HG2  ILE  34          HG21      ILE  34  -6.659  -4.526  -0.921
  276   2HG2  ILE  34          HG22      ILE  34  -6.105  -2.913  -0.473
  277   3HG2  ILE  34          HG23      ILE  34  -7.072  -3.859   0.659
  278   1HD1  ILE  34          HD11      ILE  34  -5.336  -1.756   0.708
  279   2HD1  ILE  34          HD12      ILE  34  -3.855  -1.431   1.609
  280   3HD1  ILE  34          HD13      ILE  34  -5.119  -2.435   2.323
  281    H    ASN  35           HN       ASN  35  -4.870  -7.696   1.087
  282    HA   ASN  35           HA       ASN  35  -7.362  -8.531   0.005
  283   1HB   ASN  35          HB2       ASN  35  -5.059  -9.595  -0.161
  284   2HB   ASN  35          HB1       ASN  35  -5.321 -10.235   1.461
  285   1HD2  ASN  35          HD21      ASN  35  -6.072 -10.689  -1.905
  286   2HD2  ASN  35          HD22      ASN  35  -7.110 -12.017  -1.707
  287    H    ASP  36           HN       ASP  36  -6.197  -8.425   3.331
  288    HA   ASP  36           HA       ASP  36  -8.259 -10.095   4.492
  289   1HB   ASP  36          HB2       ASP  36  -6.283  -8.034   5.472
  290   2HB   ASP  36          HB1       ASP  36  -7.445  -8.765   6.580
  291    H    ASN  37           HN       ASN  37  -7.871  -6.563   4.125
  292    HA   ASN  37           HA       ASN  37 -10.459  -5.964   5.353
  293   1HB   ASN  37          HB2       ASN  37  -8.466  -4.345   3.730
  294   2HB   ASN  37          HB1       ASN  37  -9.848  -3.656   4.590
  295   1HD2  ASN  37          HD21      ASN  37  -6.775  -3.477   5.040
  296   2HD2  ASN  37          HD22      ASN  37  -6.597  -3.846   6.696
  297    H    GLY  38           HN       GLY  38  -9.202  -6.420   2.089
  298   1HA   GLY  38          HA2       GLY  38 -10.437  -6.905   0.125
  299   2HA   GLY  38          HA1       GLY  38 -11.926  -6.647   1.035
  300    H    ILE  39           HN       ILE  39  -9.115  -4.524   0.395
  301    HA   ILE  39           HA       ILE  39 -11.013  -2.563  -0.854
  302    HB   ILE  39           HB       ILE  39  -8.726  -2.055   1.082
  303   1HG1  ILE  39          HG12      ILE  39 -10.704  -3.046   2.177
  304   2HG1  ILE  39          HG11      ILE  39 -10.519  -1.352   2.640
  305   1HG2  ILE  39          HG21      ILE  39  -9.536   0.283   1.053
  306   2HG2  ILE  39          HG22      ILE  39 -10.723  -0.149  -0.178
  307   3HG2  ILE  39          HG23      ILE  39  -9.000  -0.231  -0.546
  308   1HD1  ILE  39          HD11      ILE  39 -12.100  -1.196   0.368
  309   2HD1  ILE  39          HD12      ILE  39 -12.689  -1.121   2.029
  310   3HD1  ILE  39          HD13      ILE  39 -12.694  -2.656   1.161
  311    H    ASP  40           HN       ASP  40 -10.095  -3.646  -2.868
  312    HA   ASP  40           HA       ASP  40  -7.344  -2.644  -3.524
  313   1HB   ASP  40          HB2       ASP  40  -7.969  -5.152  -3.485
  314   2HB   ASP  40          HB1       ASP  40  -8.906  -4.810  -4.944
  315    H    GLY  41           HN       GLY  41  -7.219  -1.098  -5.112
  316   1HA   GLY  41          HA2       GLY  41  -9.178  -0.972  -7.282
  317   2HA   GLY  41          HA1       GLY  41  -9.281   0.384  -6.155
  318    H    GLU  42           HN       GLU  42  -7.802   2.034  -6.347
  319    HA   GLU  42           HA       GLU  42  -5.662   1.696  -8.423
  320   1HB   GLU  42          HB2       GLU  42  -7.584   3.855  -7.649
  321   2HB   GLU  42          HB1       GLU  42  -6.019   4.344  -8.301
  322   1HG   GLU  42          HG2       GLU  42  -6.403   3.300 -10.363
  323   2HG   GLU  42          HG1       GLU  42  -7.641   2.232  -9.700
  324    H    TRP  43           HN       TRP  43  -3.639   1.647  -7.550
  325    HA   TRP  43           HA       TRP  43  -3.180   2.861  -4.867
  326   1HB   TRP  43          HB2       TRP  43  -1.703   0.875  -6.612
  327   2HB   TRP  43          HB1       TRP  43  -1.002   1.541  -5.149
  328    HD1  TRP  43           HD1      TRP  43  -4.724   0.570  -5.408
  329    HE1  TRP  43           HE1      TRP  43  -5.144  -1.381  -3.791
  330    HE3  TRP  43           HE3      TRP  43   0.036  -0.309  -3.890
  331    HZ2  TRP  43           HZ2      TRP  43  -3.651  -3.067  -2.034
  332    HZ3  TRP  43           HZ3      TRP  43   0.525  -2.085  -2.220
  333    HH2  TRP  43           HH2      TRP  43  -1.309  -3.457  -1.292
  334    H    THR  44           HN       THR  44  -3.087   5.111  -5.727
  335    HA   THR  44           HA       THR  44  -1.243   5.926  -7.775
  336    HB   THR  44           HB       THR  44  -1.603   8.161  -6.770
  337    HG1  THR  44           HG1      THR  44  -1.933   8.209  -4.714
  338   1HG2  THR  44          HG21      THR  44  -4.259   7.818  -6.579
  339   2HG2  THR  44          HG22      THR  44  -3.836   6.258  -7.286
  340   3HG2  THR  44          HG23      THR  44  -3.413   7.750  -8.125
  341    H    TYR  45           HN       TYR  45   0.951   6.142  -7.669
  342    HA   TYR  45           HA       TYR  45   2.308   5.634  -5.064
  343   1HB   TYR  45          HB2       TYR  45   2.858   4.271  -7.048
  344   2HB   TYR  45          HB1       TYR  45   3.279   5.729  -7.946
  345    HD1  TYR  45           HD1      TYR  45   4.042   4.468  -4.486
  346    HD2  TYR  45           HD2      TYR  45   5.576   5.940  -8.218
  347    HE1  TYR  45           HE1      TYR  45   6.348   4.372  -3.576
  348    HE2  TYR  45           HE2      TYR  45   7.880   5.845  -7.309
  349    HH   TYR  45           HH       TYR  45   8.627   4.246  -4.359
  350    H    ASP  46           HN       ASP  46   4.151   7.072  -4.471
  351    HA   ASP  46           HA       ASP  46   4.050   9.791  -5.733
  352   1HB   ASP  46          HB2       ASP  46   4.188   9.196  -2.755
  353   2HB   ASP  46          HB1       ASP  46   4.055  10.783  -3.505
  354    H    ASP  47           HN       ASP  47   6.075  10.441  -6.304
  355    HA   ASP  47           HA       ASP  47   8.431   8.886  -5.607
  356   1HB   ASP  47          HB2       ASP  47   9.552  10.562  -7.021
  357   2HB   ASP  47          HB1       ASP  47   8.056  10.024  -7.778
  358    H    ALA  48           HN       ALA  48   6.743  11.268  -3.882
  359    HA   ALA  48           HA       ALA  48   8.715  12.954  -2.766
  360   1HB   ALA  48          HB1       ALA  48   6.077  11.793  -1.940
  361   2HB   ALA  48          HB2       ALA  48   6.523  13.482  -2.202
  362   3HB   ALA  48          HB3       ALA  48   7.017  12.660  -0.722
  363    H    THR  49           HN       THR  49   7.340  10.213  -0.951
  364    HA   THR  49           HA       THR  49  10.096   9.523   0.015
  365    HB   THR  49           HB       THR  49   8.843  10.820   1.691
  366    HG1  THR  49           HG1      THR  49   9.577   9.507   3.132
  367   1HG2  THR  49          HG21      THR  49   6.636   9.299   0.666
  368   2HG2  THR  49          HG22      THR  49   6.605  10.642   1.809
  369   3HG2  THR  49          HG23      THR  49   6.778   8.989   2.397
  370    H    LYS  50           HN       LYS  50   8.553   8.313  -2.144
  371    HA   LYS  50           HA       LYS  50   7.917   6.192  -2.922
  372   1HB   LYS  50          HB2       LYS  50   9.402   5.371  -0.405
  373   2HB   LYS  50          HB1       LYS  50   9.051   4.321  -1.777
  374   1HG   LYS  50          HG2       LYS  50  10.285   6.095  -3.201
  375   2HG   LYS  50          HG1       LYS  50  10.909   6.696  -1.664
  376   1HD   LYS  50          HD2       LYS  50  12.559   5.162  -2.056
  377   2HD   LYS  50          HD1       LYS  50  11.388   4.047  -1.351
  378   1HE   LYS  50          HE2       LYS  50  12.030   2.998  -3.391
  379   2HE   LYS  50          HE1       LYS  50  10.495   3.795  -3.792
  380   1HZ   LYS  50          HZ1       LYS  50  13.234   4.845  -4.255
  381   2HZ   LYS  50          HZ2       LYS  50  11.825   5.776  -4.436
  382   3HZ   LYS  50          HZ3       LYS  50  12.090   4.427  -5.434
  383    H    THR  51           HN       THR  51   5.906   7.534  -1.439
  384    HA   THR  51           HA       THR  51   4.723   5.546   0.417
  385    HB   THR  51           HB       THR  51   3.850   8.282  -0.590
  386    HG1  THR  51           HG1      THR  51   4.579   8.950   1.410
  387   1HG2  THR  51          HG21      THR  51   1.843   7.246   0.091
  388   2HG2  THR  51          HG22      THR  51   2.375   8.103   1.538
  389   3HG2  THR  51          HG23      THR  51   2.636   6.364   1.396
  390    H    TRP  52           HN       TRP  52   2.328   4.995  -0.020
  391    HA   TRP  52           HA       TRP  52   1.764   4.756  -2.954
  392   1HB   TRP  52          HB2       TRP  52   1.866   2.674  -0.777
  393   2HB   TRP  52          HB1       TRP  52   0.931   2.417  -2.241
  394    HD1  TRP  52           HD1      TRP  52   4.483   2.568  -0.957
  395    HE1  TRP  52           HE1      TRP  52   6.085   1.853  -2.854
  396    HE3  TRP  52           HE3      TRP  52   1.195   2.397  -4.803
  397    HZ2  TRP  52           HZ2      TRP  52   5.959   1.276  -5.667
  398    HZ3  TRP  52           HZ3      TRP  52   1.932   1.762  -7.094
  399    HH2  TRP  52           HH2      TRP  52   4.311   1.199  -7.526
  400    H    THR  53           HN       THR  53  -0.592   3.487  -2.928
  401    HA   THR  53           HA       THR  53  -2.407   4.581  -0.880
  402    HB   THR  53           HB       THR  53  -2.923   5.298  -3.761
  403    HG1  THR  53           HG1      THR  53  -0.974   6.227  -3.479
  404   1HG2  THR  53          HG21      THR  53  -3.894   6.090  -1.062
  405   2HG2  THR  53          HG22      THR  53  -4.790   5.897  -2.569
  406   3HG2  THR  53          HG23      THR  53  -3.832   7.352  -2.293
  407    H    VAL  54           HN       VAL  54  -4.797   4.006  -1.727
  408    HA   VAL  54           HA       VAL  54  -5.178   1.817  -3.550
  409    HB   VAL  54           HB       VAL  54  -3.861   0.504  -2.020
  410   1HG1  VAL  54          HG11      VAL  54  -5.391   2.011   0.056
  411   2HG1  VAL  54          HG12      VAL  54  -3.661   1.691  -0.054
  412   3HG1  VAL  54          HG13      VAL  54  -4.764   0.412   0.451
  413   1HG2  VAL  54          HG21      VAL  54  -6.541  -0.194  -0.898
  414   2HG2  VAL  54          HG22      VAL  54  -5.301  -1.248  -1.581
  415   3HG2  VAL  54          HG23      VAL  54  -6.337  -0.292  -2.647
  416    H    THR  55           HN       THR  55  -6.956   3.305  -3.967
  417    HA   THR  55           HA       THR  55  -9.026   3.615  -1.864
  418    HB   THR  55           HB       THR  55  -8.982   4.606  -4.728
  419    HG1  THR  55           HG1      THR  55  -7.406   5.826  -4.130
  420   1HG2  THR  55          HG21      THR  55 -10.541   6.238  -3.972
  421   2HG2  THR  55          HG22      THR  55 -10.222   5.865  -2.278
  422   3HG2  THR  55          HG23      THR  55 -11.096   4.711  -3.285
  423    H    GLU  56           HN       GLU  56 -10.847   2.355  -1.826
  424    HA   GLU  56           HA       GLU  56 -11.182   0.043  -3.471
  425   1HB   GLU  56          HB2       GLU  56 -12.164   0.855  -1.136
  426   2HB   GLU  56          HB1       GLU  56 -13.500   1.409  -2.145
  427   1HG   GLU  56          HG2       GLU  56 -12.390  -1.411  -2.206
  428   2HG   GLU  56          HG1       GLU  56 -13.807  -0.927  -1.272
  Start of MODEL   24
    1   1H    THR   1          HT1       THR   1  15.338   3.111   2.413
    2   2H    THR   1          HT2       THR   1  15.697   3.109   4.073
    3   3H    THR   1          HT3       THR   1  16.153   4.427   3.104
    4    HA   THR   1           HA       THR   1  14.153   4.865   4.502
    5    HB   THR   1           HB       THR   1  14.733   6.114   2.463
    6    HG1  THR   1           HG1      THR   1  12.741   6.905   2.150
    7   1HG2  THR   1          HG21      THR   1  14.949   4.342   0.850
    8   2HG2  THR   1          HG22      THR   1  13.643   5.389   0.295
    9   3HG2  THR   1          HG23      THR   1  13.270   3.854   1.078
   10    H    THR   2           HN       THR   2  12.013   4.271   4.987
   11    HA   THR   2           HA       THR   2  11.199   1.548   4.150
   12    HB   THR   2           HB       THR   2   9.845   3.458   6.070
   13    HG1  THR   2           HG1      THR   2  11.403   3.131   7.431
   14   1HG2  THR   2          HG21      THR   2   8.980   1.468   7.078
   15   2HG2  THR   2          HG22      THR   2  10.067   0.443   6.140
   16   3HG2  THR   2          HG23      THR   2   8.741   1.286   5.340
   17    H    PHE   3           HN       PHE   3   9.327   1.131   2.949
   18    HA   PHE   3           HA       PHE   3   8.266   3.299   1.298
   19   1HB   PHE   3          HB2       PHE   3   7.540   0.366   1.624
   20   2HB   PHE   3          HB1       PHE   3   6.957   1.408   0.325
   21    HD1  PHE   3           HD1      PHE   3   9.138   2.940  -0.607
   22    HD2  PHE   3           HD2      PHE   3   9.204  -1.093   0.884
   23    HE1  PHE   3           HE1      PHE   3  11.212   2.496  -1.892
   24    HE2  PHE   3           HE2      PHE   3  11.277  -1.532  -0.403
   25    HZ   PHE   3           HZ       PHE   3  12.281   0.262  -1.789
   26    H    LYS   4           HN       LYS   4   5.736   3.350   1.063
   27    HA   LYS   4           HA       LYS   4   4.340   2.998   3.673
   28   1HB   LYS   4          HB2       LYS   4   5.476   5.268   3.482
   29   2HB   LYS   4          HB1       LYS   4   4.389   5.610   2.140
   30   1HG   LYS   4          HG2       LYS   4   2.442   5.272   3.586
   31   2HG   LYS   4          HG1       LYS   4   3.496   4.859   4.937
   32   1HD   LYS   4          HD2       LYS   4   4.067   7.032   5.331
   33   2HD   LYS   4          HD1       LYS   4   4.102   7.439   3.615
   34   1HE   LYS   4          HE2       LYS   4   1.969   8.224   3.668
   35   2HE   LYS   4          HE1       LYS   4   1.392   6.804   4.563
   36   1HZ   LYS   4          HZ1       LYS   4   1.338   8.943   5.842
   37   2HZ   LYS   4          HZ2       LYS   4   3.036   8.946   5.794
   38   3HZ   LYS   4          HZ3       LYS   4   2.209   7.691   6.585
   39    H    LEU   5           HN       LEU   5   2.003   3.158   3.448
   40    HA   LEU   5           HA       LEU   5   0.809   3.427   0.772
   41   1HB   LEU   5          HB2       LEU   5   1.802   0.992   1.339
   42   2HB   LEU   5          HB1       LEU   5   0.256   0.838   2.166
   43    HG   LEU   5           HG       LEU   5  -0.080   2.059  -0.464
   44   1HD1  LEU   5          HD11      LEU   5   1.990   0.458  -0.708
   45   2HD1  LEU   5          HD12      LEU   5   0.688   0.388  -1.902
   46   3HD1  LEU   5          HD13      LEU   5   0.773  -0.821  -0.610
   47   1HD2  LEU   5          HD21      LEU   5  -1.182  -0.274   1.086
   48   2HD2  LEU   5          HD22      LEU   5  -1.587  -0.075  -0.619
   49   3HD2  LEU   5          HD23      LEU   5  -2.007   1.188   0.540
   50    H    ILE   6           HN       ILE   6  -1.253   4.225   1.036
   51    HA   ILE   6           HA       ILE   6  -2.359   4.300   3.809
   52    HB   ILE   6           HB       ILE   6  -2.868   5.917   1.297
   53   1HG1  ILE   6          HG12      ILE   6  -0.646   6.262   2.333
   54   2HG1  ILE   6          HG11      ILE   6  -1.659   7.695   2.499
   55   1HG2  ILE   6          HG21      ILE   6  -4.240   7.381   2.645
   56   2HG2  ILE   6          HG22      ILE   6  -3.856   6.473   4.108
   57   3HG2  ILE   6          HG23      ILE   6  -4.851   5.739   2.850
   58   1HD1  ILE   6          HD11      ILE   6  -0.498   6.004   4.569
   59   2HD1  ILE   6          HD12      ILE   6  -2.241   6.174   4.774
   60   3HD1  ILE   6          HD13      ILE   6  -1.216   7.608   4.712
   61    H    ILE   7           HN       ILE   7  -4.321   3.349   4.258
   62    HA   ILE   7           HA       ILE   7  -5.534   1.602   2.221
   63    HB   ILE   7           HB       ILE   7  -6.203   2.178   5.127
   64   1HG1  ILE   7          HG12      ILE   7  -3.920   1.281   4.827
   65   2HG1  ILE   7          HG11      ILE   7  -4.968   0.087   5.589
   66   1HG2  ILE   7          HG21      ILE   7  -7.432   0.055   5.048
   67   2HG2  ILE   7          HG22      ILE   7  -7.012  -0.141   3.346
   68   3HG2  ILE   7          HG23      ILE   7  -8.075   1.175   3.846
   69   1HD1  ILE   7          HD11      ILE   7  -4.189   0.185   2.658
   70   2HD1  ILE   7          HD12      ILE   7  -5.338  -0.960   3.351
   71   3HD1  ILE   7          HD13      ILE   7  -3.646  -0.999   3.848
   72    H    ASN   8           HN       ASN   8  -7.049   2.456   0.860
   73    HA   ASN   8           HA       ASN   8  -8.842   4.628   1.893
   74   1HB   ASN   8          HB2       ASN   8  -7.628   4.004  -0.807
   75   2HB   ASN   8          HB1       ASN   8  -8.987   5.117  -0.640
   76   1HD2  ASN   8          HD21      ASN   8  -7.655   6.974  -1.262
   77   2HD2  ASN   8          HD22      ASN   8  -6.478   7.607  -0.201
   78    H    GLY   9           HN       GLY   9  -9.635   2.102   2.528
   79   1HA   GLY   9          HA2       GLY   9 -11.311   0.947   0.418
   80   2HA   GLY   9          HA1       GLY   9 -11.203   0.378   2.088
   81    H    LYS  10           HN       LYS  10 -13.670   0.689   0.733
   82    HA   LYS  10           HA       LYS  10 -15.048   3.114   1.122
   83   1HB   LYS  10          HB2       LYS  10 -15.967   0.231   1.304
   84   2HB   LYS  10          HB1       LYS  10 -17.053   1.610   1.124
   85   1HG   LYS  10          HG2       LYS  10 -15.628   2.220  -0.944
   86   2HG   LYS  10          HG1       LYS  10 -15.002   0.574  -0.834
   87   1HD   LYS  10          HD2       LYS  10 -17.046  -0.387  -1.361
   88   2HD   LYS  10          HD1       LYS  10 -17.967   0.981  -0.737
   89   1HE   LYS  10          HE2       LYS  10 -16.811   2.298  -2.713
   90   2HE   LYS  10          HE1       LYS  10 -16.619   0.675  -3.405
   91   1HZ   LYS  10          HZ1       LYS  10 -19.177   1.670  -2.280
   92   2HZ   LYS  10          HZ2       LYS  10 -18.927   0.260  -3.194
   93   3HZ   LYS  10          HZ3       LYS  10 -18.789   1.787  -3.927
   94    H    THR  11           HN       THR  11 -14.166   0.621   3.440
   95    HA   THR  11           HA       THR  11 -15.443   2.251   5.613
   96    HB   THR  11           HB       THR  11 -15.180  -0.765   5.546
   97    HG1  THR  11           HG1      THR  11 -17.342  -0.750   4.864
   98   1HG2  THR  11          HG21      THR  11 -17.311  -0.235   7.089
   99   2HG2  THR  11          HG22      THR  11 -16.425   1.272   7.324
  100   3HG2  THR  11          HG23      THR  11 -15.670  -0.268   7.734
  101    H    LEU  12           HN       LEU  12 -12.925  -0.149   4.802
  102    HA   LEU  12           HA       LEU  12 -11.470   0.300   7.315
  103   1HB   LEU  12          HB2       LEU  12 -10.896  -1.217   4.749
  104   2HB   LEU  12          HB1       LEU  12  -9.860  -1.274   6.176
  105    HG   LEU  12           HG       LEU  12 -12.780  -1.822   6.529
  106   1HD1  LEU  12          HD11      LEU  12 -10.883  -4.024   5.731
  107   2HD1  LEU  12          HD12      LEU  12 -11.804  -3.144   4.512
  108   3HD1  LEU  12          HD13      LEU  12 -12.646  -4.048   5.770
  109   1HD2  LEU  12          HD21      LEU  12 -10.747  -1.727   8.267
  110   2HD2  LEU  12          HD22      LEU  12 -10.547  -3.398   7.740
  111   3HD2  LEU  12          HD23      LEU  12 -12.071  -2.877   8.460
  112    H    LYS  13           HN       LYS  13  -9.584   1.534   7.544
  113    HA   LYS  13           HA       LYS  13  -8.280   2.747   5.190
  114   1HB   LYS  13          HB2       LYS  13 -10.089   4.175   7.117
  115   2HB   LYS  13          HB1       LYS  13  -8.729   5.047   6.411
  116   1HG   LYS  13          HG2       LYS  13  -9.633   4.016   4.155
  117   2HG   LYS  13          HG1       LYS  13 -11.143   3.893   5.059
  118   1HD   LYS  13          HD2       LYS  13 -10.585   6.393   5.717
  119   2HD   LYS  13          HD1       LYS  13  -9.620   6.341   4.241
  120   1HE   LYS  13          HE2       LYS  13 -11.708   7.037   3.416
  121   2HE   LYS  13          HE1       LYS  13 -11.824   5.277   3.212
  122   1HZ   LYS  13          HZ1       LYS  13 -13.753   6.054   4.398
  123   2HZ   LYS  13          HZ2       LYS  13 -12.785   6.857   5.540
  124   3HZ   LYS  13          HZ3       LYS  13 -12.782   5.160   5.463
  125    H    GLY  14           HN       GLY  14  -6.506   4.345   6.069
  126   1HA   GLY  14          HA2       GLY  14  -5.323   4.773   8.357
  127   2HA   GLY  14          HA1       GLY  14  -5.195   3.015   8.386
  128    H    GLU  15           HN       GLU  15  -2.802   3.759   8.475
  129    HA   GLU  15           HA       GLU  15  -1.760   3.935   5.666
  130   1HB   GLU  15          HB2       GLU  15   0.047   5.363   6.620
  131   2HB   GLU  15          HB1       GLU  15  -1.547   6.078   6.852
  132   1HG   GLU  15          HG2       GLU  15  -1.619   5.275   9.155
  133   2HG   GLU  15          HG1       GLU  15  -0.087   4.428   8.937
  134    H    THR  16           HN       THR  16   0.420   2.954   5.420
  135    HA   THR  16           HA       THR  16   1.392   1.214   7.603
  136    HB   THR  16           HB       THR  16  -0.452  -0.063   6.602
  137    HG1  THR  16           HG1      THR  16   0.779  -1.880   6.002
  138   1HG2  THR  16          HG21      THR  16  -0.051  -0.818   4.152
  139   2HG2  THR  16          HG22      THR  16   1.001   0.594   4.038
  140   3HG2  THR  16          HG23      THR  16  -0.709   0.795   4.422
  141    H    THR  17           HN       THR  17   3.528   0.436   7.201
  142    HA   THR  17           HA       THR  17   4.824   1.310   4.647
  143    HB   THR  17           HB       THR  17   6.738   2.085   6.107
  144    HG1  THR  17           HG1      THR  17   6.466   1.227   8.038
  145   1HG2  THR  17          HG21      THR  17   5.491   4.146   6.944
  146   2HG2  THR  17          HG22      THR  17   4.016   3.377   6.360
  147   3HG2  THR  17          HG23      THR  17   5.305   3.783   5.228
  148    H    THR  18           HN       THR  18   6.809   0.086   4.192
  149    HA   THR  18           HA       THR  18   7.265  -2.307   5.891
  150    HB   THR  18           HB       THR  18   5.912  -2.147   3.294
  151    HG1  THR  18           HG1      THR  18   6.518  -4.331   5.001
  152   1HG2  THR  18          HG21      THR  18   7.038  -4.007   2.178
  153   2HG2  THR  18          HG22      THR  18   8.255  -4.071   3.454
  154   3HG2  THR  18          HG23      THR  18   8.159  -2.661   2.397
  155    H    GLU  19           HN       GLU  19   9.349  -3.414   5.174
  156    HA   GLU  19           HA       GLU  19  11.306  -1.423   4.067
  157   1HB   GLU  19          HB2       GLU  19  11.458  -1.815   6.521
  158   2HB   GLU  19          HB1       GLU  19  11.673  -3.539   6.216
  159   1HG   GLU  19          HG2       GLU  19  13.605  -2.551   4.599
  160   2HG   GLU  19          HG1       GLU  19  13.586  -1.297   5.839
  161    H    ALA  20           HN       ALA  20  11.978  -2.170   2.089
  162    HA   ALA  20           HA       ALA  20  12.819  -5.003   1.820
  163   1HB   ALA  20          HB1       ALA  20  10.500  -3.660   0.452
  164   2HB   ALA  20          HB2       ALA  20  10.578  -5.267   1.177
  165   3HB   ALA  20          HB3       ALA  20  11.366  -4.959  -0.370
  166    H    VAL  21           HN       VAL  21  13.670  -5.295  -0.553
  167    HA   VAL  21           HA       VAL  21  15.818  -3.500  -1.036
  168    HB   VAL  21           HB       VAL  21  15.991  -4.748  -3.176
  169   1HG1  VAL  21          HG11      VAL  21  16.451  -5.725  -0.770
  170   2HG1  VAL  21          HG12      VAL  21  16.511  -6.783  -2.179
  171   3HG1  VAL  21          HG13      VAL  21  15.077  -6.763  -1.152
  172   1HG2  VAL  21          HG21      VAL  21  13.169  -5.532  -2.440
  173   2HG2  VAL  21          HG22      VAL  21  14.162  -6.596  -3.433
  174   3HG2  VAL  21          HG23      VAL  21  13.791  -4.965  -3.989
  175    H    ASP  22           HN       ASP  22  12.574  -3.641  -2.496
  176    HA   ASP  22           HA       ASP  22  12.846  -0.817  -3.362
  177   1HB   ASP  22          HB2       ASP  22  12.222  -3.148  -5.209
  178   2HB   ASP  22          HB1       ASP  22  12.180  -1.448  -5.673
  179    H    ALA  23           HN       ALA  23  10.694   0.066  -3.996
  180    HA   ALA  23           HA       ALA  23   8.576  -0.732  -2.247
  181   1HB   ALA  23          HB1       ALA  23   7.317   0.718  -4.150
  182   2HB   ALA  23          HB2       ALA  23   8.988   1.103  -4.562
  183   3HB   ALA  23          HB3       ALA  23   8.374   1.459  -2.948
  184    H    ALA  24           HN       ALA  24   9.435  -1.747  -5.500
  185    HA   ALA  24           HA       ALA  24   6.954  -2.887  -6.341
  186   1HB   ALA  24          HB1       ALA  24   9.737  -3.962  -6.882
  187   2HB   ALA  24          HB2       ALA  24   9.127  -2.488  -7.634
  188   3HB   ALA  24          HB3       ALA  24   8.333  -4.032  -7.947
  189    H    THR  25           HN       THR  25   9.694  -4.317  -4.549
  190    HA   THR  25           HA       THR  25   8.507  -6.925  -4.212
  191    HB   THR  25           HB       THR  25  10.687  -5.358  -2.794
  192    HG1  THR  25           HG1      THR  25  11.687  -6.002  -4.499
  193   1HG2  THR  25          HG21      THR  25  11.375  -7.451  -1.723
  194   2HG2  THR  25          HG22      THR  25  10.017  -8.299  -2.462
  195   3HG2  THR  25          HG23      THR  25   9.722  -7.053  -1.245
  196    H    ALA  26           HN       ALA  26   8.757  -4.088  -2.025
  197    HA   ALA  26           HA       ALA  26   7.349  -5.199   0.177
  198   1HB   ALA  26          HB1       ALA  26   8.574  -3.156   0.426
  199   2HB   ALA  26          HB2       ALA  26   6.879  -2.711   0.645
  200   3HB   ALA  26          HB3       ALA  26   7.691  -2.384  -0.891
  201    H    GLU  27           HN       GLU  27   6.073  -2.963  -2.313
  202    HA   GLU  27           HA       GLU  27   3.401  -2.841  -1.706
  203   1HB   GLU  27          HB2       GLU  27   4.596  -1.762  -3.606
  204   2HB   GLU  27          HB1       GLU  27   4.582  -3.303  -4.464
  205   1HG   GLU  27          HG2       GLU  27   1.973  -3.163  -3.942
  206   2HG   GLU  27          HG1       GLU  27   2.321  -1.435  -3.884
  207    H    LYS  28           HN       LYS  28   4.987  -5.657  -3.213
  208    HA   LYS  28           HA       LYS  28   2.595  -7.121  -3.880
  209   1HB   LYS  28          HB2       LYS  28   5.372  -8.052  -3.044
  210   2HB   LYS  28          HB1       LYS  28   4.172  -9.054  -3.860
  211   1HG   LYS  28          HG2       LYS  28   4.377  -7.901  -5.873
  212   2HG   LYS  28          HG1       LYS  28   4.969  -6.436  -5.089
  213   1HD   LYS  28          HD2       LYS  28   6.982  -7.196  -5.893
  214   2HD   LYS  28          HD1       LYS  28   6.951  -8.122  -4.391
  215   1HE   LYS  28          HE2       LYS  28   6.131 -10.087  -5.516
  216   2HE   LYS  28          HE1       LYS  28   5.825  -9.174  -7.007
  217   1HZ   LYS  28          HZ1       LYS  28   8.129  -8.738  -7.262
  218   2HZ   LYS  28          HZ2       LYS  28   7.986 -10.406  -6.972
  219   3HZ   LYS  28          HZ3       LYS  28   8.497  -9.365  -5.729
  220    H    VAL  29           HN       VAL  29   4.666  -7.032  -0.989
  221    HA   VAL  29           HA       VAL  29   3.097  -8.905   0.582
  222    HB   VAL  29           HB       VAL  29   5.196  -6.776   1.100
  223   1HG1  VAL  29          HG11      VAL  29   5.313  -7.490   3.450
  224   2HG1  VAL  29          HG12      VAL  29   3.943  -8.573   3.203
  225   3HG1  VAL  29          HG13      VAL  29   3.716  -6.824   3.094
  226   1HG2  VAL  29          HG21      VAL  29   6.654  -8.609   1.423
  227   2HG2  VAL  29          HG22      VAL  29   5.647  -9.096   0.060
  228   3HG2  VAL  29          HG23      VAL  29   5.320  -9.736   1.670
  229    H    LEU  30           HN       LEU  30   3.106  -5.364   0.151
  230    HA   LEU  30           HA       LEU  30   1.218  -4.781   2.229
  231   1HB   LEU  30          HB2       LEU  30   2.123  -3.432  -0.324
  232   2HB   LEU  30          HB1       LEU  30   0.909  -2.689   0.702
  233    HG   LEU  30           HG       LEU  30   3.445  -2.054   0.995
  234   1HD1  LEU  30          HD11      LEU  30   1.780  -1.133   2.441
  235   2HD1  LEU  30          HD12      LEU  30   3.082  -1.758   3.463
  236   3HD1  LEU  30          HD13      LEU  30   1.578  -2.672   3.283
  237   1HD2  LEU  30          HD21      LEU  30   3.295  -4.648   2.541
  238   2HD2  LEU  30          HD22      LEU  30   4.471  -3.391   2.869
  239   3HD2  LEU  30          HD23      LEU  30   4.458  -4.180   1.305
  240    H    LYS  31           HN       LYS  31   0.924  -5.816  -1.123
  241    HA   LYS  31           HA       LYS  31  -1.897  -5.366  -1.515
  242   1HB   LYS  31          HB2       LYS  31   0.119  -6.178  -3.079
  243   2HB   LYS  31          HB1       LYS  31  -0.425  -7.762  -2.580
  244   1HG   LYS  31          HG2       LYS  31  -2.359  -5.711  -3.660
  245   2HG   LYS  31          HG1       LYS  31  -1.469  -6.791  -4.732
  246   1HD   LYS  31          HD2       LYS  31  -3.316  -7.645  -2.478
  247   2HD   LYS  31          HD1       LYS  31  -3.669  -7.750  -4.201
  248   1HE   LYS  31          HE2       LYS  31  -1.171  -9.035  -3.867
  249   2HE   LYS  31          HE1       LYS  31  -2.202  -9.623  -2.542
  250   1HZ   LYS  31          HZ1       LYS  31  -3.977 -10.007  -4.166
  251   2HZ   LYS  31          HZ2       LYS  31  -2.596 -10.923  -4.540
  252   3HZ   LYS  31          HZ3       LYS  31  -2.950  -9.515  -5.422
  253    H    GLN  32           HN       GLN  32   0.011  -8.097  -0.302
  254    HA   GLN  32           HA       GLN  32  -2.049  -9.974   0.206
  255   1HB   GLN  32          HB2       GLN  32   0.689  -9.371   1.168
  256   2HB   GLN  32          HB1       GLN  32  -0.286 -10.423   2.196
  257   1HG   GLN  32          HG2       GLN  32  -0.744 -11.890   0.260
  258   2HG   GLN  32          HG1       GLN  32   0.258 -10.850  -0.753
  259   1HE2  GLN  32          HE21      GLN  32   0.388 -13.025   2.090
  260   2HE2  GLN  32          HE22      GLN  32   2.058 -13.351   1.960
  261    H    TYR  33           HN       TYR  33  -0.833  -7.280   2.186
  262    HA   TYR  33           HA       TYR  33  -2.454  -7.750   4.531
  263   1HB   TYR  33          HB2       TYR  33  -0.494  -6.285   4.502
  264   2HB   TYR  33          HB1       TYR  33  -1.246  -5.248   3.290
  265    HD1  TYR  33           HD1      TYR  33  -1.539  -6.493   6.764
  266    HD2  TYR  33           HD2      TYR  33  -2.784  -3.540   3.911
  267    HE1  TYR  33           HE1      TYR  33  -2.644  -5.225   8.569
  268    HE2  TYR  33           HE2      TYR  33  -3.887  -2.258   5.722
  269    HH   TYR  33           HH       TYR  33  -3.303  -2.773   8.962
  270    H    ILE  34           HN       ILE  34  -2.932  -5.885   1.549
  271    HA   ILE  34           HA       ILE  34  -5.494  -4.741   2.207
  272    HB   ILE  34           HB       ILE  34  -4.186  -5.479  -0.431
  273   1HG1  ILE  34          HG12      ILE  34  -2.972  -3.923   1.253
  274   2HG1  ILE  34          HG11      ILE  34  -3.139  -3.364  -0.405
  275   1HG2  ILE  34          HG21      ILE  34  -6.248  -4.962  -1.240
  276   2HG2  ILE  34          HG22      ILE  34  -5.714  -3.301  -0.984
  277   3HG2  ILE  34          HG23      ILE  34  -6.720  -4.099   0.224
  278   1HD1  ILE  34          HD11      ILE  34  -4.683  -1.741   0.162
  279   2HD1  ILE  34          HD12      ILE  34  -3.735  -1.791   1.649
  280   3HD1  ILE  34          HD13      ILE  34  -5.278  -2.642   1.557
  281    H    ASN  35           HN       ASN  35  -4.467  -7.874   0.993
  282    HA   ASN  35           HA       ASN  35  -6.891  -8.846  -0.133
  283   1HB   ASN  35          HB2       ASN  35  -4.529  -9.819  -0.144
  284   2HB   ASN  35          HB1       ASN  35  -4.872 -10.431   1.473
  285   1HD2  ASN  35          HD21      ASN  35  -4.496 -11.913  -1.179
  286   2HD2  ASN  35          HD22      ASN  35  -5.887 -12.874  -1.326
  287    H    ASP  36           HN       ASP  36  -5.776  -8.700   3.231
  288    HA   ASP  36           HA       ASP  36  -7.947 -10.286   4.335
  289   1HB   ASP  36          HB2       ASP  36  -5.568  -9.644   5.238
  290   2HB   ASP  36          HB1       ASP  36  -6.376  -8.188   5.822
  291    H    ASN  37           HN       ASN  37  -7.422  -6.846   3.702
  292    HA   ASN  37           HA       ASN  37  -9.841  -5.992   5.131
  293   1HB   ASN  37          HB2       ASN  37  -7.904  -4.630   3.227
  294   2HB   ASN  37          HB1       ASN  37  -9.173  -3.791   4.127
  295   1HD2  ASN  37          HD21      ASN  37  -8.033  -2.652   5.727
  296   2HD2  ASN  37          HD22      ASN  37  -6.915  -3.366   6.800
  297    H    GLY  38           HN       GLY  38  -8.922  -6.832   1.837
  298   1HA   GLY  38          HA2       GLY  38 -10.330  -7.337   0.009
  299   2HA   GLY  38          HA1       GLY  38 -11.722  -6.963   1.026
  300    H    ILE  39           HN       ILE  39  -8.913  -4.952   0.124
  301    HA   ILE  39           HA       ILE  39 -10.840  -2.985  -1.077
  302    HB   ILE  39           HB       ILE  39  -8.297  -2.521   0.520
  303   1HG1  ILE  39          HG12      ILE  39 -10.170  -3.326   1.914
  304   2HG1  ILE  39          HG11      ILE  39  -9.830  -1.626   2.248
  305   1HG2  ILE  39          HG21      ILE  39 -10.266  -0.643  -0.799
  306   2HG2  ILE  39          HG22      ILE  39  -8.517  -0.712  -1.014
  307   3HG2  ILE  39          HG23      ILE  39  -9.196  -0.122   0.503
  308   1HD1  ILE  39          HD11      ILE  39 -12.103  -2.780   0.617
  309   2HD1  ILE  39          HD12      ILE  39 -11.661  -1.075   0.542
  310   3HD1  ILE  39          HD13      ILE  39 -12.205  -1.778   2.065
  311    H    ASP  40           HN       ASP  40 -10.382  -3.910  -3.204
  312    HA   ASP  40           HA       ASP  40  -7.597  -3.408  -4.204
  313   1HB   ASP  40          HB2       ASP  40  -9.726  -5.448  -4.697
  314   2HB   ASP  40          HB1       ASP  40  -8.679  -5.021  -6.055
  315    H    GLY  41           HN       GLY  41  -7.430  -1.680  -5.568
  316   1HA   GLY  41          HA2       GLY  41  -9.434  -1.143  -7.614
  317   2HA   GLY  41          HA1       GLY  41  -9.420   0.080  -6.339
  318    H    GLU  42           HN       GLU  42  -7.837   1.638  -6.389
  319    HA   GLU  42           HA       GLU  42  -5.622   1.295  -8.385
  320   1HB   GLU  42          HB2       GLU  42  -7.338   3.712  -7.726
  321   2HB   GLU  42          HB1       GLU  42  -5.955   3.743  -8.822
  322   1HG   GLU  42          HG2       GLU  42  -7.030   2.454 -10.437
  323   2HG   GLU  42          HG1       GLU  42  -8.125   1.718  -9.266
  324    H    TRP  43           HN       TRP  43  -3.629   1.555  -7.483
  325    HA   TRP  43           HA       TRP  43  -3.423   2.654  -4.732
  326   1HB   TRP  43          HB2       TRP  43  -1.656   1.006  -6.540
  327   2HB   TRP  43          HB1       TRP  43  -1.077   1.659  -5.017
  328    HD1  TRP  43           HD1      TRP  43  -4.664   0.328  -5.327
  329    HE1  TRP  43           HE1      TRP  43  -4.858  -1.797  -3.889
  330    HE3  TRP  43           HE3      TRP  43   0.209  -0.261  -3.997
  331    HZ2  TRP  43           HZ2      TRP  43  -3.170  -3.499  -2.341
  332    HZ3  TRP  43           HZ3      TRP  43   0.895  -2.136  -2.519
  333    HH2  TRP  43           HH2      TRP  43  -0.784  -3.750  -1.696
  334    H    THR  44           HN       THR  44  -1.755   2.891  -7.823
  335    HA   THR  44           HA       THR  44  -0.529   4.616  -8.841
  336    HB   THR  44           HB       THR  44  -1.343   6.796  -8.593
  337    HG1  THR  44           HG1      THR  44  -2.243   6.228  -5.978
  338   1HG2  THR  44          HG21      THR  44  -3.194   4.856  -8.822
  339   2HG2  THR  44          HG22      THR  44  -3.610   6.570  -8.816
  340   3HG2  THR  44          HG23      THR  44  -3.768   5.619  -7.339
  341    H    TYR  45           HN       TYR  45   1.582   5.145  -8.542
  342    HA   TYR  45           HA       TYR  45   2.649   5.050  -5.756
  343   1HB   TYR  45          HB2       TYR  45   3.523   3.496  -7.461
  344   2HB   TYR  45          HB1       TYR  45   3.954   4.854  -8.495
  345    HD1  TYR  45           HD1      TYR  45   4.365   4.242  -4.807
  346    HD2  TYR  45           HD2      TYR  45   6.269   5.071  -8.568
  347    HE1  TYR  45           HE1      TYR  45   6.553   4.440  -3.656
  348    HE2  TYR  45           HE2      TYR  45   8.455   5.269  -7.417
  349    HH   TYR  45           HH       TYR  45   8.908   4.291  -4.152
  350    H    ASP  46           HN       ASP  46   4.174   6.697  -5.070
  351    HA   ASP  46           HA       ASP  46   4.235   9.193  -6.721
  352   1HB   ASP  46          HB2       ASP  46   3.847  10.451  -4.597
  353   2HB   ASP  46          HB1       ASP  46   2.493   9.401  -5.009
  354    H    ASP  47           HN       ASP  47   6.319   9.810  -7.022
  355    HA   ASP  47           HA       ASP  47   8.512   8.524  -5.586
  356   1HB   ASP  47          HB2       ASP  47   8.495   9.125  -8.006
  357   2HB   ASP  47          HB1       ASP  47   8.473  10.830  -7.556
  358    H    ALA  48           HN       ALA  48   6.554  11.161  -4.760
  359    HA   ALA  48           HA       ALA  48   8.378  13.120  -3.799
  360   1HB   ALA  48          HB1       ALA  48   6.361  13.398  -2.099
  361   2HB   ALA  48          HB2       ALA  48   5.596  12.202  -3.145
  362   3HB   ALA  48          HB3       ALA  48   6.130  13.745  -3.812
  363    H    THR  49           HN       THR  49   7.233  10.101  -2.338
  364    HA   THR  49           HA       THR  49   9.494  10.111  -0.454
  365    HB   THR  49           HB       THR  49   7.830  11.534   0.641
  366    HG1  THR  49           HG1      THR  49   8.735  10.419   2.202
  367   1HG2  THR  49          HG21      THR  49   6.008   9.429  -0.326
  368   2HG2  THR  49          HG22      THR  49   5.691  11.133  -0.001
  369   3HG2  THR  49          HG23      THR  49   5.693   9.969   1.324
  370    H    LYS  50           HN       LYS  50   8.346   8.411  -2.652
  371    HA   LYS  50           HA       LYS  50   7.961   6.128  -3.114
  372   1HB   LYS  50          HB2       LYS  50   9.376   5.889  -0.438
  373   2HB   LYS  50          HB1       LYS  50   9.272   4.634  -1.670
  374   1HG   LYS  50          HG2       LYS  50  10.336   6.431  -3.242
  375   2HG   LYS  50          HG1       LYS  50  10.821   7.213  -1.738
  376   1HD   LYS  50          HD2       LYS  50  12.639   5.844  -1.914
  377   2HD   LYS  50          HD1       LYS  50  11.554   4.646  -1.209
  378   1HE   LYS  50          HE2       LYS  50  12.408   3.548  -3.131
  379   2HE   LYS  50          HE1       LYS  50  10.852   4.187  -3.696
  380   1HZ   LYS  50          HZ1       LYS  50  13.501   5.507  -3.973
  381   2HZ   LYS  50          HZ2       LYS  50  12.017   6.207  -4.416
  382   3HZ   LYS  50          HZ3       LYS  50  12.586   4.828  -5.229
  383    H    THR  51           HN       THR  51   5.790   7.504  -1.711
  384    HA   THR  51           HA       THR  51   4.764   5.471   0.206
  385    HB   THR  51           HB       THR  51   3.872   8.238  -0.686
  386    HG1  THR  51           HG1      THR  51   5.743   7.812   0.792
  387   1HG2  THR  51          HG21      THR  51   1.846   7.114  -0.109
  388   2HG2  THR  51          HG22      THR  51   2.305   8.032   1.326
  389   3HG2  THR  51          HG23      THR  51   2.605   6.295   1.256
  390    H    TRP  52           HN       TRP  52   2.360   4.887  -0.139
  391    HA   TRP  52           HA       TRP  52   1.667   4.660  -3.047
  392   1HB   TRP  52          HB2       TRP  52   1.880   2.554  -0.894
  393   2HB   TRP  52          HB1       TRP  52   0.940   2.291  -2.355
  394    HD1  TRP  52           HD1      TRP  52   4.511   2.655  -1.112
  395    HE1  TRP  52           HE1      TRP  52   6.119   1.911  -2.991
  396    HE3  TRP  52           HE3      TRP  52   1.180   2.073  -4.888
  397    HZ2  TRP  52           HZ2      TRP  52   5.984   1.152  -5.757
  398    HZ3  TRP  52           HZ3      TRP  52   1.919   1.331  -7.143
  399    HH2  TRP  52           HH2      TRP  52   4.318   0.869  -7.578
  400    H    THR  53           HN       THR  53  -0.651   3.344  -2.923
  401    HA   THR  53           HA       THR  53  -2.390   4.277  -0.743
  402    HB   THR  53           HB       THR  53  -3.175   5.157  -3.503
  403    HG1  THR  53           HG1      THR  53  -1.792   6.748  -3.543
  404   1HG2  THR  53          HG21      THR  53  -3.789   5.816  -0.671
  405   2HG2  THR  53          HG22      THR  53  -4.866   5.711  -2.063
  406   3HG2  THR  53          HG23      THR  53  -3.864   7.143  -1.831
  407    H    VAL  54           HN       VAL  54  -4.831   3.738  -1.664
  408    HA   VAL  54           HA       VAL  54  -5.088   1.556  -3.541
  409    HB   VAL  54           HB       VAL  54  -3.797   0.378  -1.818
  410   1HG1  VAL  54          HG11      VAL  54  -3.990   0.962   0.331
  411   2HG1  VAL  54          HG12      VAL  54  -5.632   0.322   0.367
  412   3HG1  VAL  54          HG13      VAL  54  -5.351   2.008  -0.061
  413   1HG2  VAL  54          HG21      VAL  54  -6.078  -0.571  -2.900
  414   2HG2  VAL  54          HG22      VAL  54  -6.528  -0.639  -1.196
  415   3HG2  VAL  54          HG23      VAL  54  -5.103  -1.514  -1.767
  416    H    THR  55           HN       THR  55  -6.847   3.101  -4.019
  417    HA   THR  55           HA       THR  55  -9.040   3.344  -2.045
  418    HB   THR  55           HB       THR  55  -8.961   4.319  -4.906
  419    HG1  THR  55           HG1      THR  55  -7.212   5.316  -4.301
  420   1HG2  THR  55          HG21      THR  55 -10.256   6.202  -3.870
  421   2HG2  THR  55          HG22      THR  55 -10.239   5.314  -2.346
  422   3HG2  THR  55          HG23      THR  55 -11.067   4.640  -3.750
  423    H    GLU  56           HN       GLU  56 -10.731   1.929  -2.030
  424    HA   GLU  56           HA       GLU  56 -10.964  -0.292  -3.836
  425   1HB   GLU  56          HB2       GLU  56 -11.915   0.361  -1.390
  426   2HB   GLU  56          HB1       GLU  56 -13.349   0.708  -2.356
  427   1HG   GLU  56          HG2       GLU  56 -11.919  -1.851  -2.905
  428   2HG   GLU  56          HG1       GLU  56 -12.850  -1.748  -1.410
  Start of MODEL   25
    1   1H    THR   1          HT1       THR   1  15.547   1.808   3.263
    2   2H    THR   1          HT2       THR   1  16.039   2.801   1.975
    3   3H    THR   1          HT3       THR   1  14.765   1.698   1.762
    4    HA   THR   1           HA       THR   1  14.662   3.976   3.671
    5    HB   THR   1           HB       THR   1  14.972   4.732   1.352
    6    HG1  THR   1           HG1      THR   1  13.540   5.964   2.464
    7   1HG2  THR   1          HG21      THR   1  14.306   2.806   0.090
    8   2HG2  THR   1          HG22      THR   1  13.172   4.091  -0.326
    9   3HG2  THR   1          HG23      THR   1  12.691   2.822   0.800
   10    H    THR   2           HN       THR   2  12.188   4.482   3.900
   11    HA   THR   2           HA       THR   2  10.777   1.889   4.377
   12    HB   THR   2           HB       THR   2  10.238   4.664   5.478
   13    HG1  THR   2           HG1      THR   2  11.690   2.518   6.628
   14   1HG2  THR   2          HG21      THR   2   9.314   1.878   6.191
   15   2HG2  THR   2          HG22      THR   2   8.326   3.281   5.782
   16   3HG2  THR   2          HG23      THR   2   9.189   3.228   7.319
   17    H    PHE   3           HN       PHE   3   8.948   1.444   3.207
   18    HA   PHE   3           HA       PHE   3   7.998   3.418   1.215
   19   1HB   PHE   3          HB2       PHE   3   7.294   0.523   1.812
   20   2HB   PHE   3          HB1       PHE   3   6.732   1.427   0.406
   21    HD1  PHE   3           HD1      PHE   3   8.850   2.825  -0.722
   22    HD2  PHE   3           HD2      PHE   3   9.053  -0.935   1.351
   23    HE1  PHE   3           HE1      PHE   3  10.955   2.280  -1.914
   24    HE2  PHE   3           HE2      PHE   3  11.157  -1.478   0.157
   25    HZ   PHE   3           HZ       PHE   3  12.108   0.130  -1.474
   26    H    LYS   4           HN       LYS   4   5.520   3.564   0.964
   27    HA   LYS   4           HA       LYS   4   4.060   3.357   3.562
   28   1HB   LYS   4          HB2       LYS   4   5.204   5.617   3.214
   29   2HB   LYS   4          HB1       LYS   4   4.115   5.857   1.855
   30   1HG   LYS   4          HG2       LYS   4   2.171   5.587   3.328
   31   2HG   LYS   4          HG1       LYS   4   3.239   5.311   4.703
   32   1HD   LYS   4          HD2       LYS   4   3.756   7.520   4.914
   33   2HD   LYS   4          HD1       LYS   4   3.797   7.779   3.171
   34   1HE   LYS   4          HE2       LYS   4   1.621   8.462   3.112
   35   2HE   LYS   4          HE1       LYS   4   1.100   7.185   4.230
   36   1HZ   LYS   4          HZ1       LYS   4   0.929   9.269   5.363
   37   2HZ   LYS   4          HZ2       LYS   4   2.512   9.706   4.925
   38   3HZ   LYS   4          HZ3       LYS   4   2.251   8.433   6.019
   39    H    LEU   5           HN       LEU   5   1.748   3.382   3.290
   40    HA   LEU   5           HA       LEU   5   0.603   3.518   0.574
   41   1HB   LEU   5          HB2       LEU   5   1.610   1.137   1.279
   42   2HB   LEU   5          HB1       LEU   5   0.066   1.007   2.113
   43    HG   LEU   5           HG       LEU   5  -0.253   2.066  -0.597
   44   1HD1  LEU   5          HD11      LEU   5   0.584  -0.827  -0.493
   45   2HD1  LEU   5          HD12      LEU   5   1.790   0.444  -0.737
   46   3HD1  LEU   5          HD13      LEU   5   0.468   0.250  -1.895
   47   1HD2  LEU   5          HD21      LEU   5  -2.097   1.233   0.786
   48   2HD2  LEU   5          HD22      LEU   5  -1.345  -0.362   0.858
   49   3HD2  LEU   5          HD23      LEU   5  -1.952   0.258  -0.678
   50    H    ILE   6           HN       ILE   6  -1.445   4.346   0.750
   51    HA   ILE   6           HA       ILE   6  -2.643   4.543   3.476
   52    HB   ILE   6           HB       ILE   6  -3.050   6.039   0.873
   53   1HG1  ILE   6          HG12      ILE   6  -0.881   6.432   2.006
   54   2HG1  ILE   6          HG11      ILE   6  -1.898   7.871   2.047
   55   1HG2  ILE   6          HG21      ILE   6  -5.070   6.553   1.794
   56   2HG2  ILE   6          HG22      ILE   6  -4.125   7.627   2.825
   57   3HG2  ILE   6          HG23      ILE   6  -4.579   6.024   3.403
   58   1HD1  ILE   6          HD11      ILE   6  -1.593   7.895   4.284
   59   2HD1  ILE   6          HD12      ILE   6  -0.839   6.302   4.256
   60   3HD1  ILE   6          HD13      ILE   6  -2.593   6.445   4.361
   61    H    ILE   7           HN       ILE   7  -4.639   3.636   3.901
   62    HA   ILE   7           HA       ILE   7  -5.782   1.790   1.901
   63    HB   ILE   7           HB       ILE   7  -6.514   2.453   4.774
   64   1HG1  ILE   7          HG12      ILE   7  -4.993   0.050   3.736
   65   2HG1  ILE   7          HG11      ILE   7  -4.181   1.509   4.309
   66   1HG2  ILE   7          HG21      ILE   7  -8.367   1.399   3.549
   67   2HG2  ILE   7          HG22      ILE   7  -7.679   0.265   4.712
   68   3HG2  ILE   7          HG23      ILE   7  -7.288   0.118   2.998
   69   1HD1  ILE   7          HD11      ILE   7  -5.759  -0.513   5.849
   70   2HD1  ILE   7          HD12      ILE   7  -5.795   1.163   6.396
   71   3HD1  ILE   7          HD13      ILE   7  -4.258   0.305   6.284
   72    H    ASN   8           HN       ASN   8  -7.266   2.594   0.475
   73    HA   ASN   8           HA       ASN   8  -9.067   4.815   1.375
   74   1HB   ASN   8          HB2       ASN   8  -7.799   4.007  -1.236
   75   2HB   ASN   8          HB1       ASN   8  -9.255   5.002  -1.239
   76   1HD2  ASN   8          HD21      ASN   8  -7.910   6.806  -2.114
   77   2HD2  ASN   8          HD22      ASN   8  -6.904   7.696  -1.061
   78    H    GLY   9           HN       GLY   9  -9.853   2.339   2.210
   79   1HA   GLY   9          HA2       GLY   9 -11.562   1.025   0.230
   80   2HA   GLY   9          HA1       GLY   9 -11.457   0.615   1.947
   81    H    LYS  10           HN       LYS  10 -13.890   0.972   0.355
   82    HA   LYS  10           HA       LYS  10 -15.201   3.434   0.675
   83   1HB   LYS  10          HB2       LYS  10 -16.145   0.566   0.740
   84   2HB   LYS  10          HB1       LYS  10 -17.262   1.932   0.709
   85   1HG   LYS  10          HG2       LYS  10 -15.070   1.964  -1.302
   86   2HG   LYS  10          HG1       LYS  10 -16.344   0.768  -1.543
   87   1HD   LYS  10          HD2       LYS  10 -17.960   2.360  -1.923
   88   2HD   LYS  10          HD1       LYS  10 -17.202   3.536  -0.850
   89   1HE   LYS  10          HE2       LYS  10 -15.292   3.335  -2.796
   90   2HE   LYS  10          HE1       LYS  10 -16.774   3.094  -3.744
   91   1HZ   LYS  10          HZ1       LYS  10 -16.159   5.476  -3.377
   92   2HZ   LYS  10          HZ2       LYS  10 -16.457   5.242  -1.721
   93   3HZ   LYS  10          HZ3       LYS  10 -17.716   5.062  -2.848
   94    H    THR  11           HN       THR  11 -14.593   0.897   3.044
   95    HA   THR  11           HA       THR  11 -15.938   2.581   5.136
   96    HB   THR  11           HB       THR  11 -15.595  -0.423   5.186
   97    HG1  THR  11           HG1      THR  11 -17.768  -0.442   4.384
   98   1HG2  THR  11          HG21      THR  11 -17.051   1.646   6.753
   99   2HG2  THR  11          HG22      THR  11 -16.300   0.145   7.295
  100   3HG2  THR  11          HG23      THR  11 -17.876   0.107   6.504
  101    H    LEU  12           HN       LEU  12 -13.286   0.309   4.424
  102    HA   LEU  12           HA       LEU  12 -11.972   0.857   7.015
  103   1HB   LEU  12          HB2       LEU  12 -11.256  -0.810   4.581
  104   2HB   LEU  12          HB1       LEU  12 -10.343  -0.807   6.090
  105    HG   LEU  12           HG       LEU  12 -13.299  -1.331   6.156
  106   1HD1  LEU  12          HD11      LEU  12 -11.887  -2.817   4.453
  107   2HD1  LEU  12          HD12      LEU  12 -13.104  -3.542   5.504
  108   3HD1  LEU  12          HD13      LEU  12 -11.398  -3.630   5.940
  109   1HD2  LEU  12          HD21      LEU  12 -12.425  -2.836   8.058
  110   2HD2  LEU  12          HD22      LEU  12 -12.300  -1.093   8.301
  111   3HD2  LEU  12          HD23      LEU  12 -10.877  -2.022   7.828
  112    H    LYS  13           HN       LYS  13  -9.923   1.908   7.184
  113    HA   LYS  13           HA       LYS  13  -8.628   3.068   4.811
  114   1HB   LYS  13          HB2       LYS  13 -10.450   4.553   6.656
  115   2HB   LYS  13          HB1       LYS  13  -9.006   5.394   6.091
  116   1HG   LYS  13          HG2       LYS  13  -9.816   4.377   3.746
  117   2HG   LYS  13          HG1       LYS  13 -11.383   4.464   4.551
  118   1HD   LYS  13          HD2       LYS  13  -9.499   6.817   4.581
  119   2HD   LYS  13          HD1       LYS  13 -10.586   6.545   3.219
  120   1HE   LYS  13          HE2       LYS  13 -12.531   6.589   4.718
  121   2HE   LYS  13          HE1       LYS  13 -11.462   6.790   6.121
  122   1HZ   LYS  13          HZ1       LYS  13 -10.624   8.822   5.218
  123   2HZ   LYS  13          HZ2       LYS  13 -12.320   8.923   5.222
  124   3HZ   LYS  13          HZ3       LYS  13 -11.488   8.610   3.774
  125    H    GLY  14           HN       GLY  14  -6.869   4.742   5.748
  126   1HA   GLY  14          HA2       GLY  14  -5.651   5.121   8.002
  127   2HA   GLY  14          HA1       GLY  14  -5.565   3.360   8.047
  128    H    GLU  15           HN       GLU  15  -3.157   4.112   8.144
  129    HA   GLU  15           HA       GLU  15  -2.095   4.146   5.339
  130   1HB   GLU  15          HB2       GLU  15  -0.312   5.654   6.209
  131   2HB   GLU  15          HB1       GLU  15  -1.916   6.364   6.387
  132   1HG   GLU  15          HG2       GLU  15  -1.986   5.620   8.742
  133   2HG   GLU  15          HG1       GLU  15  -0.379   4.916   8.566
  134    H    THR  16           HN       THR  16   0.196   3.287   5.252
  135    HA   THR  16           HA       THR  16   1.120   1.655   7.521
  136    HB   THR  16           HB       THR  16  -0.682   0.290   6.559
  137    HG1  THR  16           HG1      THR  16   0.636  -1.528   5.996
  138   1HG2  THR  16          HG21      THR  16  -0.883   1.049   4.326
  139   2HG2  THR  16          HG22      THR  16  -0.256  -0.591   4.173
  140   3HG2  THR  16          HG23      THR  16   0.829   0.788   3.989
  141    H    THR  17           HN       THR  17   3.288   0.973   7.243
  142    HA   THR  17           HA       THR  17   4.620   1.682   4.654
  143    HB   THR  17           HB       THR  17   6.470   2.620   6.100
  144    HG1  THR  17           HG1      THR  17   5.915   1.609   8.027
  145   1HG2  THR  17          HG21      THR  17   5.041   4.217   5.073
  146   2HG2  THR  17          HG22      THR  17   5.112   4.687   6.771
  147   3HG2  THR  17          HG23      THR  17   3.703   3.827   6.152
  148    H    THR  18           HN       THR  18   6.654   0.498   4.336
  149    HA   THR  18           HA       THR  18   7.149  -1.750   6.211
  150    HB   THR  18           HB       THR  18   5.859  -1.815   3.572
  151    HG1  THR  18           HG1      THR  18   6.432  -3.765   5.553
  152   1HG2  THR  18          HG21      THR  18   7.059  -3.785   2.692
  153   2HG2  THR  18          HG22      THR  18   8.273  -3.613   3.960
  154   3HG2  THR  18          HG23      THR  18   8.092  -2.354   2.736
  155    H    GLU  19           HN       GLU  19   9.283  -2.821   5.643
  156    HA   GLU  19           HA       GLU  19  11.195  -0.871   4.397
  157   1HB   GLU  19          HB2       GLU  19  11.229  -1.135   6.919
  158   2HB   GLU  19          HB1       GLU  19  11.689  -2.819   6.669
  159   1HG   GLU  19          HG2       GLU  19  13.508  -1.614   5.069
  160   2HG   GLU  19          HG1       GLU  19  13.283  -0.343   6.272
  161    H    ALA  20           HN       ALA  20  11.938  -1.767   2.503
  162    HA   ALA  20           HA       ALA  20  12.853  -4.589   2.497
  163   1HB   ALA  20          HB1       ALA  20  10.476  -3.454   1.077
  164   2HB   ALA  20          HB2       ALA  20  10.688  -5.048   1.805
  165   3HB   ALA  20          HB3       ALA  20  11.426  -4.686   0.245
  166    H    VAL  21           HN       VAL  21  13.518  -5.009  -0.019
  167    HA   VAL  21           HA       VAL  21  15.730  -3.260  -0.576
  168    HB   VAL  21           HB       VAL  21  15.539  -5.669  -1.190
  169   1HG1  VAL  21          HG11      VAL  21  13.711  -4.812  -3.425
  170   2HG1  VAL  21          HG12      VAL  21  13.096  -5.466  -1.906
  171   3HG1  VAL  21          HG13      VAL  21  14.134  -6.452  -2.936
  172   1HG2  VAL  21          HG21      VAL  21  16.192  -3.539  -3.158
  173   2HG2  VAL  21          HG22      VAL  21  16.129  -5.196  -3.759
  174   3HG2  VAL  21          HG23      VAL  21  17.236  -4.773  -2.453
  175    H    ASP  22           HN       ASP  22  12.497  -3.567  -1.950
  176    HA   ASP  22           HA       ASP  22  12.670  -0.852  -3.116
  177   1HB   ASP  22          HB2       ASP  22  12.258  -3.452  -4.619
  178   2HB   ASP  22          HB1       ASP  22  12.010  -1.855  -5.342
  179    H    ALA  23           HN       ALA  23  10.513  -0.073  -3.734
  180    HA   ALA  23           HA       ALA  23   8.398  -0.858  -1.975
  181   1HB   ALA  23          HB1       ALA  23   7.131   0.481  -3.960
  182   2HB   ALA  23          HB2       ALA  23   8.799   0.907  -4.341
  183   3HB   ALA  23          HB3       ALA  23   8.130   1.294  -2.756
  184    H    ALA  24           HN       ALA  24   9.319  -1.975  -5.178
  185    HA   ALA  24           HA       ALA  24   6.879  -3.206  -6.006
  186   1HB   ALA  24          HB1       ALA  24   9.630  -4.358  -6.481
  187   2HB   ALA  24          HB2       ALA  24   9.168  -2.814  -7.198
  188   3HB   ALA  24          HB3       ALA  24   8.267  -4.277  -7.597
  189    H    THR  25           HN       THR  25   9.617  -4.493  -4.107
  190    HA   THR  25           HA       THR  25   8.464  -7.108  -3.670
  191    HB   THR  25           HB       THR  25  10.621  -5.455  -2.316
  192    HG1  THR  25           HG1      THR  25  11.839  -6.336  -3.768
  193   1HG2  THR  25          HG21      THR  25   9.673  -7.103  -0.706
  194   2HG2  THR  25          HG22      THR  25  11.335  -7.492  -1.161
  195   3HG2  THR  25          HG23      THR  25   9.994  -8.390  -1.872
  196    H    ALA  26           HN       ALA  26   8.709  -4.190  -1.585
  197    HA   ALA  26           HA       ALA  26   7.271  -5.231   0.638
  198   1HB   ALA  26          HB1       ALA  26   6.818  -2.707   1.009
  199   2HB   ALA  26          HB2       ALA  26   7.704  -2.459  -0.501
  200   3HB   ALA  26          HB3       ALA  26   8.508  -3.205   0.880
  201    H    GLU  27           HN       GLU  27   6.079  -3.125  -2.000
  202    HA   GLU  27           HA       GLU  27   3.399  -2.888  -1.428
  203   1HB   GLU  27          HB2       GLU  27   4.634  -1.958  -3.377
  204   2HB   GLU  27          HB1       GLU  27   4.619  -3.553  -4.129
  205   1HG   GLU  27          HG2       GLU  27   2.032  -3.419  -3.782
  206   2HG   GLU  27          HG1       GLU  27   2.315  -1.685  -3.623
  207    H    LYS  28           HN       LYS  28   4.941  -5.819  -2.758
  208    HA   LYS  28           HA       LYS  28   2.520  -7.282  -3.327
  209   1HB   LYS  28          HB2       LYS  28   5.281  -8.223  -2.448
  210   2HB   LYS  28          HB1       LYS  28   4.064  -9.230  -3.230
  211   1HG   LYS  28          HG2       LYS  28   4.328  -8.192  -5.291
  212   2HG   LYS  28          HG1       LYS  28   4.909  -6.688  -4.575
  213   1HD   LYS  28          HD2       LYS  28   6.926  -7.509  -5.330
  214   2HD   LYS  28          HD1       LYS  28   6.886  -8.307  -3.758
  215   1HE   LYS  28          HE2       LYS  28   5.725 -10.267  -4.912
  216   2HE   LYS  28          HE1       LYS  28   6.152  -9.490  -6.450
  217   1HZ   LYS  28          HZ1       LYS  28   8.088 -10.067  -4.272
  218   2HZ   LYS  28          HZ2       LYS  28   8.446  -9.459  -5.818
  219   3HZ   LYS  28          HZ3       LYS  28   7.877 -11.050  -5.638
  220    H    VAL  29           HN       VAL  29   4.619  -7.053  -0.467
  221    HA   VAL  29           HA       VAL  29   3.063  -8.814   1.231
  222    HB   VAL  29           HB       VAL  29   5.165  -6.656   1.581
  223   1HG1  VAL  29          HG11      VAL  29   3.703  -6.527   3.581
  224   2HG1  VAL  29          HG12      VAL  29   5.295  -7.177   3.981
  225   3HG1  VAL  29          HG13      VAL  29   3.912  -8.263   3.833
  226   1HG2  VAL  29          HG21      VAL  29   6.492  -8.610   2.376
  227   2HG2  VAL  29          HG22      VAL  29   5.894  -8.824   0.730
  228   3HG2  VAL  29          HG23      VAL  29   5.098  -9.647   2.072
  229    H    LEU  30           HN       LEU  30   3.157  -5.268   0.725
  230    HA   LEU  30           HA       LEU  30   1.244  -4.511   2.685
  231   1HB   LEU  30          HB2       LEU  30   2.154  -3.429   0.018
  232   2HB   LEU  30          HB1       LEU  30   0.912  -2.591   0.936
  233    HG   LEU  30           HG       LEU  30   3.404  -1.873   1.237
  234   1HD1  LEU  30          HD11      LEU  30   1.720  -0.917   2.628
  235   2HD1  LEU  30          HD12      LEU  30   3.021  -1.464   3.694
  236   3HD1  LEU  30          HD13      LEU  30   1.538  -2.416   3.545
  237   1HD2  LEU  30          HD21      LEU  30   4.457  -3.066   3.197
  238   2HD2  LEU  30          HD22      LEU  30   4.501  -3.929   1.675
  239   3HD2  LEU  30          HD23      LEU  30   3.340  -4.383   2.920
  240    H    LYS  31           HN       LYS  31   0.886  -5.883  -0.534
  241    HA   LYS  31           HA       LYS  31  -1.952  -5.467  -0.901
  242   1HB   LYS  31          HB2       LYS  31   0.031  -6.403  -2.442
  243   2HB   LYS  31          HB1       LYS  31  -0.477  -7.938  -1.783
  244   1HG   LYS  31          HG2       LYS  31  -2.465  -6.020  -3.001
  245   2HG   LYS  31          HG1       LYS  31  -1.591  -7.192  -3.986
  246   1HD   LYS  31          HD2       LYS  31  -3.379  -7.832  -1.617
  247   2HD   LYS  31          HD1       LYS  31  -3.761  -8.120  -3.312
  248   1HE   LYS  31          HE2       LYS  31  -1.249  -9.342  -2.913
  249   2HE   LYS  31          HE1       LYS  31  -2.224  -9.785  -1.493
  250   1HZ   LYS  31          HZ1       LYS  31  -2.722 -11.320  -3.253
  251   2HZ   LYS  31          HZ2       LYS  31  -3.010 -10.056  -4.351
  252   3HZ   LYS  31          HZ3       LYS  31  -4.067 -10.308  -3.045
  253    H    GLN  32           HN       GLN  32   0.037  -8.015   0.537
  254    HA   GLN  32           HA       GLN  32  -1.932  -9.908   1.266
  255   1HB   GLN  32          HB2       GLN  32   0.689  -9.779   1.465
  256   2HB   GLN  32          HB1       GLN  32   0.335  -9.189   3.086
  257   1HG   GLN  32          HG2       GLN  32   0.460 -11.495   3.445
  258   2HG   GLN  32          HG1       GLN  32  -1.270 -11.263   3.194
  259   1HE2  GLN  32          HE21      GLN  32   1.134 -13.331   2.331
  260   2HE2  GLN  32          HE22      GLN  32   0.593 -13.789   0.780
  261    H    TYR  33           HN       TYR  33  -0.801  -6.988   2.959
  262    HA   TYR  33           HA       TYR  33  -2.437  -7.234   5.326
  263   1HB   TYR  33          HB2       TYR  33  -0.492  -5.744   5.126
  264   2HB   TYR  33          HB1       TYR  33  -1.286  -4.842   3.834
  265    HD1  TYR  33           HD1      TYR  33  -1.510  -5.772   7.413
  266    HD2  TYR  33           HD2      TYR  33  -2.854  -3.123   4.319
  267    HE1  TYR  33           HE1      TYR  33  -2.626  -4.369   9.110
  268    HE2  TYR  33           HE2      TYR  33  -3.969  -1.707   6.018
  269    HH   TYR  33           HH       TYR  33  -4.835  -1.865   8.265
  270    H    ILE  34           HN       ILE  34  -2.891  -5.680   2.168
  271    HA   ILE  34           HA       ILE  34  -5.519  -4.582   2.657
  272    HB   ILE  34           HB       ILE  34  -4.086  -5.469   0.130
  273   1HG1  ILE  34          HG12      ILE  34  -2.979  -3.743   1.701
  274   2HG1  ILE  34          HG11      ILE  34  -3.146  -3.301   0.006
  275   1HG2  ILE  34          HG21      ILE  34  -6.421  -3.565   0.455
  276   2HG2  ILE  34          HG22      ILE  34  -6.504  -5.185  -0.237
  277   3HG2  ILE  34          HG23      ILE  34  -5.586  -3.923  -1.057
  278   1HD1  ILE  34          HD11      ILE  34  -5.338  -2.559   1.911
  279   2HD1  ILE  34          HD12      ILE  34  -4.802  -1.738   0.446
  280   3HD1  ILE  34          HD13      ILE  34  -3.849  -1.614   1.925
  281    H    ASN  35           HN       ASN  35  -4.285  -7.722   1.659
  282    HA   ASN  35           HA       ASN  35  -6.608  -8.927   0.570
  283   1HB   ASN  35          HB2       ASN  35  -4.148  -9.705   0.763
  284   2HB   ASN  35          HB1       ASN  35  -4.610 -10.324   2.348
  285   1HD2  ASN  35          HD21      ASN  35  -6.173 -12.102   2.425
  286   2HD2  ASN  35          HD22      ASN  35  -6.537 -13.012   1.040
  287    H    ASP  36           HN       ASP  36  -5.738  -8.228   3.902
  288    HA   ASP  36           HA       ASP  36  -7.772  -9.966   5.092
  289   1HB   ASP  36          HB2       ASP  36  -5.486  -9.052   6.000
  290   2HB   ASP  36          HB1       ASP  36  -6.429  -7.623   6.426
  291    H    ASN  37           HN       ASN  37  -7.362  -6.405   4.879
  292    HA   ASN  37           HA       ASN  37  -9.945  -5.714   5.888
  293   1HB   ASN  37          HB2       ASN  37  -8.052  -4.320   3.963
  294   2HB   ASN  37          HB1       ASN  37  -9.427  -3.533   4.746
  295   1HD2  ASN  37          HD21      ASN  37  -8.218  -2.115   6.122
  296   2HD2  ASN  37          HD22      ASN  37  -7.200  -2.686   7.366
  297    H    GLY  38           HN       GLY  38  -8.848  -6.638   2.668
  298   1HA   GLY  38          HA2       GLY  38 -10.188  -7.441   0.882
  299   2HA   GLY  38          HA1       GLY  38 -11.628  -7.006   1.803
  300    H    ILE  39           HN       ILE  39  -8.969  -4.776   1.180
  301    HA   ILE  39           HA       ILE  39 -10.839  -3.150  -0.512
  302    HB   ILE  39           HB       ILE  39  -8.540  -2.332   1.298
  303   1HG1  ILE  39          HG12      ILE  39 -10.492  -3.153   2.562
  304   2HG1  ILE  39          HG11      ILE  39 -10.332  -1.403   2.742
  305   1HG2  ILE  39          HG21      ILE  39  -9.469  -0.029   0.934
  306   2HG2  ILE  39          HG22      ILE  39 -10.535  -0.701  -0.299
  307   3HG2  ILE  39          HG23      ILE  39  -8.786  -0.749  -0.524
  308   1HD1  ILE  39          HD11      ILE  39 -12.519  -1.330   2.140
  309   2HD1  ILE  39          HD12      ILE  39 -12.486  -2.968   1.486
  310   3HD1  ILE  39          HD13      ILE  39 -11.931  -1.614   0.502
  311    H    ASP  40           HN       ASP  40  -9.919  -4.553  -2.324
  312    HA   ASP  40           HA       ASP  40  -7.232  -3.546  -3.214
  313   1HB   ASP  40          HB2       ASP  40  -8.670  -6.184  -3.379
  314   2HB   ASP  40          HB1       ASP  40  -7.454  -5.783  -4.597
  315    H    GLY  41           HN       GLY  41  -8.090  -1.742  -4.397
  316   1HA   GLY  41          HA2       GLY  41  -9.785  -2.499  -6.748
  317   2HA   GLY  41          HA1       GLY  41  -9.950  -0.948  -5.919
  318    H    GLU  42           HN       GLU  42  -8.204   0.604  -6.125
  319    HA   GLU  42           HA       GLU  42  -6.305   0.035  -8.376
  320   1HB   GLU  42          HB2       GLU  42  -8.504   1.945  -8.123
  321   2HB   GLU  42          HB1       GLU  42  -6.981   2.757  -8.482
  322   1HG   GLU  42          HG2       GLU  42  -6.801   1.806 -10.557
  323   2HG   GLU  42          HG1       GLU  42  -7.553   0.295 -10.046
  324    H    TRP  43           HN       TRP  43  -4.244   0.321  -7.662
  325    HA   TRP  43           HA       TRP  43  -3.728   2.026  -5.271
  326   1HB   TRP  43          HB2       TRP  43  -2.106   0.004  -6.851
  327   2HB   TRP  43          HB1       TRP  43  -1.453   0.917  -5.503
  328    HD1  TRP  43           HD1      TRP  43  -5.043  -0.443  -5.334
  329    HE1  TRP  43           HE1      TRP  43  -5.116  -2.305  -3.570
  330    HE3  TRP  43           HE3      TRP  43  -0.081  -0.820  -4.263
  331    HZ2  TRP  43           HZ2      TRP  43  -3.318  -3.734  -1.881
  332    HZ3  TRP  43           HZ3      TRP  43   0.713  -2.430  -2.546
  333    HH2  TRP  43           HH2      TRP  43  -0.893  -3.882  -1.361
  334    H    THR  44           HN       THR  44  -1.708   3.413  -5.420
  335    HA   THR  44           HA       THR  44  -0.944   4.275  -8.152
  336    HB   THR  44           HB       THR  44  -1.497   6.617  -7.647
  337    HG1  THR  44           HG1      THR  44  -2.330   7.192  -5.743
  338   1HG2  THR  44          HG21      THR  44  -3.211   4.970  -8.618
  339   2HG2  THR  44          HG22      THR  44  -3.849   6.464  -7.931
  340   3HG2  THR  44          HG23      THR  44  -3.940   4.961  -7.012
  341    H    TYR  45           HN       TYR  45   1.210   4.687  -8.161
  342    HA   TYR  45           HA       TYR  45   2.674   4.730  -5.582
  343   1HB   TYR  45          HB2       TYR  45   3.352   3.190  -7.359
  344   2HB   TYR  45          HB1       TYR  45   3.492   4.522  -8.503
  345    HD1  TYR  45           HD1      TYR  45   4.655   4.043  -4.957
  346    HD2  TYR  45           HD2      TYR  45   5.717   4.908  -9.028
  347    HE1  TYR  45           HE1      TYR  45   7.013   4.405  -4.266
  348    HE2  TYR  45           HE2      TYR  45   8.069   5.268  -8.340
  349    HH   TYR  45           HH       TYR  45   9.569   4.666  -6.551
  350    H    ASP  46           HN       ASP  46   4.236   6.450  -5.135
  351    HA   ASP  46           HA       ASP  46   3.943   8.931  -6.788
  352   1HB   ASP  46          HB2       ASP  46   3.868   8.778  -3.753
  353   2HB   ASP  46          HB1       ASP  46   3.669  10.227  -4.732
  354    H    ASP  47           HN       ASP  47   5.934   9.707  -7.314
  355    HA   ASP  47           HA       ASP  47   8.372   8.549  -6.241
  356   1HB   ASP  47          HB2       ASP  47   8.041   9.365  -8.566
  357   2HB   ASP  47          HB1       ASP  47   7.890  11.011  -7.949
  358    H    ALA  48           HN       ALA  48   6.304  10.955  -5.010
  359    HA   ALA  48           HA       ALA  48   7.990  12.979  -4.003
  360   1HB   ALA  48          HB1       ALA  48   5.712  13.321  -3.679
  361   2HB   ALA  48          HB2       ALA  48   6.165  12.779  -2.063
  362   3HB   ALA  48          HB3       ALA  48   5.427  11.646  -3.199
  363    H    THR  49           HN       THR  49   6.765  10.336  -1.946
  364    HA   THR  49           HA       THR  49   9.482  10.092  -0.701
  365    HB   THR  49           HB       THR  49   8.020  11.503   0.682
  366    HG1  THR  49           HG1      THR  49   9.372   9.919   1.691
  367   1HG2  THR  49          HG21      THR  49   5.799  11.159   0.684
  368   2HG2  THR  49          HG22      THR  49   6.049   9.636   1.537
  369   3HG2  THR  49          HG23      THR  49   6.012   9.662  -0.227
  370    H    LYS  50           HN       LYS  50   8.149   8.435  -2.726
  371    HA   LYS  50           HA       LYS  50   7.767   6.162  -3.191
  372   1HB   LYS  50          HB2       LYS  50   9.047   5.758  -0.470
  373   2HB   LYS  50          HB1       LYS  50   9.012   4.608  -1.801
  374   1HG   LYS  50          HG2       LYS  50  10.366   7.318  -1.938
  375   2HG   LYS  50          HG1       LYS  50  11.206   5.808  -1.584
  376   1HD   LYS  50          HD2       LYS  50   9.553   6.254  -4.081
  377   2HD   LYS  50          HD1       LYS  50  11.297   6.503  -4.011
  378   1HE   LYS  50          HE2       LYS  50  11.104   4.008  -2.906
  379   2HE   LYS  50          HE1       LYS  50   9.772   3.969  -4.078
  380   1HZ   LYS  50          HZ1       LYS  50  12.605   4.689  -4.595
  381   2HZ   LYS  50          HZ2       LYS  50  11.353   4.969  -5.709
  382   3HZ   LYS  50          HZ3       LYS  50  11.743   3.382  -5.246
  383    H    THR  51           HN       THR  51   5.525   7.467  -2.172
  384    HA   THR  51           HA       THR  51   4.395   5.682  -0.067
  385    HB   THR  51           HB       THR  51   3.431   8.250  -1.382
  386    HG1  THR  51           HG1      THR  51   4.027   9.133   0.609
  387   1HG2  THR  51          HG21      THR  51   1.457   7.187  -0.646
  388   2HG2  THR  51          HG22      THR  51   1.900   8.222   0.712
  389   3HG2  THR  51          HG23      THR  51   2.252   6.494   0.768
  390    H    TRP  52           HN       TRP  52   2.066   4.960  -0.497
  391    HA   TRP  52           HA       TRP  52   1.579   4.384  -3.399
  392   1HB   TRP  52          HB2       TRP  52   1.713   2.564  -0.999
  393   2HB   TRP  52          HB1       TRP  52   0.827   2.101  -2.445
  394    HD1  TRP  52           HD1      TRP  52   4.334   2.601  -1.118
  395    HE1  TRP  52           HE1      TRP  52   6.022   1.732  -2.869
  396    HE3  TRP  52           HE3      TRP  52   1.164   1.729  -4.972
  397    HZ2  TRP  52           HZ2      TRP  52   6.002   0.775  -5.580
  398    HZ3  TRP  52           HZ3      TRP  52   1.996   0.834  -7.138
  399    HH2  TRP  52           HH2      TRP  52   4.413   0.355  -7.442
  400    H    THR  53           HN       THR  53  -0.737   3.022  -3.259
  401    HA   THR  53           HA       THR  53  -2.631   4.247  -1.368
  402    HB   THR  53           HB       THR  53  -2.957   4.725  -4.339
  403    HG1  THR  53           HG1      THR  53  -1.284   5.989  -4.001
  404   1HG2  THR  53          HG21      THR  53  -4.266   6.723  -3.112
  405   2HG2  THR  53          HG22      THR  53  -4.367   5.507  -1.839
  406   3HG2  THR  53          HG23      THR  53  -5.021   5.163  -3.440
  407    H    VAL  54           HN       VAL  54  -4.948   3.463  -2.007
  408    HA   VAL  54           HA       VAL  54  -5.211   1.119  -3.706
  409    HB   VAL  54           HB       VAL  54  -3.890   0.097  -1.947
  410   1HG1  VAL  54          HG11      VAL  54  -3.907   1.314  -0.032
  411   2HG1  VAL  54          HG12      VAL  54  -5.204   0.212   0.426
  412   3HG1  VAL  54          HG13      VAL  54  -5.586   1.802  -0.233
  413   1HG2  VAL  54          HG21      VAL  54  -6.256  -0.928  -2.705
  414   2HG2  VAL  54          HG22      VAL  54  -6.595  -0.721  -0.987
  415   3HG2  VAL  54          HG23      VAL  54  -5.233  -1.722  -1.502
  416    H    THR  55           HN       THR  55  -6.991   2.603  -4.310
  417    HA   THR  55           HA       THR  55  -9.162   3.040  -2.355
  418    HB   THR  55           HB       THR  55  -9.121   3.624  -5.325
  419    HG1  THR  55           HG1      THR  55  -7.970   5.426  -4.893
  420   1HG2  THR  55          HG21      THR  55 -11.237   4.137  -4.454
  421   2HG2  THR  55          HG22      THR  55 -10.390   5.679  -4.346
  422   3HG2  THR  55          HG23      THR  55 -10.576   4.673  -2.909
  423    H    GLU  56           HN       GLU  56 -11.052   1.842  -2.300
  424    HA   GLU  56           HA       GLU  56 -11.217  -0.746  -3.506
  425   1HB   GLU  56          HB2       GLU  56 -12.423   0.436  -1.467
  426   2HB   GLU  56          HB1       GLU  56 -13.644   0.820  -2.680
  427   1HG   GLU  56          HG2       GLU  56 -13.303  -1.776  -3.264
  428   2HG   GLU  56          HG1       GLU  56 -12.853  -1.826  -1.559
  Start of MODEL   26
    1   1H    THR   1          HT1       THR   1  14.700   2.046   1.463
    2   2H    THR   1          HT2       THR   1  15.245   1.506   2.979
    3   3H    THR   1          HT3       THR   1  15.991   2.835   2.229
    4    HA   THR   1           HA       THR   1  14.570   3.691   3.939
    5    HB   THR   1           HB       THR   1  13.091   5.030   2.419
    6    HG1  THR   1           HG1      THR   1  12.407   3.724   0.874
    7   1HG2  THR   1          HG21      THR   1  14.871   6.086   1.283
    8   2HG2  THR   1          HG22      THR   1  15.751   4.571   1.077
    9   3HG2  THR   1          HG23      THR   1  15.647   5.321   2.670
   10    H    THR   2           HN       THR   2  12.209   3.999   4.568
   11    HA   THR   2           HA       THR   2  10.844   1.365   4.605
   12    HB   THR   2           HB       THR   2  10.178   3.965   6.017
   13    HG1  THR   2           HG1      THR   2  11.704   3.514   7.397
   14   1HG2  THR   2          HG21      THR   2   9.675   1.203   7.068
   15   2HG2  THR   2          HG22      THR   2   8.581   1.874   5.859
   16   3HG2  THR   2          HG23      THR   2   8.804   2.700   7.401
   17    H    PHE   3           HN       PHE   3   9.188   0.970   3.204
   18    HA   PHE   3           HA       PHE   3   8.093   3.079   1.495
   19   1HB   PHE   3          HB2       PHE   3   7.419   0.144   1.896
   20   2HB   PHE   3          HB1       PHE   3   6.812   1.142   0.575
   21    HD1  PHE   3           HD1      PHE   3   8.952   2.679  -0.419
   22    HD2  PHE   3           HD2      PHE   3   9.113  -1.300   1.197
   23    HE1  PHE   3           HE1      PHE   3  11.027   2.240  -1.704
   24    HE2  PHE   3           HE2      PHE   3  11.188  -1.736  -0.089
   25    HZ   PHE   3           HZ       PHE   3  12.144   0.034  -1.538
   26    H    LYS   4           HN       LYS   4   5.672   3.370   1.326
   27    HA   LYS   4           HA       LYS   4   4.198   2.884   3.880
   28   1HB   LYS   4          HB2       LYS   4   5.408   5.145   3.774
   29   2HB   LYS   4          HB1       LYS   4   4.296   5.563   2.477
   30   1HG   LYS   4          HG2       LYS   4   2.378   5.167   3.952
   31   2HG   LYS   4          HG1       LYS   4   3.465   4.701   5.259
   32   1HD   LYS   4          HD2       LYS   4   4.190   6.865   5.620
   33   2HD   LYS   4          HD1       LYS   4   3.905   7.349   3.949
   34   1HE   LYS   4          HE2       LYS   4   2.042   8.373   4.810
   35   2HE   LYS   4          HE1       LYS   4   1.350   6.738   4.801
   36   1HZ   LYS   4          HZ1       LYS   4   3.012   7.790   7.023
   37   2HZ   LYS   4          HZ2       LYS   4   2.090   6.363   7.005
   38   3HZ   LYS   4          HZ3       LYS   4   1.318   7.876   7.018
   39    H    LEU   5           HN       LEU   5   1.889   2.961   3.605
   40    HA   LEU   5           HA       LEU   5   0.779   3.434   0.904
   41   1HB   LEU   5          HB2       LEU   5   1.681   0.965   1.357
   42   2HB   LEU   5          HB1       LEU   5   0.152   0.809   2.213
   43    HG   LEU   5           HG       LEU   5  -0.190   2.128  -0.377
   44   1HD1  LEU   5          HD11      LEU   5   0.468   0.450  -1.860
   45   2HD1  LEU   5          HD12      LEU   5   0.513  -0.787  -0.593
   46   3HD1  LEU   5          HD13      LEU   5   1.792   0.429  -0.688
   47   1HD2  LEU   5          HD21      LEU   5  -2.058   1.260   0.901
   48   2HD2  LEU   5          HD22      LEU   5  -1.338  -0.350   0.939
   49   3HD2  LEU   5          HD23      LEU   5  -1.919   0.320  -0.585
   50    H    ILE   6           HN       ILE   6  -1.207   4.367   1.156
   51    HA   ILE   6           HA       ILE   6  -2.451   4.337   3.864
   52    HB   ILE   6           HB       ILE   6  -2.758   6.072   1.400
   53   1HG1  ILE   6          HG12      ILE   6  -0.606   6.275   2.621
   54   2HG1  ILE   6          HG11      ILE   6  -1.569   7.746   2.750
   55   1HG2  ILE   6          HG21      ILE   6  -4.191   6.068   4.045
   56   2HG2  ILE   6          HG22      ILE   6  -4.851   6.302   2.426
   57   3HG2  ILE   6          HG23      ILE   6  -3.923   7.590   3.195
   58   1HD1  ILE   6          HD11      ILE   6  -2.374   6.132   4.918
   59   2HD1  ILE   6          HD12      ILE   6  -1.372   7.581   4.991
   60   3HD1  ILE   6          HD13      ILE   6  -0.617   5.994   4.854
   61    H    ILE   7           HN       ILE   7  -4.490   3.473   4.178
   62    HA   ILE   7           HA       ILE   7  -5.666   1.890   1.968
   63    HB   ILE   7           HB       ILE   7  -6.330   2.154   4.922
   64   1HG1  ILE   7          HG12      ILE   7  -4.882  -0.102   3.514
   65   2HG1  ILE   7          HG11      ILE   7  -4.028   1.245   4.268
   66   1HG2  ILE   7          HG21      ILE   7  -7.406  -0.131   4.454
   67   2HG2  ILE   7          HG22      ILE   7  -7.295   0.291   2.745
   68   3HG2  ILE   7          HG23      ILE   7  -8.262   1.282   3.836
   69   1HD1  ILE   7          HD11      ILE   7  -4.081  -0.210   6.060
   70   2HD1  ILE   7          HD12      ILE   7  -5.590  -0.961   5.540
   71   3HD1  ILE   7          HD13      ILE   7  -5.615   0.621   6.321
   72    H    ASN   8           HN       ASN   8  -7.189   2.866   0.705
   73    HA   ASN   8           HA       ASN   8  -8.897   5.014   1.912
   74   1HB   ASN   8          HB2       ASN   8  -7.647   4.492  -0.754
   75   2HB   ASN   8          HB1       ASN   8  -9.196   5.334  -0.739
   76   1HD2  ASN   8          HD21      ASN   8  -6.944   6.750  -1.612
   77   2HD2  ASN   8          HD22      ASN   8  -6.508   7.915  -0.445
   78    H    GLY   9           HN       GLY   9  -9.708   2.478   2.527
   79   1HA   GLY   9          HA2       GLY   9 -11.576   1.462   0.503
   80   2HA   GLY   9          HA1       GLY   9 -11.346   0.806   2.129
   81    H    LYS  10           HN       LYS  10 -13.845   1.581   0.653
   82    HA   LYS  10           HA       LYS  10 -15.024   3.952   1.605
   83   1HB   LYS  10          HB2       LYS  10 -16.227   1.217   1.087
   84   2HB   LYS  10          HB1       LYS  10 -17.147   2.719   1.177
   85   1HG   LYS  10          HG2       LYS  10 -15.581   3.597  -0.662
   86   2HG   LYS  10          HG1       LYS  10 -15.084   1.918  -0.881
   87   1HD   LYS  10          HD2       LYS  10 -17.119   1.284  -1.747
   88   2HD   LYS  10          HD1       LYS  10 -18.013   2.465  -0.790
   89   1HE   LYS  10          HE2       LYS  10 -17.803   4.100  -2.383
   90   2HE   LYS  10          HE1       LYS  10 -16.155   3.602  -2.813
   91   1HZ   LYS  10          HZ1       LYS  10 -17.791   3.055  -4.557
   92   2HZ   LYS  10          HZ2       LYS  10 -18.608   2.053  -3.455
   93   3HZ   LYS  10          HZ3       LYS  10 -17.021   1.679  -3.933
   94    H    THR  11           HN       THR  11 -14.584   0.841   3.223
   95    HA   THR  11           HA       THR  11 -15.907   1.963   5.674
   96    HB   THR  11           HB       THR  11 -15.438  -0.928   4.887
   97    HG1  THR  11           HG1      THR  11 -16.836  -0.139   3.407
   98   1HG2  THR  11          HG21      THR  11 -17.487  -1.071   6.529
   99   2HG2  THR  11          HG22      THR  11 -16.893   0.490   7.094
  100   3HG2  THR  11          HG23      THR  11 -15.854  -0.932   7.178
  101    H    LEU  12           HN       LEU  12 -13.013   0.440   4.367
  102    HA   LEU  12           HA       LEU  12 -11.763   0.470   7.091
  103   1HB   LEU  12          HB2       LEU  12 -11.089  -1.024   4.535
  104   2HB   LEU  12          HB1       LEU  12 -10.201  -1.173   6.051
  105    HG   LEU  12           HG       LEU  12 -12.731  -1.613   6.939
  106   1HD1  LEU  12          HD11      LEU  12 -13.203  -1.543   4.279
  107   2HD1  LEU  12          HD12      LEU  12 -14.123  -2.562   5.384
  108   3HD1  LEU  12          HD13      LEU  12 -12.790  -3.248   4.455
  109   1HD2  LEU  12          HD21      LEU  12 -11.116  -3.169   7.574
  110   2HD2  LEU  12          HD22      LEU  12 -10.565  -3.425   5.918
  111   3HD2  LEU  12          HD23      LEU  12 -12.087  -4.132   6.460
  112    H    LYS  13           HN       LYS  13  -9.829   1.615   7.379
  113    HA   LYS  13           HA       LYS  13  -8.464   2.848   5.062
  114   1HB   LYS  13          HB2       LYS  13 -10.080   4.311   7.153
  115   2HB   LYS  13          HB1       LYS  13  -8.779   5.119   6.278
  116   1HG   LYS  13          HG2       LYS  13  -9.908   4.319   4.131
  117   2HG   LYS  13          HG1       LYS  13 -11.291   3.883   5.134
  118   1HD   LYS  13          HD2       LYS  13 -10.107   6.636   5.352
  119   2HD   LYS  13          HD1       LYS  13 -11.211   6.261   4.028
  120   1HE   LYS  13          HE2       LYS  13 -12.671   5.230   6.022
  121   2HE   LYS  13          HE1       LYS  13 -11.769   6.438   6.960
  122   1HZ   LYS  13          HZ1       LYS  13 -12.382   8.126   5.381
  123   2HZ   LYS  13          HZ2       LYS  13 -13.795   7.364   5.937
  124   3HZ   LYS  13          HZ3       LYS  13 -13.174   6.991   4.401
  125    H    GLY  14           HN       GLY  14  -6.739   4.513   6.198
  126   1HA   GLY  14          HA2       GLY  14  -5.498   4.663   8.449
  127   2HA   GLY  14          HA1       GLY  14  -5.417   2.905   8.341
  128    H    GLU  15           HN       GLU  15  -3.058   3.165   8.379
  129    HA   GLU  15           HA       GLU  15  -1.973   3.615   5.641
  130   1HB   GLU  15          HB2       GLU  15  -0.170   5.018   6.618
  131   2HB   GLU  15          HB1       GLU  15  -1.759   5.731   6.888
  132   1HG   GLU  15          HG2       GLU  15  -0.960   5.897   9.036
  133   2HG   GLU  15          HG1       GLU  15  -1.578   4.249   9.131
  134    H    THR  16           HN       THR  16   0.342   2.755   5.519
  135    HA   THR  16           HA       THR  16   1.198   0.896   7.630
  136    HB   THR  16           HB       THR  16  -0.635  -0.331   6.547
  137    HG1  THR  16           HG1      THR  16   0.522  -2.154   6.153
  138   1HG2  THR  16          HG21      THR  16   0.922   0.307   4.032
  139   2HG2  THR  16          HG22      THR  16  -0.774   0.644   4.382
  140   3HG2  THR  16          HG23      THR  16  -0.245  -1.015   4.103
  141    H    THR  17           HN       THR  17   3.335   0.124   7.274
  142    HA   THR  17           HA       THR  17   4.708   1.046   4.777
  143    HB   THR  17           HB       THR  17   6.594   1.746   6.297
  144    HG1  THR  17           HG1      THR  17   5.850   0.453   8.073
  145   1HG2  THR  17          HG21      THR  17   3.879   3.047   6.543
  146   2HG2  THR  17          HG22      THR  17   5.212   3.503   5.483
  147   3HG2  THR  17          HG23      THR  17   5.336   3.774   7.221
  148    H    THR  18           HN       THR  18   6.684  -0.195   4.330
  149    HA   THR  18           HA       THR  18   7.063  -2.649   5.955
  150    HB   THR  18           HB       THR  18   5.767  -2.376   3.333
  151    HG1  THR  18           HG1      THR  18   5.023  -3.580   5.126
  152   1HG2  THR  18          HG21      THR  18   8.061  -4.357   3.507
  153   2HG2  THR  18          HG22      THR  18   8.007  -2.933   2.468
  154   3HG2  THR  18          HG23      THR  18   6.867  -4.256   2.211
  155    H    GLU  19           HN       GLU  19   9.159  -3.718   5.375
  156    HA   GLU  19           HA       GLU  19  11.160  -1.749   4.309
  157   1HB   GLU  19          HB2       GLU  19  11.137  -2.354   6.795
  158   2HB   GLU  19          HB1       GLU  19  11.609  -3.983   6.308
  159   1HG   GLU  19          HG2       GLU  19  13.430  -2.568   4.907
  160   2HG   GLU  19          HG1       GLU  19  13.185  -1.460   6.258
  161    H    ALA  20           HN       ALA  20  11.881  -2.446   2.329
  162    HA   ALA  20           HA       ALA  20  12.660  -5.286   1.982
  163   1HB   ALA  20          HB1       ALA  20  11.251  -5.110  -0.245
  164   2HB   ALA  20          HB2       ALA  20  10.381  -3.858   0.644
  165   3HB   ALA  20          HB3       ALA  20  10.445  -5.506   1.273
  166    H    VAL  21           HN       VAL  21  13.401  -5.465  -0.506
  167    HA   VAL  21           HA       VAL  21  15.658  -3.732  -0.858
  168    HB   VAL  21           HB       VAL  21  15.408  -6.050  -1.730
  169   1HG1  VAL  21          HG11      VAL  21  12.977  -5.695  -2.437
  170   2HG1  VAL  21          HG12      VAL  21  13.995  -6.605  -3.554
  171   3HG1  VAL  21          HG13      VAL  21  13.629  -4.911  -3.877
  172   1HG2  VAL  21          HG21      VAL  21  17.139  -4.883  -2.803
  173   2HG2  VAL  21          HG22      VAL  21  16.016  -3.794  -3.617
  174   3HG2  VAL  21          HG23      VAL  21  16.162  -5.469  -4.149
  175    H    ASP  22           HN       ASP  22  12.437  -3.783  -2.293
  176    HA   ASP  22           HA       ASP  22  12.716  -0.966  -3.162
  177   1HB   ASP  22          HB2       ASP  22  12.236  -3.379  -4.934
  178   2HB   ASP  22          HB1       ASP  22  12.050  -1.707  -5.488
  179    H    ALA  23           HN       ALA  23  10.590  -0.063  -3.748
  180    HA   ALA  23           HA       ALA  23   8.432  -0.920  -2.081
  181   1HB   ALA  23          HB1       ALA  23   8.338   1.317  -2.712
  182   2HB   ALA  23          HB2       ALA  23   7.195   0.632  -3.867
  183   3HB   ALA  23          HB3       ALA  23   8.851   0.976  -4.365
  184    H    ALA  24           HN       ALA  24   9.349  -1.803  -5.358
  185    HA   ALA  24           HA       ALA  24   6.883  -2.881  -6.308
  186   1HB   ALA  24          HB1       ALA  24   9.604  -4.083  -6.834
  187   2HB   ALA  24          HB2       ALA  24   9.194  -2.479  -7.443
  188   3HB   ALA  24          HB3       ALA  24   8.259  -3.883  -7.957
  189    H    THR  25           HN       THR  25   9.557  -4.440  -4.520
  190    HA   THR  25           HA       THR  25   8.291  -7.025  -4.293
  191    HB   THR  25           HB       THR  25  10.505  -5.576  -2.803
  192    HG1  THR  25           HG1      THR  25  11.241  -6.096  -4.739
  193   1HG2  THR  25          HG21      THR  25   9.477  -7.299  -1.326
  194   2HG2  THR  25          HG22      THR  25  11.123  -7.725  -1.805
  195   3HG2  THR  25          HG23      THR  25   9.748  -8.507  -2.586
  196    H    ALA  26           HN       ALA  26   8.617  -4.281  -1.999
  197    HA   ALA  26           HA       ALA  26   7.148  -5.427   0.146
  198   1HB   ALA  26          HB1       ALA  26   8.438  -3.449   0.508
  199   2HB   ALA  26          HB2       ALA  26   6.759  -2.932   0.693
  200   3HB   ALA  26          HB3       ALA  26   7.632  -2.593  -0.807
  201    H    GLU  27           HN       GLU  27   5.996  -3.066  -2.285
  202    HA   GLU  27           HA       GLU  27   3.323  -2.841  -1.708
  203   1HB   GLU  27          HB2       GLU  27   4.583  -1.762  -3.561
  204   2HB   GLU  27          HB1       GLU  27   4.539  -3.282  -4.455
  205   1HG   GLU  27          HG2       GLU  27   1.957  -3.131  -4.113
  206   2HG   GLU  27          HG1       GLU  27   2.268  -1.427  -3.780
  207    H    LYS  28           HN       LYS  28   4.810  -5.683  -3.266
  208    HA   LYS  28           HA       LYS  28   2.360  -7.026  -3.988
  209   1HB   LYS  28          HB2       LYS  28   5.091  -8.101  -3.171
  210   2HB   LYS  28          HB1       LYS  28   3.857  -9.018  -4.034
  211   1HG   LYS  28          HG2       LYS  28   4.139  -7.811  -6.002
  212   2HG   LYS  28          HG1       LYS  28   4.772  -6.395  -5.163
  213   1HD   LYS  28          HD2       LYS  28   6.765  -7.205  -5.975
  214   2HD   LYS  28          HD1       LYS  28   6.686  -8.166  -4.498
  215   1HE   LYS  28          HE2       LYS  28   7.040  -9.856  -6.066
  216   2HE   LYS  28          HE1       LYS  28   5.266  -9.799  -6.082
  217   1HZ   LYS  28          HZ1       LYS  28   7.066  -8.254  -7.875
  218   2HZ   LYS  28          HZ2       LYS  28   5.368  -8.173  -7.871
  219   3HZ   LYS  28          HZ3       LYS  28   6.153  -9.609  -8.328
  220    H    VAL  29           HN       VAL  29   4.433  -7.121  -1.097
  221    HA   VAL  29           HA       VAL  29   2.796  -8.970   0.421
  222    HB   VAL  29           HB       VAL  29   4.947  -6.911   1.009
  223   1HG1  VAL  29          HG11      VAL  29   5.028  -7.696   3.339
  224   2HG1  VAL  29          HG12      VAL  29   3.634  -8.738   3.051
  225   3HG1  VAL  29          HG13      VAL  29   3.450  -6.982   2.991
  226   1HG2  VAL  29          HG21      VAL  29   4.808  -9.937   1.129
  227   2HG2  VAL  29          HG22      VAL  29   6.210  -8.986   1.620
  228   3HG2  VAL  29          HG23      VAL  29   5.676  -8.967  -0.061
  229    H    LEU  30           HN       LEU  30   2.904  -5.425   0.063
  230    HA   LEU  30           HA       LEU  30   1.034  -4.828   2.151
  231   1HB   LEU  30          HB2       LEU  30   1.993  -3.462  -0.372
  232   2HB   LEU  30          HB1       LEU  30   0.786  -2.701   0.651
  233    HG   LEU  30           HG       LEU  30   3.335  -2.143   0.988
  234   1HD1  LEU  30          HD11      LEU  30   1.684  -1.200   2.432
  235   2HD1  LEU  30          HD12      LEU  30   2.948  -1.888   3.459
  236   3HD1  LEU  30          HD13      LEU  30   1.418  -2.748   3.238
  237   1HD2  LEU  30          HD21      LEU  30   4.288  -3.542   2.862
  238   2HD2  LEU  30          HD22      LEU  30   4.300  -4.287   1.278
  239   3HD2  LEU  30          HD23      LEU  30   3.097  -4.766   2.471
  240    H    LYS  31           HN       LYS  31   0.700  -5.810  -1.212
  241    HA   LYS  31           HA       LYS  31  -2.116  -5.273  -1.573
  242   1HB   LYS  31          HB2       LYS  31  -0.127  -6.095  -3.175
  243   2HB   LYS  31          HB1       LYS  31  -0.711  -7.675  -2.713
  244   1HG   LYS  31          HG2       LYS  31  -2.591  -5.542  -3.728
  245   2HG   LYS  31          HG1       LYS  31  -1.745  -6.627  -4.830
  246   1HD   LYS  31          HD2       LYS  31  -3.599  -7.469  -2.578
  247   2HD   LYS  31          HD1       LYS  31  -3.970  -7.527  -4.300
  248   1HE   LYS  31          HE2       LYS  31  -1.512  -8.897  -4.019
  249   2HE   LYS  31          HE1       LYS  31  -2.546  -9.478  -2.694
  250   1HZ   LYS  31          HZ1       LYS  31  -3.372  -9.256  -5.546
  251   2HZ   LYS  31          HZ2       LYS  31  -4.338  -9.828  -4.271
  252   3HZ   LYS  31          HZ3       LYS  31  -2.967 -10.704  -4.761
  253    H    GLN  32           HN       GLN  32  -0.259  -8.078  -0.445
  254    HA   GLN  32           HA       GLN  32  -2.352  -9.922   0.037
  255   1HB   GLN  32          HB2       GLN  32   0.395  -9.387   1.018
  256   2HB   GLN  32          HB1       GLN  32  -0.600 -10.452   2.010
  257   1HG   GLN  32          HG2       GLN  32  -0.603 -10.935  -0.930
  258   2HG   GLN  32          HG1       GLN  32   0.849 -11.391  -0.036
  259   1HE2  GLN  32          HE21      GLN  32   0.465 -13.694  -0.185
  260   2HE2  GLN  32          HE22      GLN  32  -0.828 -14.448   0.634
  261    H    TYR  33           HN       TYR  33  -1.085  -7.286   2.057
  262    HA   TYR  33           HA       TYR  33  -2.711  -7.768   4.398
  263   1HB   TYR  33          HB2       TYR  33  -0.712  -6.349   4.384
  264   2HB   TYR  33          HB1       TYR  33  -1.454  -5.265   3.208
  265    HD1  TYR  33           HD1      TYR  33  -1.742  -6.598   6.652
  266    HD2  TYR  33           HD2      TYR  33  -2.947  -3.543   3.891
  267    HE1  TYR  33           HE1      TYR  33  -2.803  -5.355   8.501
  268    HE2  TYR  33           HE2      TYR  33  -4.006  -2.287   5.745
  269    HH   TYR  33           HH       TYR  33  -3.398  -2.471   8.677
  270    H    ILE  34           HN       ILE  34  -3.135  -5.825   1.458
  271    HA   ILE  34           HA       ILE  34  -5.675  -4.642   2.132
  272    HB   ILE  34           HB       ILE  34  -4.350  -5.334  -0.509
  273   1HG1  ILE  34          HG12      ILE  34  -3.140  -3.842   1.226
  274   2HG1  ILE  34          HG11      ILE  34  -3.284  -3.225  -0.415
  275   1HG2  ILE  34          HG21      ILE  34  -5.782  -3.583  -1.490
  276   2HG2  ILE  34          HG22      ILE  34  -6.582  -3.366   0.067
  277   3HG2  ILE  34          HG23      ILE  34  -6.751  -4.889  -0.806
  278   1HD1  ILE  34          HD11      ILE  34  -3.908  -1.733   1.714
  279   2HD1  ILE  34          HD12      ILE  34  -5.459  -2.550   1.521
  280   3HD1  ILE  34          HD13      ILE  34  -4.797  -1.592   0.197
  281    H    ASN  35           HN       ASN  35  -4.704  -7.745   0.783
  282    HA   ASN  35           HA       ASN  35  -7.156  -8.634  -0.348
  283   1HB   ASN  35          HB2       ASN  35  -4.825  -9.649  -0.453
  284   2HB   ASN  35          HB1       ASN  35  -5.122 -10.298   1.160
  285   1HD2  ASN  35          HD21      ASN  35  -4.832 -11.749  -1.500
  286   2HD2  ASN  35          HD22      ASN  35  -6.246 -12.678  -1.641
  287    H    ASP  36           HN       ASP  36  -6.098  -8.427   3.001
  288    HA   ASP  36           HA       ASP  36  -8.212 -10.131   4.080
  289   1HB   ASP  36          HB2       ASP  36  -6.058  -8.304   5.093
  290   2HB   ASP  36          HB1       ASP  36  -7.328  -8.811   6.208
  291    H    ASN  37           HN       ASN  37  -7.630  -6.605   3.930
  292    HA   ASN  37           HA       ASN  37 -10.128  -5.879   5.211
  293   1HB   ASN  37          HB2       ASN  37  -8.122  -4.424   3.460
  294   2HB   ASN  37          HB1       ASN  37  -9.481  -3.616   4.249
  295   1HD2  ASN  37          HD21      ASN  37  -8.376  -2.426   5.867
  296   2HD2  ASN  37          HD22      ASN  37  -7.401  -3.148   7.066
  297    H    GLY  38           HN       GLY  38  -9.158  -6.551   1.897
  298   1HA   GLY  38          HA2       GLY  38 -10.568  -7.016   0.050
  299   2HA   GLY  38          HA1       GLY  38 -11.961  -6.597   1.048
  300    H    ILE  39           HN       ILE  39  -9.185  -4.474   0.710
  301    HA   ILE  39           HA       ILE  39 -10.941  -2.522  -0.740
  302    HB   ILE  39           HB       ILE  39  -8.538  -2.132   1.079
  303   1HG1  ILE  39          HG12      ILE  39 -10.526  -2.955   2.287
  304   2HG1  ILE  39          HG11      ILE  39 -10.204  -1.269   2.697
  305   1HG2  ILE  39          HG21      ILE  39  -9.477   0.278   1.059
  306   2HG2  ILE  39          HG22      ILE  39 -10.341  -0.215  -0.398
  307   3HG2  ILE  39          HG23      ILE  39  -8.578  -0.258  -0.360
  308   1HD1  ILE  39          HD11      ILE  39 -12.384  -0.911   2.182
  309   2HD1  ILE  39          HD12      ILE  39 -12.526  -2.452   1.337
  310   3HD1  ILE  39          HD13      ILE  39 -11.873  -1.044   0.500
  311    H    ASP  40           HN       ASP  40 -10.155  -3.804  -2.725
  312    HA   ASP  40           HA       ASP  40  -7.436  -2.862  -3.584
  313   1HB   ASP  40          HB2       ASP  40  -7.726  -5.316  -3.272
  314   2HB   ASP  40          HB1       ASP  40  -9.051  -5.288  -4.441
  315    H    GLY  41           HN       GLY  41  -7.955  -0.997  -4.749
  316   1HA   GLY  41          HA2       GLY  41  -9.820  -1.370  -7.054
  317   2HA   GLY  41          HA1       GLY  41  -9.907   0.088  -6.060
  318    H    GLU  42           HN       GLU  42  -8.081   1.561  -6.104
  319    HA   GLU  42           HA       GLU  42  -6.210   1.154  -8.412
  320   1HB   GLU  42          HB2       GLU  42  -8.309   3.153  -7.925
  321   2HB   GLU  42          HB1       GLU  42  -6.748   3.882  -8.298
  322   1HG   GLU  42          HG2       GLU  42  -6.689   3.012 -10.430
  323   2HG   GLU  42          HG1       GLU  42  -7.629   1.586  -9.989
  324    H    TRP  43           HN       TRP  43  -4.144   1.275  -7.653
  325    HA   TRP  43           HA       TRP  43  -3.587   2.714  -5.104
  326   1HB   TRP  43          HB2       TRP  43  -2.018   0.807  -6.870
  327   2HB   TRP  43          HB1       TRP  43  -1.355   1.550  -5.426
  328    HD1  TRP  43           HD1      TRP  43  -4.994   0.311  -5.443
  329    HE1  TRP  43           HE1      TRP  43  -5.161  -1.719  -3.884
  330    HE3  TRP  43           HE3      TRP  43  -0.067  -0.353  -4.353
  331    HZ2  TRP  43           HZ2      TRP  43  -3.442  -3.384  -2.337
  332    HZ3  TRP  43           HZ3      TRP  43   0.641  -2.161  -2.804
  333    HH2  TRP  43           HH2      TRP  43  -1.032  -3.669  -1.800
  334    H    THR  44           HN       THR  44  -1.565   4.073  -5.083
  335    HA   THR  44           HA       THR  44  -0.656   5.142  -7.686
  336    HB   THR  44           HB       THR  44  -1.240   7.460  -7.001
  337    HG1  THR  44           HG1      THR  44  -2.606   7.716  -5.219
  338   1HG2  THR  44          HG21      THR  44  -2.794   5.936  -8.356
  339   2HG2  THR  44          HG22      THR  44  -3.540   7.336  -7.585
  340   3HG2  THR  44          HG23      THR  44  -3.715   5.735  -6.865
  341    H    TYR  45           HN       TYR  45   1.496   5.585  -7.518
  342    HA   TYR  45           HA       TYR  45   2.821   5.329  -4.903
  343   1HB   TYR  45          HB2       TYR  45   3.723   4.232  -6.888
  344   2HB   TYR  45          HB1       TYR  45   3.770   5.762  -7.761
  345    HD1  TYR  45           HD1      TYR  45   5.181   3.978  -4.799
  346    HD2  TYR  45           HD2      TYR  45   5.640   7.204  -7.595
  347    HE1  TYR  45           HE1      TYR  45   7.456   4.419  -3.915
  348    HE2  TYR  45           HE2      TYR  45   7.915   7.647  -6.713
  349    HH   TYR  45           HH       TYR  45   9.045   7.056  -4.169
  350    H    ASP  46           HN       ASP  46   4.557   7.020  -4.357
  351    HA   ASP  46           HA       ASP  46   3.904   9.773  -5.312
  352   1HB   ASP  46          HB2       ASP  46   4.120   8.955  -2.391
  353   2HB   ASP  46          HB1       ASP  46   3.728  10.558  -3.005
  354    H    ASP  47           HN       ASP  47   5.791  10.835  -5.752
  355    HA   ASP  47           HA       ASP  47   8.376   9.630  -5.176
  356   1HB   ASP  47          HB2       ASP  47   7.229  11.943  -6.624
  357   2HB   ASP  47          HB1       ASP  47   8.884  12.166  -6.057
  358    H    ALA  48           HN       ALA  48   6.309  11.482  -3.228
  359    HA   ALA  48           HA       ALA  48   7.991  13.346  -1.917
  360   1HB   ALA  48          HB1       ALA  48   5.739  13.477  -1.354
  361   2HB   ALA  48          HB2       ALA  48   6.342  12.592   0.048
  362   3HB   ALA  48          HB3       ALA  48   5.554  11.722  -1.273
  363    H    THR  49           HN       THR  49   7.043  10.229  -0.469
  364    HA   THR  49           HA       THR  49   9.867   9.791   0.422
  365    HB   THR  49           HB       THR  49   8.552  10.942   2.188
  366    HG1  THR  49           HG1      THR  49  10.056   9.429   2.874
  367   1HG2  THR  49          HG21      THR  49   6.612   9.728   3.192
  368   2HG2  THR  49          HG22      THR  49   6.724   8.545   1.885
  369   3HG2  THR  49          HG23      THR  49   6.316  10.222   1.522
  370    H    LYS  50           HN       LYS  50   8.431   8.521  -1.721
  371    HA   LYS  50           HA       LYS  50   7.927   6.387  -2.547
  372   1HB   LYS  50          HB2       LYS  50   9.363   5.567  -0.001
  373   2HB   LYS  50          HB1       LYS  50   9.094   4.536  -1.404
  374   1HG   LYS  50          HG2       LYS  50  10.279   6.525  -2.691
  375   2HG   LYS  50          HG1       LYS  50  10.951   6.866  -1.096
  376   1HD   LYS  50          HD2       LYS  50  12.538   5.360  -1.793
  377   2HD   LYS  50          HD1       LYS  50  11.360   4.206  -1.166
  378   1HE   LYS  50          HE2       LYS  50  10.762   3.478  -3.263
  379   2HE   LYS  50          HE1       LYS  50  10.960   5.087  -3.985
  380   1HZ   LYS  50          HZ1       LYS  50  12.760   3.711  -4.723
  381   2HZ   LYS  50          HZ2       LYS  50  13.124   3.237  -3.132
  382   3HZ   LYS  50          HZ3       LYS  50  13.382   4.843  -3.624
  383    H    THR  51           HN       THR  51   5.754   7.516  -1.408
  384    HA   THR  51           HA       THR  51   4.585   5.581   0.534
  385    HB   THR  51           HB       THR  51   3.437   8.138  -0.634
  386    HG1  THR  51           HG1      THR  51   4.879   7.814   1.780
  387   1HG2  THR  51          HG21      THR  51   1.658   7.253   0.497
  388   2HG2  THR  51          HG22      THR  51   2.489   7.941   1.892
  389   3HG2  THR  51          HG23      THR  51   2.677   6.230   1.509
  390    H    TRP  52           HN       TRP  52   2.177   5.034  -0.006
  391    HA   TRP  52           HA       TRP  52   1.778   4.640  -2.948
  392   1HB   TRP  52          HB2       TRP  52   1.814   2.654  -0.682
  393   2HB   TRP  52          HB1       TRP  52   0.911   2.329  -2.154
  394    HD1  TRP  52           HD1      TRP  52   4.420   2.472  -0.784
  395    HE1  TRP  52           HE1      TRP  52   6.067   1.689  -2.612
  396    HE3  TRP  52           HE3      TRP  52   1.256   2.278  -4.734
  397    HZ2  TRP  52           HZ2      TRP  52   6.022   1.054  -5.417
  398    HZ3  TRP  52           HZ3      TRP  52   2.055   1.581  -6.985
  399    HH2  TRP  52           HH2      TRP  52   4.436   0.967  -7.326
  400    H    THR  53           HN       THR  53  -0.584   3.357  -2.973
  401    HA   THR  53           HA       THR  53  -2.484   4.503  -1.038
  402    HB   THR  53           HB       THR  53  -2.779   5.191  -3.965
  403    HG1  THR  53           HG1      THR  53  -1.544   6.896  -3.701
  404   1HG2  THR  53          HG21      THR  53  -4.805   5.640  -2.954
  405   2HG2  THR  53          HG22      THR  53  -3.981   7.171  -2.660
  406   3HG2  THR  53          HG23      THR  53  -4.070   5.958  -1.383
  407    H    VAL  54           HN       VAL  54  -4.809   3.860  -1.785
  408    HA   VAL  54           HA       VAL  54  -5.156   1.679  -3.659
  409    HB   VAL  54           HB       VAL  54  -3.849   0.451  -2.022
  410   1HG1  VAL  54          HG11      VAL  54  -5.115   0.368   0.367
  411   2HG1  VAL  54          HG12      VAL  54  -5.497   2.017  -0.127
  412   3HG1  VAL  54          HG13      VAL  54  -3.818   1.501  -0.005
  413   1HG2  VAL  54          HG21      VAL  54  -6.571  -0.373  -1.117
  414   2HG2  VAL  54          HG22      VAL  54  -5.246  -1.361  -1.738
  415   3HG2  VAL  54          HG23      VAL  54  -6.250  -0.424  -2.851
  416    H    THR  55           HN       THR  55  -6.877   3.322  -4.060
  417    HA   THR  55           HA       THR  55  -9.011   3.626  -2.052
  418    HB   THR  55           HB       THR  55  -9.041   4.456  -4.959
  419    HG1  THR  55           HG1      THR  55  -7.579   5.919  -4.563
  420   1HG2  THR  55          HG21      THR  55 -10.008   5.996  -2.557
  421   2HG2  THR  55          HG22      THR  55 -11.008   4.740  -3.288
  422   3HG2  THR  55          HG23      THR  55 -10.518   6.142  -4.239
  423    H    GLU  56           HN       GLU  56 -10.793   2.313  -1.949
  424    HA   GLU  56           HA       GLU  56 -11.090  -0.055  -3.528
  425   1HB   GLU  56          HB2       GLU  56 -12.014   0.548  -1.212
  426   2HB   GLU  56          HB1       GLU  56 -13.284   1.432  -2.060
  427   1HG   GLU  56          HG2       GLU  56 -12.745  -1.367  -2.940
  428   2HG   GLU  56          HG1       GLU  56 -13.567  -1.148  -1.394
  Start of MODEL   27
    1   1H    THR   1          HT1       THR   1  14.132   5.820   3.675
    2   2H    THR   1          HT2       THR   1  13.941   7.411   4.238
    3   3H    THR   1          HT3       THR   1  12.981   6.838   2.959
    4    HA   THR   1           HA       THR   1  12.871   5.959   5.799
    5    HB   THR   1           HB       THR   1  10.878   7.320   3.958
    6    HG1  THR   1           HG1      THR   1  11.430   9.181   5.068
    7   1HG2  THR   1          HG21      THR   1   9.882   7.863   6.290
    8   2HG2  THR   1          HG22      THR   1  10.900   6.545   6.869
    9   3HG2  THR   1          HG23      THR   1   9.660   6.232   5.655
   10    H    THR   2           HN       THR   2  11.256   4.289   6.178
   11    HA   THR   2           HA       THR   2  11.278   2.102   4.340
   12    HB   THR   2           HB       THR   2   9.152   2.611   6.427
   13    HG1  THR   2           HG1      THR   2  10.770   1.773   7.897
   14   1HG2  THR   2          HG21      THR   2  10.439   0.267   5.112
   15   2HG2  THR   2          HG22      THR   2   8.760   0.501   5.599
   16   3HG2  THR   2          HG23      THR   2   9.981   0.093   6.806
   17    H    PHE   3           HN       PHE   3   9.410   1.186   3.186
   18    HA   PHE   3           HA       PHE   3   8.089   3.041   1.462
   19   1HB   PHE   3          HB2       PHE   3   7.433   0.161   2.176
   20   2HB   PHE   3          HB1       PHE   3   6.860   1.008   0.740
   21    HD1  PHE   3           HD1      PHE   3   9.157   2.496  -0.212
   22    HD2  PHE   3           HD2      PHE   3   9.020  -1.436   1.517
   23    HE1  PHE   3           HE1      PHE   3  11.250   1.900  -1.399
   24    HE2  PHE   3           HE2      PHE   3  11.113  -2.029   0.329
   25    HZ   PHE   3           HZ       PHE   3  12.229  -0.362  -1.127
   26    H    LYS   4           HN       LYS   4   5.612   3.125   1.268
   27    HA   LYS   4           HA       LYS   4   4.152   2.923   3.846
   28   1HB   LYS   4          HB2       LYS   4   5.314   5.095   3.875
   29   2HB   LYS   4          HB1       LYS   4   4.646   5.496   2.313
   30   1HG   LYS   4          HG2       LYS   4   3.269   6.614   3.902
   31   2HG   LYS   4          HG1       LYS   4   2.338   5.222   3.354
   32   1HD   LYS   4          HD2       LYS   4   2.908   3.974   5.338
   33   2HD   LYS   4          HD1       LYS   4   4.055   5.215   5.848
   34   1HE   LYS   4          HE2       LYS   4   2.296   6.799   6.267
   35   2HE   LYS   4          HE1       LYS   4   1.093   5.764   5.469
   36   1HZ   LYS   4          HZ1       LYS   4   1.066   5.507   7.903
   37   2HZ   LYS   4          HZ2       LYS   4   2.686   4.997   7.862
   38   3HZ   LYS   4          HZ3       LYS   4   1.479   4.062   7.117
   39    H    LEU   5           HN       LEU   5   1.862   2.947   3.538
   40    HA   LEU   5           HA       LEU   5   0.756   3.414   0.839
   41   1HB   LEU   5          HB2       LEU   5   1.679   0.955   1.223
   42   2HB   LEU   5          HB1       LEU   5   0.183   0.763   2.125
   43    HG   LEU   5           HG       LEU   5  -0.220   2.109  -0.453
   44   1HD1  LEU   5          HD11      LEU   5   0.373   0.421  -1.939
   45   2HD1  LEU   5          HD12      LEU   5   0.357  -0.827  -0.682
   46   3HD1  LEU   5          HD13      LEU   5   1.698   0.318  -0.774
   47   1HD2  LEU   5          HD21      LEU   5  -2.094   1.336   0.841
   48   2HD2  LEU   5          HD22      LEU   5  -1.411  -0.286   0.969
   49   3HD2  LEU   5          HD23      LEU   5  -1.992   0.305  -0.587
   50    H    ILE   6           HN       ILE   6  -1.118   4.494   1.194
   51    HA   ILE   6           HA       ILE   6  -2.446   4.304   3.847
   52    HB   ILE   6           HB       ILE   6  -2.577   6.160   1.460
   53   1HG1  ILE   6          HG12      ILE   6  -0.581   6.274   2.950
   54   2HG1  ILE   6          HG11      ILE   6  -1.537   7.756   2.998
   55   1HG2  ILE   6          HG21      ILE   6  -4.231   6.170   3.996
   56   2HG2  ILE   6          HG22      ILE   6  -4.807   6.205   2.329
   57   3HG2  ILE   6          HG23      ILE   6  -3.997   7.615   3.011
   58   1HD1  ILE   6          HD11      ILE   6  -0.856   5.969   5.156
   59   2HD1  ILE   6          HD12      ILE   6  -2.609   6.052   4.993
   60   3HD1  ILE   6          HD13      ILE   6  -1.675   7.528   5.234
   61    H    ILE   7           HN       ILE   7  -4.438   3.335   4.080
   62    HA   ILE   7           HA       ILE   7  -5.596   1.923   1.753
   63    HB   ILE   7           HB       ILE   7  -6.286   1.964   4.712
   64   1HG1  ILE   7          HG12      ILE   7  -4.781  -0.150   3.147
   65   2HG1  ILE   7          HG11      ILE   7  -3.967   1.138   4.037
   66   1HG2  ILE   7          HG21      ILE   7  -7.242  -0.365   3.961
   67   2HG2  ILE   7          HG22      ILE   7  -7.283   0.376   2.361
   68   3HG2  ILE   7          HG23      ILE   7  -8.199   1.091   3.688
   69   1HD1  ILE   7          HD11      ILE   7  -5.622  -1.136   5.098
   70   2HD1  ILE   7          HD12      ILE   7  -5.475   0.353   6.031
   71   3HD1  ILE   7          HD13      ILE   7  -4.034  -0.579   5.625
   72    H    ASN   8           HN       ASN   8  -6.965   3.155   0.518
   73    HA   ASN   8           HA       ASN   8  -8.788   5.101   1.880
   74   1HB   ASN   8          HB2       ASN   8  -7.526   4.817  -0.836
   75   2HB   ASN   8          HB1       ASN   8  -9.001   5.769  -0.669
   76   1HD2  ASN   8          HD21      ASN   8  -7.402   7.583  -1.328
   77   2HD2  ASN   8          HD22      ASN   8  -6.540   8.348  -0.072
   78    H    GLY   9           HN       GLY   9  -9.640   2.549   2.248
   79   1HA   GLY   9          HA2       GLY   9 -11.356   1.657   0.048
   80   2HA   GLY   9          HA1       GLY   9 -11.253   0.915   1.650
   81    H    LYS  10           HN       LYS  10 -13.677   1.539   0.198
   82    HA   LYS  10           HA       LYS  10 -14.984   3.914   0.967
   83   1HB   LYS  10          HB2       LYS  10 -16.051   1.102   0.580
   84   2HB   LYS  10          HB1       LYS  10 -17.036   2.565   0.551
   85   1HG   LYS  10          HG2       LYS  10 -15.483   3.404  -1.301
   86   2HG   LYS  10          HG1       LYS  10 -14.856   1.757  -1.386
   87   1HD   LYS  10          HD2       LYS  10 -16.951   0.872  -2.048
   88   2HD   LYS  10          HD1       LYS  10 -17.816   2.327  -1.551
   89   1HE   LYS  10          HE2       LYS  10 -16.191   3.460  -3.358
   90   2HE   LYS  10          HE1       LYS  10 -16.244   1.823  -4.042
   91   1HZ   LYS  10          HZ1       LYS  10 -18.689   1.896  -3.773
   92   2HZ   LYS  10          HZ2       LYS  10 -18.109   3.047  -4.881
   93   3HZ   LYS  10          HZ3       LYS  10 -18.569   3.525  -3.317
   94    H    THR  11           HN       THR  11 -14.489   0.905   2.764
   95    HA   THR  11           HA       THR  11 -15.815   2.170   5.144
   96    HB   THR  11           HB       THR  11 -15.513  -0.784   4.548
   97    HG1  THR  11           HG1      THR  11 -17.067  -0.579   3.177
   98   1HG2  THR  11          HG21      THR  11 -16.051   0.147   6.893
   99   2HG2  THR  11          HG22      THR  11 -17.129  -1.090   6.247
  100   3HG2  THR  11          HG23      THR  11 -17.611   0.605   6.210
  101    H    LEU  12           HN       LEU  12 -13.221  -0.035   4.065
  102    HA   LEU  12           HA       LEU  12 -11.909   0.082   6.717
  103   1HB   LEU  12          HB2       LEU  12 -11.334  -1.317   4.088
  104   2HB   LEU  12          HB1       LEU  12 -10.335  -1.504   5.530
  105    HG   LEU  12           HG       LEU  12 -13.296  -1.932   5.744
  106   1HD1  LEU  12          HD11      LEU  12 -11.460  -4.209   5.048
  107   2HD1  LEU  12          HD12      LEU  12 -12.186  -3.246   3.761
  108   3HD1  LEU  12          HD13      LEU  12 -13.215  -4.113   4.901
  109   1HD2  LEU  12          HD21      LEU  12 -10.909  -3.267   7.060
  110   2HD2  LEU  12          HD22      LEU  12 -12.600  -3.436   7.532
  111   3HD2  LEU  12          HD23      LEU  12 -11.778  -1.890   7.739
  112    H    LYS  13           HN       LYS  13 -10.132   1.358   7.146
  113    HA   LYS  13           HA       LYS  13  -8.646   2.617   4.892
  114   1HB   LYS  13          HB2       LYS  13 -10.434   3.899   6.901
  115   2HB   LYS  13          HB1       LYS  13  -8.931   4.745   6.531
  116   1HG   LYS  13          HG2       LYS  13  -9.474   4.936   4.230
  117   2HG   LYS  13          HG1       LYS  13 -10.751   3.724   4.348
  118   1HD   LYS  13          HD2       LYS  13 -12.049   5.632   4.404
  119   2HD   LYS  13          HD1       LYS  13 -11.722   5.460   6.129
  120   1HE   LYS  13          HE2       LYS  13 -10.350   7.298   6.181
  121   2HE   LYS  13          HE1       LYS  13  -9.676   6.959   4.574
  122   1HZ   LYS  13          HZ1       LYS  13 -12.477   7.834   5.018
  123   2HZ   LYS  13          HZ2       LYS  13 -11.651   7.719   3.537
  124   3HZ   LYS  13          HZ3       LYS  13 -11.217   8.913   4.664
  125    H    GLY  14           HN       GLY  14  -6.869   4.140   6.124
  126   1HA   GLY  14          HA2       GLY  14  -5.649   4.088   8.405
  127   2HA   GLY  14          HA1       GLY  14  -5.583   2.347   8.132
  128    H    GLU  15           HN       GLU  15  -3.228   2.551   8.180
  129    HA   GLU  15           HA       GLU  15  -2.130   3.215   5.498
  130   1HB   GLU  15          HB2       GLU  15  -0.375   4.611   6.559
  131   2HB   GLU  15          HB1       GLU  15  -1.982   5.259   6.876
  132   1HG   GLU  15          HG2       GLU  15  -1.765   3.661   9.024
  133   2HG   GLU  15          HG1       GLU  15  -0.052   3.980   8.754
  134    H    THR  16           HN       THR  16   0.306   2.504   5.478
  135    HA   THR  16           HA       THR  16   1.151   0.536   7.459
  136    HB   THR  16           HB       THR  16  -0.651  -0.691   6.326
  137    HG1  THR  16           HG1      THR  16   0.550  -2.402   6.335
  138   1HG2  THR  16          HG21      THR  16  -0.789   0.370   4.196
  139   2HG2  THR  16          HG22      THR  16  -0.254  -1.277   3.867
  140   3HG2  THR  16          HG23      THR  16   0.910   0.050   3.839
  141    H    THR  17           HN       THR  17   3.308  -0.100   7.140
  142    HA   THR  17           HA       THR  17   4.690   0.902   4.675
  143    HB   THR  17           HB       THR  17   6.519   1.642   6.192
  144    HG1  THR  17           HG1      THR  17   6.472   1.026   8.182
  145   1HG2  THR  17          HG21      THR  17   4.994   3.367   5.598
  146   2HG2  THR  17          HG22      THR  17   5.173   3.491   7.348
  147   3HG2  THR  17          HG23      THR  17   3.740   2.728   6.660
  148    H    THR  18           HN       THR  18   6.703  -0.297   4.227
  149    HA   THR  18           HA       THR  18   7.126  -2.773   5.795
  150    HB   THR  18           HB       THR  18   5.721  -2.515   3.240
  151    HG1  THR  18           HG1      THR  18   5.416  -4.814   3.793
  152   1HG2  THR  18          HG21      THR  18   7.959  -2.988   2.279
  153   2HG2  THR  18          HG22      THR  18   6.823  -4.312   2.007
  154   3HG2  THR  18          HG23      THR  18   8.060  -4.453   3.257
  155    H    GLU  19           HN       GLU  19   9.236  -3.741   5.311
  156    HA   GLU  19           HA       GLU  19  11.177  -1.788   4.120
  157   1HB   GLU  19          HB2       GLU  19  11.249  -2.362   6.601
  158   2HB   GLU  19          HB1       GLU  19  11.674  -4.007   6.128
  159   1HG   GLU  19          HG2       GLU  19  13.480  -2.673   4.649
  160   2HG   GLU  19          HG1       GLU  19  13.290  -1.511   5.963
  161    H    ALA  20           HN       ALA  20  11.854  -2.485   2.124
  162    HA   ALA  20           HA       ALA  20  12.603  -5.337   1.762
  163   1HB   ALA  20          HB1       ALA  20  11.161  -4.883  -0.515
  164   2HB   ALA  20          HB2       ALA  20  10.242  -3.935   0.656
  165   3HB   ALA  20          HB3       ALA  20  10.500  -5.660   0.924
  166    H    VAL  21           HN       VAL  21  13.391  -5.547  -0.675
  167    HA   VAL  21           HA       VAL  21  15.652  -3.846  -1.048
  168    HB   VAL  21           HB       VAL  21  15.767  -5.006  -3.247
  169   1HG1  VAL  21          HG11      VAL  21  15.285  -7.410  -2.144
  170   2HG1  VAL  21          HG12      VAL  21  15.233  -6.424  -0.683
  171   3HG1  VAL  21          HG13      VAL  21  16.679  -6.429  -1.692
  172   1HG2  VAL  21          HG21      VAL  21  13.770  -6.821  -3.362
  173   2HG2  VAL  21          HG22      VAL  21  13.673  -5.257  -4.168
  174   3HG2  VAL  21          HG23      VAL  21  12.894  -5.491  -2.605
  175    H    ASP  22           HN       ASP  22  12.340  -3.621  -2.211
  176    HA   ASP  22           HA       ASP  22  12.739  -0.836  -3.033
  177   1HB   ASP  22          HB2       ASP  22  13.653  -2.128  -4.936
  178   2HB   ASP  22          HB1       ASP  22  12.137  -3.022  -5.057
  179    H    ALA  23           HN       ALA  23  10.648   0.154  -3.632
  180    HA   ALA  23           HA       ALA  23   8.448  -0.721  -2.032
  181   1HB   ALA  23          HB1       ALA  23   7.371   0.927  -3.961
  182   2HB   ALA  23          HB2       ALA  23   9.081   1.348  -4.037
  183   3HB   ALA  23          HB3       ALA  23   8.203   1.496  -2.515
  184    H    ALA  24           HN       ALA  24   9.363  -1.456  -5.348
  185    HA   ALA  24           HA       ALA  24   6.868  -2.423  -6.352
  186   1HB   ALA  24          HB1       ALA  24   9.786  -2.994  -6.867
  187   2HB   ALA  24          HB2       ALA  24   8.639  -2.127  -7.887
  188   3HB   ALA  24          HB3       ALA  24   8.538  -3.882  -7.741
  189    H    THR  25           HN       THR  25   9.524  -4.145  -4.694
  190    HA   THR  25           HA       THR  25   8.220  -6.713  -4.600
  191    HB   THR  25           HB       THR  25  10.441  -5.373  -3.021
  192    HG1  THR  25           HG1      THR  25  11.705  -6.718  -4.328
  193   1HG2  THR  25          HG21      THR  25   9.388  -7.158  -1.641
  194   2HG2  THR  25          HG22      THR  25  11.029  -7.583  -2.139
  195   3HG2  THR  25          HG23      THR  25   9.644  -8.302  -2.963
  196    H    ALA  26           HN       ALA  26   8.544  -4.082  -2.187
  197    HA   ALA  26           HA       ALA  26   7.091  -5.311  -0.083
  198   1HB   ALA  26          HB1       ALA  26   6.689  -2.853   0.567
  199   2HB   ALA  26          HB2       ALA  26   7.514  -2.435  -0.940
  200   3HB   ALA  26          HB3       ALA  26   8.373  -3.326   0.316
  201    H    GLU  27           HN       GLU  27   5.884  -2.850  -2.387
  202    HA   GLU  27           HA       GLU  27   3.214  -2.702  -1.787
  203   1HB   GLU  27          HB2       GLU  27   4.431  -1.506  -3.590
  204   2HB   GLU  27          HB1       GLU  27   4.427  -2.979  -4.558
  205   1HG   GLU  27          HG2       GLU  27   1.807  -2.857  -4.098
  206   2HG   GLU  27          HG1       GLU  27   2.161  -1.143  -3.890
  207    H    LYS  28           HN       LYS  28   4.721  -5.431  -3.524
  208    HA   LYS  28           HA       LYS  28   2.286  -6.769  -4.289
  209   1HB   LYS  28          HB2       LYS  28   5.034  -7.857  -3.551
  210   2HB   LYS  28          HB1       LYS  28   3.806  -8.733  -4.463
  211   1HG   LYS  28          HG2       LYS  28   4.072  -7.412  -6.357
  212   2HG   LYS  28          HG1       LYS  28   4.683  -6.036  -5.439
  213   1HD   LYS  28          HD2       LYS  28   6.696  -6.749  -6.265
  214   2HD   LYS  28          HD1       LYS  28   6.618  -7.842  -4.882
  215   1HE   LYS  28          HE2       LYS  28   5.704  -9.624  -6.264
  216   2HE   LYS  28          HE1       LYS  28   5.584  -8.530  -7.657
  217   1HZ   LYS  28          HZ1       LYS  28   8.092  -9.206  -6.210
  218   2HZ   LYS  28          HZ2       LYS  28   7.965  -8.166  -7.548
  219   3HZ   LYS  28          HZ3       LYS  28   7.641  -9.825  -7.723
  220    H    VAL  29           HN       VAL  29   4.368  -6.979  -1.411
  221    HA   VAL  29           HA       VAL  29   2.754  -8.936   0.003
  222    HB   VAL  29           HB       VAL  29   4.906  -6.912   0.696
  223   1HG1  VAL  29          HG11      VAL  29   3.423  -7.105   2.681
  224   2HG1  VAL  29          HG12      VAL  29   5.005  -7.834   2.974
  225   3HG1  VAL  29          HG13      VAL  29   3.612  -8.861   2.634
  226   1HG2  VAL  29          HG21      VAL  29   5.216  -9.212  -0.531
  227   2HG2  VAL  29          HG22      VAL  29   5.028  -9.887   1.087
  228   3HG2  VAL  29          HG23      VAL  29   6.337  -8.754   0.751
  229    H    LEU  30           HN       LEU  30   2.848  -5.375  -0.147
  230    HA   LEU  30           HA       LEU  30   0.995  -4.908   1.989
  231   1HB   LEU  30          HB2       LEU  30   1.913  -3.398  -0.467
  232   2HB   LEU  30          HB1       LEU  30   0.715  -2.704   0.613
  233    HG   LEU  30           HG       LEU  30   3.264  -2.143   0.944
  234   1HD1  LEU  30          HD11      LEU  30   1.632  -1.290   2.460
  235   2HD1  LEU  30          HD12      LEU  30   2.908  -2.032   3.434
  236   3HD1  LEU  30          HD13      LEU  30   1.378  -2.883   3.180
  237   1HD2  LEU  30          HD21      LEU  30   4.253  -3.633   2.727
  238   2HD2  LEU  30          HD22      LEU  30   4.250  -4.291   1.104
  239   3HD2  LEU  30          HD23      LEU  30   3.066  -4.845   2.285
  240    H    LYS  31           HN       LYS  31   0.635  -5.683  -1.426
  241    HA   LYS  31           HA       LYS  31  -2.184  -5.152  -1.740
  242   1HB   LYS  31          HB2       LYS  31  -0.197  -5.885  -3.389
  243   2HB   LYS  31          HB1       LYS  31  -0.777  -7.488  -3.006
  244   1HG   LYS  31          HG2       LYS  31  -2.666  -5.310  -3.905
  245   2HG   LYS  31          HG1       LYS  31  -1.819  -6.334  -5.064
  246   1HD   LYS  31          HD2       LYS  31  -3.663  -7.298  -2.852
  247   2HD   LYS  31          HD1       LYS  31  -4.040  -7.268  -4.574
  248   1HE   LYS  31          HE2       LYS  31  -1.577  -8.642  -4.372
  249   2HE   LYS  31          HE1       LYS  31  -2.605  -9.296  -3.076
  250   1HZ   LYS  31          HZ1       LYS  31  -3.149 -10.472  -5.062
  251   2HZ   LYS  31          HZ2       LYS  31  -3.287  -9.036  -5.959
  252   3HZ   LYS  31          HZ3       LYS  31  -4.430  -9.404  -4.758
  253    H    GLN  32           HN       GLN  32  -0.312  -8.003  -0.762
  254    HA   GLN  32           HA       GLN  32  -2.406  -9.872  -0.367
  255   1HB   GLN  32          HB2       GLN  32   0.356  -9.399   0.603
  256   2HB   GLN  32          HB1       GLN  32  -0.629 -10.512   1.552
  257   1HG   GLN  32          HG2       GLN  32  -1.226 -11.552  -0.779
  258   2HG   GLN  32          HG1       GLN  32   0.252 -10.745  -1.307
  259   1HE2  GLN  32          HE21      GLN  32   2.264 -11.255   0.066
  260   2HE2  GLN  32          HE22      GLN  32   2.392 -12.824   0.722
  261    H    TYR  33           HN       TYR  33  -1.105  -7.360   1.787
  262    HA   TYR  33           HA       TYR  33  -2.698  -7.969   4.119
  263   1HB   TYR  33          HB2       TYR  33  -0.704  -6.545   4.157
  264   2HB   TYR  33          HB1       TYR  33  -1.461  -5.403   3.047
  265    HD1  TYR  33           HD1      TYR  33  -1.683  -6.897   6.425
  266    HD2  TYR  33           HD2      TYR  33  -2.978  -3.737   3.827
  267    HE1  TYR  33           HE1      TYR  33  -2.728  -5.755   8.346
  268    HE2  TYR  33           HE2      TYR  33  -4.020  -2.581   5.755
  269    HH   TYR  33           HH       TYR  33  -3.439  -3.542   9.011
  270    H    ILE  34           HN       ILE  34  -3.171  -5.864   1.301
  271    HA   ILE  34           HA       ILE  34  -5.698  -4.722   2.074
  272    HB   ILE  34           HB       ILE  34  -4.426  -5.288  -0.622
  273   1HG1  ILE  34          HG12      ILE  34  -3.174  -3.882   1.146
  274   2HG1  ILE  34          HG11      ILE  34  -3.370  -3.177  -0.454
  275   1HG2  ILE  34          HG21      ILE  34  -6.812  -4.835  -0.887
  276   2HG2  ILE  34          HG22      ILE  34  -5.871  -3.460  -1.466
  277   3HG2  ILE  34          HG23      ILE  34  -6.666  -3.384   0.106
  278   1HD1  ILE  34          HD11      ILE  34  -3.902  -1.756   1.704
  279   2HD1  ILE  34          HD12      ILE  34  -5.435  -2.628   1.654
  280   3HD1  ILE  34          HD13      ILE  34  -4.943  -1.630   0.286
  281    H    ASN  35           HN       ASN  35  -4.767  -7.788   0.632
  282    HA   ASN  35           HA       ASN  35  -7.214  -8.617  -0.548
  283   1HB   ASN  35          HB2       ASN  35  -4.886  -9.662  -0.620
  284   2HB   ASN  35          HB1       ASN  35  -5.247 -10.357   0.960
  285   1HD2  ASN  35          HD21      ASN  35  -5.403 -11.038  -2.323
  286   2HD2  ASN  35          HD22      ASN  35  -6.619 -12.222  -2.291
  287    H    ASP  36           HN       ASP  36  -6.204  -8.494   2.820
  288    HA   ASP  36           HA       ASP  36  -8.323 -10.202   3.855
  289   1HB   ASP  36          HB2       ASP  36  -6.124  -9.754   4.949
  290   2HB   ASP  36          HB1       ASP  36  -6.616  -8.077   5.194
  291    H    ASN  37           HN       ASN  37  -7.815  -6.664   3.706
  292    HA   ASN  37           HA       ASN  37 -10.381  -6.004   4.897
  293   1HB   ASN  37          HB2       ASN  37  -8.320  -4.489   3.267
  294   2HB   ASN  37          HB1       ASN  37  -9.734  -3.716   3.992
  295   1HD2  ASN  37          HD21      ASN  37  -6.728  -3.507   4.646
  296   2HD2  ASN  37          HD22      ASN  37  -6.653  -3.809   6.323
  297    H    GLY  38           HN       GLY  38  -9.198  -6.468   1.598
  298   1HA   GLY  38          HA2       GLY  38 -10.528  -7.010  -0.304
  299   2HA   GLY  38          HA1       GLY  38 -11.974  -6.610   0.624
  300    H    ILE  39           HN       ILE  39  -9.151  -4.509   0.303
  301    HA   ILE  39           HA       ILE  39 -10.894  -2.535  -1.133
  302    HB   ILE  39           HB       ILE  39  -8.506  -2.190   0.714
  303   1HG1  ILE  39          HG12      ILE  39 -10.531  -2.918   1.898
  304   2HG1  ILE  39          HG11      ILE  39 -10.198  -1.223   2.263
  305   1HG2  ILE  39          HG21      ILE  39 -10.344  -0.002  -0.240
  306   2HG2  ILE  39          HG22      ILE  39  -8.901  -0.432  -1.151
  307   3HG2  ILE  39          HG23      ILE  39  -8.758   0.149   0.507
  308   1HD1  ILE  39          HD11      ILE  39 -12.316  -0.776   1.625
  309   2HD1  ILE  39          HD12      ILE  39 -12.530  -2.401   0.976
  310   3HD1  ILE  39          HD13      ILE  39 -11.816  -1.139  -0.027
  311    H    ASP  40           HN       ASP  40 -10.178  -3.740  -3.147
  312    HA   ASP  40           HA       ASP  40  -7.420  -2.911  -4.002
  313   1HB   ASP  40          HB2       ASP  40  -9.144  -5.333  -4.457
  314   2HB   ASP  40          HB1       ASP  40  -7.933  -4.897  -5.668
  315    H    GLY  41           HN       GLY  41  -7.882  -0.969  -5.074
  316   1HA   GLY  41          HA2       GLY  41  -9.753  -1.181  -7.392
  317   2HA   GLY  41          HA1       GLY  41  -9.815   0.225  -6.324
  318    H    GLU  42           HN       GLU  42  -7.954   1.661  -6.285
  319    HA   GLU  42           HA       GLU  42  -6.093   1.339  -8.614
  320   1HB   GLU  42          HB2       GLU  42  -8.160   3.349  -8.024
  321   2HB   GLU  42          HB1       GLU  42  -6.590   4.060  -8.398
  322   1HG   GLU  42          HG2       GLU  42  -6.603   3.304 -10.563
  323   2HG   GLU  42          HG1       GLU  42  -7.497   1.838 -10.158
  324    H    TRP  43           HN       TRP  43  -4.032   1.378  -7.839
  325    HA   TRP  43           HA       TRP  43  -3.446   2.781  -5.269
  326   1HB   TRP  43          HB2       TRP  43  -1.947   0.791  -7.005
  327   2HB   TRP  43          HB1       TRP  43  -1.255   1.530  -5.574
  328    HD1  TRP  43           HD1      TRP  43  -4.929   0.374  -5.650
  329    HE1  TRP  43           HE1      TRP  43  -5.175  -1.598  -4.027
  330    HE3  TRP  43           HE3      TRP  43  -0.055  -0.304  -4.378
  331    HZ2  TRP  43           HZ2      TRP  43  -3.528  -3.224  -2.361
  332    HZ3  TRP  43           HZ3      TRP  43   0.586  -2.060  -2.741
  333    HH2  TRP  43           HH2      TRP  43  -1.138  -3.515  -1.735
  334    H    THR  44           HN       THR  44  -1.333   4.020  -5.254
  335    HA   THR  44           HA       THR  44  -0.389   5.043  -7.862
  336    HB   THR  44           HB       THR  44  -0.837   7.389  -7.163
  337    HG1  THR  44           HG1      THR  44  -2.033   7.771  -5.355
  338   1HG2  THR  44          HG21      THR  44  -3.148   7.392  -7.740
  339   2HG2  THR  44          HG22      THR  44  -3.397   5.788  -7.050
  340   3HG2  THR  44          HG23      THR  44  -2.466   5.974  -8.536
  341    H    TYR  45           HN       TYR  45   1.786   5.349  -7.706
  342    HA   TYR  45           HA       TYR  45   3.047   5.184  -5.023
  343   1HB   TYR  45          HB2       TYR  45   3.796   3.671  -6.788
  344   2HB   TYR  45          HB1       TYR  45   4.084   5.025  -7.877
  345    HD1  TYR  45           HD1      TYR  45   6.255   5.843  -8.055
  346    HD2  TYR  45           HD2      TYR  45   5.055   3.884  -4.427
  347    HE1  TYR  45           HE1      TYR  45   8.555   6.090  -7.161
  348    HE2  TYR  45           HE2      TYR  45   7.356   4.125  -3.533
  349    HH   TYR  45           HH       TYR  45   9.810   4.397  -4.831
  350    H    ASP  46           HN       ASP  46   4.981   6.675  -4.679
  351    HA   ASP  46           HA       ASP  46   4.937   9.243  -6.145
  352   1HB   ASP  46          HB2       ASP  46   4.515  10.516  -4.068
  353   2HB   ASP  46          HB1       ASP  46   3.177   9.421  -4.407
  354    H    ASP  47           HN       ASP  47   7.035   9.916  -6.344
  355    HA   ASP  47           HA       ASP  47   9.182   8.479  -4.979
  356   1HB   ASP  47          HB2       ASP  47   8.776  10.339  -7.213
  357   2HB   ASP  47          HB1       ASP  47  10.279  10.636  -6.339
  358    H    ALA  48           HN       ALA  48   7.246  10.971  -3.871
  359    HA   ALA  48           HA       ALA  48   9.082  12.881  -2.800
  360   1HB   ALA  48          HB1       ALA  48   6.783  13.422  -2.777
  361   2HB   ALA  48          HB2       ALA  48   7.121  13.082  -1.080
  362   3HB   ALA  48          HB3       ALA  48   6.332  11.865  -2.083
  363    H    THR  49           HN       THR  49   7.660   9.958  -1.306
  364    HA   THR  49           HA       THR  49  10.095   9.623   0.356
  365    HB   THR  49           HB       THR  49   8.613  11.105   1.643
  366    HG1  THR  49           HG1      THR  49   8.461   8.452   2.624
  367   1HG2  THR  49          HG21      THR  49   6.367  10.874   1.707
  368   2HG2  THR  49          HG22      THR  49   6.479   9.153   2.076
  369   3HG2  THR  49          HG23      THR  49   6.561   9.702   0.402
  370    H    LYS  50           HN       LYS  50   8.727   8.172  -1.858
  371    HA   LYS  50           HA       LYS  50   8.162   5.970  -2.452
  372   1HB   LYS  50          HB2       LYS  50   9.515   5.412   0.207
  373   2HB   LYS  50          HB1       LYS  50   9.306   4.265  -1.110
  374   1HG   LYS  50          HG2       LYS  50  11.113   5.052  -2.209
  375   2HG   LYS  50          HG1       LYS  50  10.573   6.722  -2.042
  376   1HD   LYS  50          HD2       LYS  50  12.488   6.819  -0.756
  377   2HD   LYS  50          HD1       LYS  50  11.334   6.329   0.486
  378   1HE   LYS  50          HE2       LYS  50  11.938   3.933   0.039
  379   2HE   LYS  50          HE1       LYS  50  13.198   4.505  -1.074
  380   1HZ   LYS  50          HZ1       LYS  50  12.931   5.163   1.811
  381   2HZ   LYS  50          HZ2       LYS  50  14.028   5.925   0.761
  382   3HZ   LYS  50          HZ3       LYS  50  14.172   4.263   1.084
  383    H    THR  51           HN       THR  51   5.896   7.041  -1.686
  384    HA   THR  51           HA       THR  51   4.726   5.290   0.454
  385    HB   THR  51           HB       THR  51   3.410   7.743  -0.710
  386    HG1  THR  51           HG1      THR  51   4.581   9.017   0.673
  387   1HG2  THR  51          HG21      THR  51   2.915   5.939   1.455
  388   2HG2  THR  51          HG22      THR  51   1.969   7.342   0.962
  389   3HG2  THR  51          HG23      THR  51   3.273   7.528   2.132
  390    H    TRP  52           HN       TRP  52   2.147   5.120  -0.163
  391    HA   TRP  52           HA       TRP  52   1.825   4.532  -3.064
  392   1HB   TRP  52          HB2       TRP  52   1.779   2.612  -0.744
  393   2HB   TRP  52          HB1       TRP  52   0.882   2.274  -2.218
  394    HD1  TRP  52           HD1      TRP  52   4.364   2.288  -0.796
  395    HE1  TRP  52           HE1      TRP  52   6.007   1.411  -2.585
  396    HE3  TRP  52           HE3      TRP  52   1.277   2.222  -4.809
  397    HZ2  TRP  52           HZ2      TRP  52   5.989   0.762  -5.386
  398    HZ3  TRP  52           HZ3      TRP  52   2.086   1.472  -7.039
  399    HH2  TRP  52           HH2      TRP  52   4.440   0.741  -7.328
  400    H    THR  53           HN       THR  53  -0.556   3.327  -3.110
  401    HA   THR  53           HA       THR  53  -2.468   4.541  -1.228
  402    HB   THR  53           HB       THR  53  -2.599   5.205  -4.179
  403    HG1  THR  53           HG1      THR  53  -1.101   6.600  -3.788
  404   1HG2  THR  53          HG21      THR  53  -4.726   5.492  -3.203
  405   2HG2  THR  53          HG22      THR  53  -4.017   7.106  -3.144
  406   3HG2  THR  53          HG23      THR  53  -4.047   6.102  -1.694
  407    H    VAL  54           HN       VAL  54  -4.776   3.898  -1.943
  408    HA   VAL  54           HA       VAL  54  -5.174   1.739  -3.831
  409    HB   VAL  54           HB       VAL  54  -3.866   0.445  -2.268
  410   1HG1  VAL  54          HG11      VAL  54  -4.862   0.359   0.184
  411   2HG1  VAL  54          HG12      VAL  54  -5.438   1.969  -0.243
  412   3HG1  VAL  54          HG13      VAL  54  -3.715   1.609  -0.290
  413   1HG2  VAL  54          HG21      VAL  54  -5.306  -1.317  -1.849
  414   2HG2  VAL  54          HG22      VAL  54  -6.311  -0.377  -2.962
  415   3HG2  VAL  54          HG23      VAL  54  -6.578  -0.263  -1.222
  416    H    THR  55           HN       THR  55  -6.911   3.325  -4.225
  417    HA   THR  55           HA       THR  55  -9.001   3.646  -2.158
  418    HB   THR  55           HB       THR  55  -9.038   4.553  -5.044
  419    HG1  THR  55           HG1      THR  55  -7.174   5.408  -4.465
  420   1HG2  THR  55          HG21      THR  55  -9.969   6.119  -2.662
  421   2HG2  THR  55          HG22      THR  55 -10.971   4.797  -3.262
  422   3HG2  THR  55          HG23      THR  55 -10.567   6.148  -4.321
  423    H    GLU  56           HN       GLU  56 -11.137   2.815  -2.396
  424    HA   GLU  56           HA       GLU  56 -11.417   0.595  -4.394
  425   1HB   GLU  56          HB2       GLU  56 -11.357   0.066  -1.935
  426   2HB   GLU  56          HB1       GLU  56 -12.818   1.034  -1.737
  427   1HG   GLU  56          HG2       GLU  56 -13.445  -1.309  -1.947
  428   2HG   GLU  56          HG1       GLU  56 -13.966  -0.446  -3.394
  Start of MODEL   28
    1   1H    THR   1          HT1       THR   1  15.233   2.587   5.706
    2   2H    THR   1          HT2       THR   1  16.148   3.574   4.669
    3   3H    THR   1          HT3       THR   1  15.488   2.116   4.097
    4    HA   THR   1           HA       THR   1  14.032   4.602   4.822
    5    HB   THR   1           HB       THR   1  14.099   2.916   2.305
    6    HG1  THR   1           HG1      THR   1  15.666   4.315   1.578
    7   1HG2  THR   1          HG21      THR   1  12.208   4.366   2.327
    8   2HG2  THR   1          HG22      THR   1  13.417   5.179   1.333
    9   3HG2  THR   1          HG23      THR   1  13.148   5.700   2.997
   10    H    THR   2           HN       THR   2  11.693   4.403   4.734
   11    HA   THR   2           HA       THR   2  10.683   1.603   5.142
   12    HB   THR   2           HB       THR   2   9.635   4.141   6.421
   13    HG1  THR   2           HG1      THR   2  11.445   2.262   7.523
   14   1HG2  THR   2          HG21      THR   2   8.427   2.713   7.836
   15   2HG2  THR   2          HG22      THR   2   9.467   1.332   7.486
   16   3HG2  THR   2          HG23      THR   2   8.317   1.899   6.275
   17    H    PHE   3           HN       PHE   3   9.080   1.042   3.729
   18    HA   PHE   3           HA       PHE   3   8.050   2.953   1.776
   19   1HB   PHE   3          HB2       PHE   3   7.322   0.077   2.438
   20   2HB   PHE   3          HB1       PHE   3   6.844   0.933   0.973
   21    HD1  PHE   3           HD1      PHE   3   9.106   2.335   0.018
   22    HD2  PHE   3           HD2      PHE   3   9.019  -1.468   2.017
   23    HE1  PHE   3           HE1      PHE   3  11.267   1.730  -1.036
   24    HE2  PHE   3           HE2      PHE   3  11.180  -2.071   0.962
   25    HZ   PHE   3           HZ       PHE   3  12.304  -0.471  -0.563
   26    H    LYS   4           HN       LYS   4   5.764   3.498   1.535
   27    HA   LYS   4           HA       LYS   4   4.083   3.097   3.981
   28   1HB   LYS   4          HB2       LYS   4   5.334   5.295   3.954
   29   2HB   LYS   4          HB1       LYS   4   4.458   5.709   2.491
   30   1HG   LYS   4          HG2       LYS   4   2.318   5.465   3.676
   31   2HG   LYS   4          HG1       LYS   4   3.180   5.037   5.153
   32   1HD   LYS   4          HD2       LYS   4   3.791   7.190   5.580
   33   2HD   LYS   4          HD1       LYS   4   4.068   7.554   3.877
   34   1HE   LYS   4          HE2       LYS   4   1.954   8.369   3.594
   35   2HE   LYS   4          HE1       LYS   4   1.230   7.068   4.561
   36   1HZ   LYS   4          HZ1       LYS   4   1.099   9.225   5.695
   37   2HZ   LYS   4          HZ2       LYS   4   2.794   9.348   5.658
   38   3HZ   LYS   4          HZ3       LYS   4   2.047   8.117   6.562
   39    H    LEU   5           HN       LEU   5   1.816   3.178   3.563
   40    HA   LEU   5           HA       LEU   5   0.896   3.541   0.762
   41   1HB   LEU   5          HB2       LEU   5   1.632   1.079   1.507
   42   2HB   LEU   5          HB1       LEU   5   0.034   1.079   2.242
   43    HG   LEU   5           HG       LEU   5  -0.083   2.167  -0.456
   44   1HD1  LEU   5          HD11      LEU   5   1.917   0.472  -0.516
   45   2HD1  LEU   5          HD12      LEU   5   0.671   0.384  -1.767
   46   3HD1  LEU   5          HD13      LEU   5   0.646  -0.753  -0.407
   47   1HD2  LEU   5          HD21      LEU   5  -1.724   0.191  -0.641
   48   2HD2  LEU   5          HD22      LEU   5  -2.083   1.410   0.582
   49   3HD2  LEU   5          HD23      LEU   5  -1.353  -0.124   1.055
   50    H    ILE   6           HN       ILE   6  -1.213   4.323   0.715
   51    HA   ILE   6           HA       ILE   6  -2.564   4.683   3.363
   52    HB   ILE   6           HB       ILE   6  -2.604   6.233   0.759
   53   1HG1  ILE   6          HG12      ILE   6  -0.553   6.441   2.142
   54   2HG1  ILE   6          HG11      ILE   6  -1.453   7.956   2.077
   55   1HG2  ILE   6          HG21      ILE   6  -3.872   7.934   2.234
   56   2HG2  ILE   6          HG22      ILE   6  -4.198   6.569   3.302
   57   3HG2  ILE   6          HG23      ILE   6  -4.782   6.546   1.638
   58   1HD1  ILE   6          HD11      ILE   6  -1.445   7.960   4.332
   59   2HD1  ILE   6          HD12      ILE   6  -0.764   6.335   4.380
   60   3HD1  ILE   6          HD13      ILE   6  -2.510   6.556   4.282
   61    H    ILE   7           HN       ILE   7  -4.572   3.780   3.627
   62    HA   ILE   7           HA       ILE   7  -5.703   2.147   1.445
   63    HB   ILE   7           HB       ILE   7  -6.539   2.619   4.328
   64   1HG1  ILE   7          HG12      ILE   7  -5.018   0.285   3.128
   65   2HG1  ILE   7          HG11      ILE   7  -4.237   1.630   3.961
   66   1HG2  ILE   7          HG21      ILE   7  -7.538   0.227   3.816
   67   2HG2  ILE   7          HG22      ILE   7  -7.500   0.795   2.147
   68   3HG2  ILE   7          HG23      ILE   7  -8.434   1.674   3.356
   69   1HD1  ILE   7          HD11      ILE   7  -4.506   0.224   5.763
   70   2HD1  ILE   7          HD12      ILE   7  -5.924  -0.565   5.069
   71   3HD1  ILE   7          HD13      ILE   7  -6.076   1.025   5.817
   72    H    ASN   8           HN       ASN   8  -7.156   3.041   0.053
   73    HA   ASN   8           HA       ASN   8  -8.876   5.300   1.026
   74   1HB   ASN   8          HB2       ASN   8  -7.456   4.648  -1.533
   75   2HB   ASN   8          HB1       ASN   8  -8.955   5.571  -1.628
   76   1HD2  ASN   8          HD21      ASN   8  -6.669   6.905  -2.417
   77   2HD2  ASN   8          HD22      ASN   8  -6.202   8.047  -1.238
   78    H    GLY   9           HN       GLY   9  -9.776   2.796   1.654
   79   1HA   GLY   9          HA2       GLY   9 -11.462   1.700  -0.471
   80   2HA   GLY   9          HA1       GLY   9 -11.425   1.155   1.210
   81    H    LYS  10           HN       LYS  10 -13.783   1.723  -0.435
   82    HA   LYS  10           HA       LYS  10 -15.026   4.198   0.065
   83   1HB   LYS  10          HB2       LYS  10 -16.176   1.396  -0.084
   84   2HB   LYS  10          HB1       LYS  10 -17.115   2.878  -0.274
   85   1HG   LYS  10          HG2       LYS  10 -15.453   3.492  -2.139
   86   2HG   LYS  10          HG1       LYS  10 -14.939   1.805  -2.075
   87   1HD   LYS  10          HD2       LYS  10 -17.105   1.016  -2.682
   88   2HD   LYS  10          HD1       LYS  10 -17.841   2.592  -2.391
   89   1HE   LYS  10          HE2       LYS  10 -15.942   3.249  -4.256
   90   2HE   LYS  10          HE1       LYS  10 -16.401   1.616  -4.780
   91   1HZ   LYS  10          HZ1       LYS  10 -17.959   3.124  -5.730
   92   2HZ   LYS  10          HZ2       LYS  10 -18.210   3.909  -4.244
   93   3HZ   LYS  10          HZ3       LYS  10 -18.757   2.316  -4.470
   94    H    THR  11           HN       THR  11 -14.654   1.390   2.176
   95    HA   THR  11           HA       THR  11 -16.075   2.888   4.357
   96    HB   THR  11           HB       THR  11 -15.675  -0.103   4.139
   97    HG1  THR  11           HG1      THR  11 -16.955   0.066   2.484
   98   1HG2  THR  11          HG21      THR  11 -16.473   1.307   6.258
   99   2HG2  THR  11          HG22      THR  11 -17.193  -0.256   5.869
  100   3HG2  THR  11          HG23      THR  11 -18.020   1.235   5.414
  101    H    LEU  12           HN       LEU  12 -13.304   0.824   3.529
  102    HA   LEU  12           HA       LEU  12 -12.135   1.193   6.238
  103   1HB   LEU  12          HB2       LEU  12 -11.422  -0.441   3.787
  104   2HB   LEU  12          HB1       LEU  12 -10.449  -0.431   5.258
  105    HG   LEU  12           HG       LEU  12 -13.404  -1.020   5.359
  106   1HD1  LEU  12          HD11      LEU  12 -12.010  -2.544   3.753
  107   2HD1  LEU  12          HD12      LEU  12 -13.054  -3.303   4.955
  108   3HD1  LEU  12          HD13      LEU  12 -11.318  -3.186   5.243
  109   1HD2  LEU  12          HD21      LEU  12 -11.007  -1.635   7.113
  110   2HD2  LEU  12          HD22      LEU  12 -12.620  -2.290   7.397
  111   3HD2  LEU  12          HD23      LEU  12 -12.347  -0.550   7.486
  112    H    LYS  13           HN       LYS  13 -10.127   2.261   6.545
  113    HA   LYS  13           HA       LYS  13  -8.672   3.431   4.275
  114   1HB   LYS  13          HB2       LYS  13 -10.627   4.907   5.981
  115   2HB   LYS  13          HB1       LYS  13  -9.141   5.752   5.544
  116   1HG   LYS  13          HG2       LYS  13  -9.740   4.781   3.129
  117   2HG   LYS  13          HG1       LYS  13 -11.373   4.813   3.796
  118   1HD   LYS  13          HD2       LYS  13 -10.924   7.217   4.486
  119   2HD   LYS  13          HD1       LYS  13  -9.452   7.134   3.517
  120   1HE   LYS  13          HE2       LYS  13 -10.932   7.949   1.915
  121   2HE   LYS  13          HE1       LYS  13 -11.178   6.207   1.678
  122   1HZ   LYS  13          HZ1       LYS  13 -12.995   6.241   3.220
  123   2HZ   LYS  13          HZ2       LYS  13 -13.278   7.434   2.044
  124   3HZ   LYS  13          HZ3       LYS  13 -12.725   7.874   3.590
  125    H    GLY  14           HN       GLY  14  -6.993   5.117   5.348
  126   1HA   GLY  14          HA2       GLY  14  -5.915   5.501   7.656
  127   2HA   GLY  14          HA1       GLY  14  -5.873   3.741   7.751
  128    H    GLU  15           HN       GLU  15  -3.537   3.842   7.894
  129    HA   GLU  15           HA       GLU  15  -2.247   4.052   5.218
  130   1HB   GLU  15          HB2       GLU  15  -0.449   5.445   6.220
  131   2HB   GLU  15          HB1       GLU  15  -2.017   6.242   6.323
  132   1HG   GLU  15          HG2       GLU  15  -2.038   4.892   8.672
  133   2HG   GLU  15          HG1       GLU  15  -0.303   5.150   8.489
  134    H    THR  16           HN       THR  16   0.038   3.105   5.335
  135    HA   THR  16           HA       THR  16   0.678   1.376   7.620
  136    HB   THR  16           HB       THR  16  -1.146   0.140   6.529
  137    HG1  THR  16           HG1      THR  16   0.064  -1.764   6.069
  138   1HG2  THR  16          HG21      THR  16   0.583   0.489   4.069
  139   2HG2  THR  16          HG22      THR  16  -1.102   0.963   4.290
  140   3HG2  THR  16          HG23      THR  16  -0.676  -0.744   4.176
  141    H    THR  17           HN       THR  17   2.822   0.587   7.489
  142    HA   THR  17           HA       THR  17   4.348   1.219   4.987
  143    HB   THR  17           HB       THR  17   6.172   1.986   6.588
  144    HG1  THR  17           HG1      THR  17   5.527   2.430   8.678
  145   1HG2  THR  17          HG21      THR  17   3.548   3.374   6.192
  146   2HG2  THR  17          HG22      THR  17   5.135   3.777   5.538
  147   3HG2  THR  17          HG23      THR  17   4.762   4.127   7.225
  148    H    THR  18           HN       THR  18   6.321  -0.081   4.771
  149    HA   THR  18           HA       THR  18   6.545  -2.399   6.615
  150    HB   THR  18           HB       THR  18   5.436  -2.324   3.905
  151    HG1  THR  18           HG1      THR  18   5.021  -4.573   4.608
  152   1HG2  THR  18          HG21      THR  18   7.730  -2.920   3.212
  153   2HG2  THR  18          HG22      THR  18   6.614  -4.268   2.976
  154   3HG2  THR  18          HG23      THR  18   7.727  -4.272   4.345
  155    H    GLU  19           HN       GLU  19   8.647  -3.608   6.122
  156    HA   GLU  19           HA       GLU  19  10.763  -1.722   5.132
  157   1HB   GLU  19          HB2       GLU  19  10.655  -2.033   7.610
  158   2HB   GLU  19          HB1       GLU  19  10.880  -3.767   7.375
  159   1HG   GLU  19          HG2       GLU  19  12.968  -2.858   5.927
  160   2HG   GLU  19          HG1       GLU  19  12.842  -1.549   7.103
  161    H    ALA  20           HN       ALA  20  11.594  -2.575   3.256
  162    HA   ALA  20           HA       ALA  20  12.355  -5.440   3.180
  163   1HB   ALA  20          HB1       ALA  20  10.224  -5.743   2.310
  164   2HB   ALA  20          HB2       ALA  20  11.101  -5.361   0.827
  165   3HB   ALA  20          HB3       ALA  20  10.158  -4.112   1.641
  166    H    VAL  21           HN       VAL  21  13.145  -5.762   0.664
  167    HA   VAL  21           HA       VAL  21  15.502  -4.134   0.372
  168    HB   VAL  21           HB       VAL  21  15.210  -6.492  -0.388
  169   1HG1  VAL  21          HG11      VAL  21  12.848  -6.092  -1.272
  170   2HG1  VAL  21          HG12      VAL  21  13.901  -7.086  -2.278
  171   3HG1  VAL  21          HG13      VAL  21  13.617  -5.398  -2.699
  172   1HG2  VAL  21          HG21      VAL  21  16.054  -5.961  -2.853
  173   2HG2  VAL  21          HG22      VAL  21  17.055  -5.595  -1.447
  174   3HG2  VAL  21          HG23      VAL  21  16.114  -4.317  -2.217
  175    H    ASP  22           HN       ASP  22  12.363  -4.161  -1.237
  176    HA   ASP  22           HA       ASP  22  12.796  -1.409  -2.244
  177   1HB   ASP  22          HB2       ASP  22  12.313  -3.901  -3.900
  178   2HB   ASP  22          HB1       ASP  22  12.225  -2.258  -4.556
  179    H    ALA  23           HN       ALA  23  10.748  -0.444  -2.949
  180    HA   ALA  23           HA       ALA  23   8.467  -1.151  -1.378
  181   1HB   ALA  23          HB1       ALA  23   8.354   1.037  -2.064
  182   2HB   ALA  23          HB2       ALA  23   7.457   0.352  -3.420
  183   3HB   ALA  23          HB3       ALA  23   9.178   0.701  -3.587
  184    H    ALA  24           HN       ALA  24   9.516  -2.179  -4.573
  185    HA   ALA  24           HA       ALA  24   7.055  -3.200  -5.604
  186   1HB   ALA  24          HB1       ALA  24   8.918  -3.041  -7.062
  187   2HB   ALA  24          HB2       ALA  24   8.747  -4.777  -6.804
  188   3HB   ALA  24          HB3       ALA  24   9.982  -3.873  -5.928
  189    H    THR  25           HN       THR  25   9.588  -4.764  -3.631
  190    HA   THR  25           HA       THR  25   8.245  -7.313  -3.396
  191    HB   THR  25           HB       THR  25  10.419  -5.874  -1.838
  192    HG1  THR  25           HG1      THR  25  10.428  -8.028  -3.679
  193   1HG2  THR  25          HG21      THR  25   9.576  -8.778  -1.581
  194   2HG2  THR  25          HG22      THR  25   9.273  -7.529  -0.370
  195   3HG2  THR  25          HG23      THR  25  10.930  -8.008  -0.751
  196    H    ALA  26           HN       ALA  26   8.540  -4.512  -1.169
  197    HA   ALA  26           HA       ALA  26   6.928  -5.552   0.929
  198   1HB   ALA  26          HB1       ALA  26   6.590  -3.022   1.376
  199   2HB   ALA  26          HB2       ALA  26   7.574  -2.769  -0.072
  200   3HB   ALA  26          HB3       ALA  26   8.255  -3.611   1.320
  201    H    GLU  27           HN       GLU  27   5.987  -3.251  -1.650
  202    HA   GLU  27           HA       GLU  27   3.295  -2.914  -1.205
  203   1HB   GLU  27          HB2       GLU  27   4.683  -1.943  -3.031
  204   2HB   GLU  27          HB1       GLU  27   4.611  -3.488  -3.879
  205   1HG   GLU  27          HG2       GLU  27   2.016  -3.207  -3.609
  206   2HG   GLU  27          HG1       GLU  27   2.411  -1.504  -3.379
  207    H    LYS  28           HN       LYS  28   4.770  -5.849  -2.582
  208    HA   LYS  28           HA       LYS  28   2.324  -7.150  -3.388
  209   1HB   LYS  28          HB2       LYS  28   4.977  -8.263  -2.389
  210   2HB   LYS  28          HB1       LYS  28   3.761  -9.185  -3.274
  211   1HG   LYS  28          HG2       LYS  28   4.169  -8.067  -5.273
  212   2HG   LYS  28          HG1       LYS  28   4.802  -6.635  -4.461
  213   1HD   LYS  28          HD2       LYS  28   6.808  -7.529  -5.139
  214   2HD   LYS  28          HD1       LYS  28   6.630  -8.431  -3.634
  215   1HE   LYS  28          HE2       LYS  28   6.193 -10.407  -4.721
  216   2HE   LYS  28          HE1       LYS  28   5.295  -9.605  -6.025
  217   1HZ   LYS  28          HZ1       LYS  28   7.511 -10.453  -6.720
  218   2HZ   LYS  28          HZ2       LYS  28   8.230  -9.362  -5.634
  219   3HZ   LYS  28          HZ3       LYS  28   7.321  -8.783  -6.947
  220    H    VAL  29           HN       VAL  29   4.236  -7.193  -0.386
  221    HA   VAL  29           HA       VAL  29   2.460  -8.934   1.105
  222    HB   VAL  29           HB       VAL  29   4.639  -6.919   1.741
  223   1HG1  VAL  29          HG11      VAL  29   3.029  -6.874   3.634
  224   2HG1  VAL  29          HG12      VAL  29   4.563  -7.618   4.098
  225   3HG1  VAL  29          HG13      VAL  29   3.157  -8.631   3.767
  226   1HG2  VAL  29          HG21      VAL  29   6.005  -8.775   2.005
  227   2HG2  VAL  29          HG22      VAL  29   4.892  -9.373   0.774
  228   3HG2  VAL  29          HG23      VAL  29   4.665  -9.826   2.464
  229    H    LEU  30           HN       LEU  30   2.694  -5.415   0.608
  230    HA   LEU  30           HA       LEU  30   0.738  -4.672   2.566
  231   1HB   LEU  30          HB2       LEU  30   1.862  -3.455   0.039
  232   2HB   LEU  30          HB1       LEU  30   0.621  -2.617   0.954
  233    HG   LEU  30           HG       LEU  30   3.170  -2.111   1.402
  234   1HD1  LEU  30          HD11      LEU  30   1.092  -2.512   3.551
  235   2HD1  LEU  30          HD12      LEU  30   1.480  -1.025   2.683
  236   3HD1  LEU  30          HD13      LEU  30   2.640  -1.705   3.833
  237   1HD2  LEU  30          HD21      LEU  30   2.761  -4.645   2.998
  238   2HD2  LEU  30          HD22      LEU  30   3.934  -3.424   3.437
  239   3HD2  LEU  30          HD23      LEU  30   4.069  -4.239   1.892
  240    H    LYS  31           HN       LYS  31   0.549  -5.795  -0.765
  241    HA   LYS  31           HA       LYS  31  -2.227  -5.205  -1.298
  242   1HB   LYS  31          HB2       LYS  31  -0.184  -6.150  -2.752
  243   2HB   LYS  31          HB1       LYS  31  -0.831  -7.693  -2.249
  244   1HG   LYS  31          HG2       LYS  31  -2.606  -5.570  -3.456
  245   2HG   LYS  31          HG1       LYS  31  -1.726  -6.717  -4.464
  246   1HD   LYS  31          HD2       LYS  31  -3.714  -7.427  -2.281
  247   2HD   LYS  31          HD1       LYS  31  -3.994  -7.551  -4.016
  248   1HE   LYS  31          HE2       LYS  31  -1.584  -8.955  -3.544
  249   2HE   LYS  31          HE1       LYS  31  -2.702  -9.460  -2.256
  250   1HZ   LYS  31          HZ1       LYS  31  -4.429  -9.714  -4.004
  251   2HZ   LYS  31          HZ2       LYS  31  -3.135 -10.800  -4.180
  252   3HZ   LYS  31          HZ3       LYS  31  -3.242  -9.433  -5.183
  253    H    GLN  32           HN       GLN  32  -0.516  -8.004   0.055
  254    HA   GLN  32           HA       GLN  32  -2.685  -9.767   0.500
  255   1HB   GLN  32          HB2       GLN  32   0.019  -9.261   1.613
  256   2HB   GLN  32          HB1       GLN  32  -1.061 -10.260   2.586
  257   1HG   GLN  32          HG2       GLN  32  -1.506 -11.409   0.211
  258   2HG   GLN  32          HG1       GLN  32   0.125 -10.811  -0.090
  259   1HE2  GLN  32          HE21      GLN  32   1.218 -12.851   0.040
  260   2HE2  GLN  32          HE22      GLN  32   1.286 -13.768   1.477
  261    H    TYR  33           HN       TYR  33  -1.456  -7.076   2.470
  262    HA   TYR  33           HA       TYR  33  -3.222  -7.409   4.736
  263   1HB   TYR  33          HB2       TYR  33  -1.182  -6.047   4.774
  264   2HB   TYR  33          HB1       TYR  33  -1.824  -4.998   3.510
  265    HD1  TYR  33           HD1      TYR  33  -2.344  -6.162   6.987
  266    HD2  TYR  33           HD2      TYR  33  -3.302  -3.204   4.029
  267    HE1  TYR  33           HE1      TYR  33  -3.468  -4.807   8.716
  268    HE2  TYR  33           HE2      TYR  33  -4.424  -1.837   5.763
  269    HH   TYR  33           HH       TYR  33  -5.594  -2.528   8.180
  270    H    ILE  34           HN       ILE  34  -3.419  -5.597   1.695
  271    HA   ILE  34           HA       ILE  34  -5.957  -4.309   2.167
  272    HB   ILE  34           HB       ILE  34  -4.493  -5.149  -0.354
  273   1HG1  ILE  34          HG12      ILE  34  -3.338  -3.629   1.376
  274   2HG1  ILE  34          HG11      ILE  34  -3.386  -3.061  -0.286
  275   1HG2  ILE  34          HG21      ILE  34  -7.058  -3.807   0.031
  276   2HG2  ILE  34          HG22      ILE  34  -6.353  -4.492  -1.433
  277   3HG2  ILE  34          HG23      ILE  34  -5.934  -2.853  -0.938
  278   1HD1  ILE  34          HD11      ILE  34  -5.062  -1.471   0.192
  279   2HD1  ILE  34          HD12      ILE  34  -3.993  -1.386   1.593
  280   3HD1  ILE  34          HD13      ILE  34  -5.516  -2.271   1.697
  281    H    ASN  35           HN       ASN  35  -5.005  -7.496   1.016
  282    HA   ASN  35           HA       ASN  35  -7.410  -8.358  -0.234
  283   1HB   ASN  35          HB2       ASN  35  -5.117  -9.451  -0.159
  284   2HB   ASN  35          HB1       ASN  35  -5.517 -10.008   1.465
  285   1HD2  ASN  35          HD21      ASN  35  -6.186 -10.483  -1.959
  286   2HD2  ASN  35          HD22      ASN  35  -7.176 -11.848  -1.767
  287    H    ASP  36           HN       ASP  36  -6.554  -8.034   3.162
  288    HA   ASP  36           HA       ASP  36  -8.772  -9.632   4.187
  289   1HB   ASP  36          HB2       ASP  36  -6.605  -9.228   5.354
  290   2HB   ASP  36          HB1       ASP  36  -7.022  -7.519   5.492
  291    H    ASN  37           HN       ASN  37  -8.103  -6.121   3.960
  292    HA   ASN  37           HA       ASN  37 -10.575  -5.207   5.066
  293   1HB   ASN  37          HB2       ASN  37  -8.600  -4.054   3.075
  294   2HB   ASN  37          HB1       ASN  37  -9.948  -3.120   3.734
  295   1HD2  ASN  37          HD21      ASN  37  -6.856  -3.025   4.170
  296   2HD2  ASN  37          HD22      ASN  37  -6.706  -2.991   5.869
  297    H    GLY  38           HN       GLY  38  -9.718  -6.336   1.843
  298   1HA   GLY  38          HA2       GLY  38 -11.239  -7.108   0.180
  299   2HA   GLY  38          HA1       GLY  38 -12.568  -6.414   1.109
  300    H    ILE  39           HN       ILE  39  -9.629  -4.688   0.167
  301    HA   ILE  39           HA       ILE  39 -11.327  -2.906  -1.554
  302    HB   ILE  39           HB       ILE  39  -8.868  -2.306   0.128
  303   1HG1  ILE  39          HG12      ILE  39 -10.872  -2.760   1.496
  304   2HG1  ILE  39          HG11      ILE  39 -10.448  -1.047   1.562
  305   1HG2  ILE  39          HG21      ILE  39  -8.886  -0.786  -1.714
  306   2HG2  ILE  39          HG22      ILE  39  -9.594   0.095  -0.360
  307   3HG2  ILE  39          HG23      ILE  39 -10.634  -0.577  -1.616
  308   1HD1  ILE  39          HD11      ILE  39 -12.130  -0.694  -0.328
  309   2HD1  ILE  39          HD12      ILE  39 -12.819  -1.128   1.236
  310   3HD1  ILE  39          HD13      ILE  39 -12.673  -2.345  -0.032
  311    H    ASP  40           HN       ASP  40 -10.376  -2.182  -3.528
  312    HA   ASP  40           HA       ASP  40  -7.660  -2.824  -4.321
  313   1HB   ASP  40          HB2       ASP  40  -8.296  -4.597  -5.962
  314   2HB   ASP  40          HB1       ASP  40  -8.625  -5.086  -4.298
  315    H    GLY  41           HN       GLY  41  -7.141  -1.611  -6.152
  316   1HA   GLY  41          HA2       GLY  41  -8.937  -0.922  -8.250
  317   2HA   GLY  41          HA1       GLY  41  -8.930   0.399  -7.079
  318    H    GLU  42           HN       GLU  42  -7.231   1.832  -7.114
  319    HA   GLU  42           HA       GLU  42  -4.955   1.198  -8.968
  320   1HB   GLU  42          HB2       GLU  42  -6.683   3.615  -8.503
  321   2HB   GLU  42          HB1       GLU  42  -5.046   3.830  -9.127
  322   1HG   GLU  42          HG2       GLU  42  -5.537   2.860 -11.144
  323   2HG   GLU  42          HG1       GLU  42  -6.687   1.725 -10.437
  324    H    TRP  43           HN       TRP  43  -2.956   1.299  -8.043
  325    HA   TRP  43           HA       TRP  43  -2.713   2.480  -5.310
  326   1HB   TRP  43          HB2       TRP  43  -1.194   0.413  -6.908
  327   2HB   TRP  43          HB1       TRP  43  -0.516   1.122  -5.455
  328    HD1  TRP  43           HD1      TRP  43  -4.248   0.213  -5.826
  329    HE1  TRP  43           HE1      TRP  43  -4.773  -1.639  -4.122
  330    HE3  TRP  43           HE3      TRP  43   0.420  -0.638  -4.038
  331    HZ2  TRP  43           HZ2      TRP  43  -3.388  -3.242  -2.201
  332    HZ3  TRP  43           HZ3      TRP  43   0.807  -2.319  -2.247
  333    HH2  TRP  43           HH2      TRP  43  -1.088  -3.615  -1.331
  334    H    THR  44           HN       THR  44  -2.560   4.713  -6.318
  335    HA   THR  44           HA       THR  44  -0.490   5.453  -8.153
  336    HB   THR  44           HB       THR  44  -0.891   7.731  -7.121
  337    HG1  THR  44           HG1      THR  44  -2.353   7.862  -5.472
  338   1HG2  THR  44          HG21      THR  44  -2.365   7.454  -8.854
  339   2HG2  THR  44          HG22      THR  44  -3.538   7.439  -7.538
  340   3HG2  THR  44          HG23      THR  44  -2.971   5.919  -8.231
  341    H    TYR  45           HN       TYR  45   1.684   5.681  -7.829
  342    HA   TYR  45           HA       TYR  45   2.786   5.172  -5.116
  343   1HB   TYR  45          HB2       TYR  45   3.573   3.887  -7.064
  344   2HB   TYR  45          HB1       TYR  45   4.016   5.380  -7.890
  345    HD1  TYR  45           HD1      TYR  45   4.539   3.970  -4.443
  346    HD2  TYR  45           HD2      TYR  45   6.302   5.767  -7.922
  347    HE1  TYR  45           HE1      TYR  45   6.760   3.928  -3.339
  348    HE2  TYR  45           HE2      TYR  45   8.522   5.727  -6.819
  349    HH   TYR  45           HH       TYR  45   9.447   5.645  -4.555
  350    H    ASP  46           HN       ASP  46   4.571   6.620  -4.334
  351    HA   ASP  46           HA       ASP  46   4.460   9.393  -5.472
  352   1HB   ASP  46          HB2       ASP  46   4.477   8.675  -2.519
  353   2HB   ASP  46          HB1       ASP  46   4.298  10.281  -3.216
  354    H    ASP  47           HN       ASP  47   6.493  10.086  -5.943
  355    HA   ASP  47           HA       ASP  47   8.859   8.588  -5.154
  356   1HB   ASP  47          HB2       ASP  47   8.546   9.793  -7.307
  357   2HB   ASP  47          HB1       ASP  47   8.532  11.324  -6.430
  358    H    ALA  48           HN       ALA  48   6.998  10.889  -3.481
  359    HA   ALA  48           HA       ALA  48   8.850  12.603  -2.216
  360   1HB   ALA  48          HB1       ALA  48   6.206  11.343  -1.566
  361   2HB   ALA  48          HB2       ALA  48   6.609  13.050  -1.777
  362   3HB   ALA  48          HB3       ALA  48   7.046  12.220  -0.283
  363    H    THR  49           HN       THR  49   7.453   9.785  -0.541
  364    HA   THR  49           HA       THR  49  10.167   9.137   0.561
  365    HB   THR  49           HB       THR  49   8.771  10.405   2.169
  366    HG1  THR  49           HG1      THR  49  10.052   8.856   3.089
  367   1HG2  THR  49          HG21      THR  49   6.561   9.880   1.326
  368   2HG2  THR  49          HG22      THR  49   6.659   9.314   2.995
  369   3HG2  THR  49          HG23      THR  49   6.796   8.164   1.662
  370    H    LYS  50           HN       LYS  50   8.826   7.909  -1.694
  371    HA   LYS  50           HA       LYS  50   8.272   5.783  -2.518
  372   1HB   LYS  50          HB2       LYS  50   9.431   4.927   0.156
  373   2HB   LYS  50          HB1       LYS  50   9.246   3.902  -1.264
  374   1HG   LYS  50          HG2       LYS  50  10.699   6.392  -1.833
  375   2HG   LYS  50          HG1       LYS  50  11.505   5.382  -0.634
  376   1HD   LYS  50          HD2       LYS  50  10.766   3.507  -2.490
  377   2HD   LYS  50          HD1       LYS  50  11.079   4.904  -3.520
  378   1HE   LYS  50          HE2       LYS  50  13.035   3.982  -1.392
  379   2HE   LYS  50          HE1       LYS  50  13.115   3.441  -3.080
  380   1HZ   LYS  50          HZ1       LYS  50  14.441   5.466  -2.670
  381   2HZ   LYS  50          HZ2       LYS  50  13.021   6.285  -2.223
  382   3HZ   LYS  50          HZ3       LYS  50  13.211   5.712  -3.811
  383    H    THR  51           HN       THR  51   6.194   7.229  -1.214
  384    HA   THR  51           HA       THR  51   4.749   5.437   0.604
  385    HB   THR  51           HB       THR  51   3.477   7.719  -0.879
  386    HG1  THR  51           HG1      THR  51   4.564   9.183   0.436
  387   1HG2  THR  51          HG21      THR  51   3.365   7.750   2.018
  388   2HG2  THR  51          HG22      THR  51   2.869   6.178   1.393
  389   3HG2  THR  51          HG23      THR  51   2.046   7.641   0.854
  390    H    TRP  52           HN       TRP  52   2.196   5.339  -0.254
  391    HA   TRP  52           HA       TRP  52   2.055   4.492  -3.082
  392   1HB   TRP  52          HB2       TRP  52   1.968   2.684  -0.674
  393   2HB   TRP  52          HB1       TRP  52   1.125   2.251  -2.156
  394    HD1  TRP  52           HD1      TRP  52   4.568   2.491  -0.645
  395    HE1  TRP  52           HE1      TRP  52   6.295   1.570  -2.332
  396    HE3  TRP  52           HE3      TRP  52   1.585   1.997  -4.713
  397    HZ2  TRP  52           HZ2      TRP  52   6.376   0.725  -5.077
  398    HZ3  TRP  52           HZ3      TRP  52   2.486   1.130  -6.864
  399    HH2  TRP  52           HH2      TRP  52   4.879   0.493  -7.046
  400    H    THR  53           HN       THR  53  -0.303   3.239  -3.159
  401    HA   THR  53           HA       THR  53  -2.298   4.503  -1.406
  402    HB   THR  53           HB       THR  53  -2.520   5.021  -4.367
  403    HG1  THR  53           HG1      THR  53  -1.196   6.671  -2.482
  404   1HG2  THR  53          HG21      THR  53  -3.741   6.015  -1.839
  405   2HG2  THR  53          HG22      THR  53  -4.493   5.694  -3.402
  406   3HG2  THR  53          HG23      THR  53  -3.559   7.170  -3.159
  407    H    VAL  54           HN       VAL  54  -4.598   3.890  -2.446
  408    HA   VAL  54           HA       VAL  54  -4.827   1.563  -4.124
  409    HB   VAL  54           HB       VAL  54  -3.694   0.408  -2.318
  410   1HG1  VAL  54          HG11      VAL  54  -3.775   1.724  -0.436
  411   2HG1  VAL  54          HG12      VAL  54  -4.980   0.512  -0.006
  412   3HG1  VAL  54          HG13      VAL  54  -5.489   2.081  -0.626
  413   1HG2  VAL  54          HG21      VAL  54  -6.074  -0.449  -3.226
  414   2HG2  VAL  54          HG22      VAL  54  -6.495  -0.251  -1.525
  415   3HG2  VAL  54          HG23      VAL  54  -5.173  -1.328  -1.985
  416    H    THR  55           HN       THR  55  -6.393   3.408  -4.650
  417    HA   THR  55           HA       THR  55  -8.707   3.781  -2.882
  418    HB   THR  55           HB       THR  55  -8.358   4.584  -5.783
  419    HG1  THR  55           HG1      THR  55  -6.720   5.689  -5.117
  420   1HG2  THR  55          HG21      THR  55  -9.680   6.099  -3.531
  421   2HG2  THR  55          HG22      THR  55 -10.558   4.899  -4.480
  422   3HG2  THR  55          HG23      THR  55  -9.882   6.325  -5.269
  423    H    GLU  56           HN       GLU  56 -10.473   2.452  -2.884
  424    HA   GLU  56           HA       GLU  56 -10.748   0.136  -4.532
  425   1HB   GLU  56          HB2       GLU  56 -11.821   0.898  -2.253
  426   2HB   GLU  56          HB1       GLU  56 -13.085   1.568  -3.284
  427   1HG   GLU  56          HG2       GLU  56 -12.172  -1.253  -3.743
  428   2HG   GLU  56          HG1       GLU  56 -13.279  -0.914  -2.412
  Start of MODEL   29
    1   1H    THR   1          HT1       THR   1  14.113   3.431   5.497
    2   2H    THR   1          HT2       THR   1  15.503   3.045   4.599
    3   3H    THR   1          HT3       THR   1  14.574   1.810   5.303
    4    HA   THR   1           HA       THR   1  13.528   3.644   3.210
    5    HB   THR   1           HB       THR   1  15.474   2.382   2.403
    6    HG1  THR   1           HG1      THR   1  14.063   2.400   0.811
    7   1HG2  THR   1          HG21      THR   1  15.721   0.573   3.888
    8   2HG2  THR   1          HG22      THR   1  15.174  -0.198   2.399
    9   3HG2  THR   1          HG23      THR   1  14.036   0.082   3.716
   10    H    THR   2           HN       THR   2  11.962   3.202   5.373
   11    HA   THR   2           HA       THR   2  10.427   0.708   5.152
   12    HB   THR   2           HB       THR   2   9.710   3.227   6.664
   13    HG1  THR   2           HG1      THR   2  11.548   1.195   7.396
   14   1HG2  THR   2          HG21      THR   2   8.387   0.880   6.464
   15   2HG2  THR   2          HG22      THR   2   8.367   1.870   7.923
   16   3HG2  THR   2          HG23      THR   2   9.468   0.498   7.804
   17    H    PHE   3           HN       PHE   3   9.408   0.685   3.113
   18    HA   PHE   3           HA       PHE   3   8.194   2.831   1.728
   19   1HB   PHE   3          HB2       PHE   3   7.435  -0.107   1.893
   20   2HB   PHE   3          HB1       PHE   3   6.923   0.993   0.613
   21    HD1  PHE   3           HD1      PHE   3   9.081   2.513  -0.242
   22    HD2  PHE   3           HD2      PHE   3   9.202  -1.507   1.278
   23    HE1  PHE   3           HE1      PHE   3  11.219   2.124  -1.435
   24    HE2  PHE   3           HE2      PHE   3  11.339  -1.892   0.083
   25    HZ   PHE   3           HZ       PHE   3  12.349  -0.077  -1.272
   26    H    LYS   4           HN       LYS   4   5.748   3.099   1.416
   27    HA   LYS   4           HA       LYS   4   4.172   2.570   3.903
   28   1HB   LYS   4          HB2       LYS   4   5.377   4.832   3.874
   29   2HB   LYS   4          HB1       LYS   4   4.327   5.264   2.532
   30   1HG   LYS   4          HG2       LYS   4   2.342   4.817   3.927
   31   2HG   LYS   4          HG1       LYS   4   3.391   4.407   5.282
   32   1HD   LYS   4          HD2       LYS   4   3.769   6.580   5.784
   33   2HD   LYS   4          HD1       LYS   4   4.076   6.997   4.099
   34   1HE   LYS   4          HE2       LYS   4   1.854   7.543   3.688
   35   2HE   LYS   4          HE1       LYS   4   1.245   6.436   4.935
   36   1HZ   LYS   4          HZ1       LYS   4   2.851   8.874   5.490
   37   2HZ   LYS   4          HZ2       LYS   4   2.136   7.846   6.638
   38   3HZ   LYS   4          HZ3       LYS   4   1.162   8.797   5.621
   39    H    LEU   5           HN       LEU   5   1.861   2.707   3.541
   40    HA   LEU   5           HA       LEU   5   0.857   3.179   0.805
   41   1HB   LEU   5          HB2       LEU   5   1.758   0.709   1.274
   42   2HB   LEU   5          HB1       LEU   5   0.186   0.536   2.043
   43    HG   LEU   5           HG       LEU   5  -0.015   1.890  -0.544
   44   1HD1  LEU   5          HD11      LEU   5   1.978   0.211  -0.786
   45   2HD1  LEU   5          HD12      LEU   5   0.700   0.212  -2.007
   46   3HD1  LEU   5          HD13      LEU   5   0.713  -1.023  -0.737
   47   1HD2  LEU   5          HD21      LEU   5  -1.730   0.081  -0.869
   48   2HD2  LEU   5          HD22      LEU   5  -1.954   1.011   0.613
   49   3HD2  LEU   5          HD23      LEU   5  -1.237  -0.599   0.682
   50    H    ILE   6           HN       ILE   6  -1.155   4.080   0.980
   51    HA   ILE   6           HA       ILE   6  -2.515   3.995   3.637
   52    HB   ILE   6           HB       ILE   6  -2.705   5.792   1.201
   53   1HG1  ILE   6          HG12      ILE   6  -0.627   5.984   2.542
   54   2HG1  ILE   6          HG11      ILE   6  -1.611   7.442   2.656
   55   1HG2  ILE   6          HG21      ILE   6  -4.276   5.729   3.769
   56   2HG2  ILE   6          HG22      ILE   6  -4.857   5.967   2.121
   57   3HG2  ILE   6          HG23      ILE   6  -3.987   7.261   2.944
   58   1HD1  ILE   6          HD11      ILE   6  -2.519   5.772   4.735
   59   2HD1  ILE   6          HD12      ILE   6  -1.527   7.221   4.899
   60   3HD1  ILE   6          HD13      ILE   6  -0.761   5.639   4.763
   61    H    ILE   7           HN       ILE   7  -4.715   3.364   3.772
   62    HA   ILE   7           HA       ILE   7  -5.752   1.867   1.397
   63    HB   ILE   7           HB       ILE   7  -6.392   1.638   4.357
   64   1HG1  ILE   7          HG12      ILE   7  -4.790  -0.267   2.627
   65   2HG1  ILE   7          HG11      ILE   7  -4.036   0.985   3.614
   66   1HG2  ILE   7          HG21      ILE   7  -8.260   0.823   3.120
   67   2HG2  ILE   7          HG22      ILE   7  -7.320  -0.609   3.537
   68   3HG2  ILE   7          HG23      ILE   7  -7.222   0.067   1.910
   69   1HD1  ILE   7          HD11      ILE   7  -5.602  -0.076   5.497
   70   2HD1  ILE   7          HD12      ILE   7  -4.012  -0.747   5.138
   71   3HD1  ILE   7          HD13      ILE   7  -5.458  -1.499   4.464
   72    H    ASN   8           HN       ASN   8  -7.289   3.013   0.312
   73    HA   ASN   8           HA       ASN   8  -9.066   4.870   1.843
   74   1HB   ASN   8          HB2       ASN   8  -8.296   4.632  -1.085
   75   2HB   ASN   8          HB1       ASN   8  -9.448   5.814  -0.465
   76   1HD2  ASN   8          HD21      ASN   8  -6.932   6.532  -1.735
   77   2HD2  ASN   8          HD22      ASN   8  -5.972   7.312  -0.559
   78    H    GLY   9           HN       GLY   9  -9.751   2.242   2.175
   79   1HA   GLY   9          HA2       GLY   9 -11.573   1.274   0.128
   80   2HA   GLY   9          HA1       GLY   9 -11.410   0.617   1.762
   81    H    LYS  10           HN       LYS  10 -13.857   1.334   0.180
   82    HA   LYS  10           HA       LYS  10 -15.133   3.683   1.050
   83   1HB   LYS  10          HB2       LYS  10 -16.239   0.905   0.541
   84   2HB   LYS  10          HB1       LYS  10 -17.208   2.379   0.578
   85   1HG   LYS  10          HG2       LYS  10 -15.412   3.211  -1.187
   86   2HG   LYS  10          HG1       LYS  10 -15.202   1.481  -1.458
   87   1HD   LYS  10          HD2       LYS  10 -17.294   1.229  -2.364
   88   2HD   LYS  10          HD1       LYS  10 -18.005   2.467  -1.327
   89   1HE   LYS  10          HE2       LYS  10 -17.998   3.705  -3.265
   90   2HE   LYS  10          HE1       LYS  10 -16.296   3.982  -2.845
   91   1HZ   LYS  10          HZ1       LYS  10 -16.601   3.057  -5.109
   92   2HZ   LYS  10          HZ2       LYS  10 -17.275   1.659  -4.418
   93   3HZ   LYS  10          HZ3       LYS  10 -15.656   2.069  -4.106
   94    H    THR  11           HN       THR  11 -14.649   0.628   2.748
   95    HA   THR  11           HA       THR  11 -16.033   1.784   5.149
   96    HB   THR  11           HB       THR  11 -15.650  -1.122   4.365
   97    HG1  THR  11           HG1      THR  11 -17.506  -0.992   3.350
   98   1HG2  THR  11          HG21      THR  11 -17.480  -1.447   6.047
   99   2HG2  THR  11          HG22      THR  11 -17.340   0.262   6.463
  100   3HG2  THR  11          HG23      THR  11 -15.984  -0.829   6.749
  101    H    LEU  12           HN       LEU  12 -13.275  -0.124   3.969
  102    HA   LEU  12           HA       LEU  12 -12.019  -0.033   6.673
  103   1HB   LEU  12          HB2       LEU  12 -11.410  -1.517   4.097
  104   2HB   LEU  12          HB1       LEU  12 -10.457  -1.674   5.573
  105    HG   LEU  12           HG       LEU  12 -13.424  -2.062   5.730
  106   1HD1  LEU  12          HD11      LEU  12 -12.671  -3.428   3.793
  107   2HD1  LEU  12          HD12      LEU  12 -13.171  -4.432   5.154
  108   3HD1  LEU  12          HD13      LEU  12 -11.456  -4.186   4.823
  109   1HD2  LEU  12          HD21      LEU  12 -10.949  -2.947   7.195
  110   2HD2  LEU  12          HD22      LEU  12 -12.438  -3.879   7.352
  111   3HD2  LEU  12          HD23      LEU  12 -12.404  -2.184   7.836
  112    H    LYS  13           HN       LYS  13 -10.006   0.993   6.986
  113    HA   LYS  13           HA       LYS  13  -8.589   2.247   4.721
  114   1HB   LYS  13          HB2       LYS  13 -10.297   3.690   6.731
  115   2HB   LYS  13          HB1       LYS  13  -8.869   4.494   6.079
  116   1HG   LYS  13          HG2       LYS  13  -9.857   3.658   3.766
  117   2HG   LYS  13          HG1       LYS  13 -11.371   3.640   4.671
  118   1HD   LYS  13          HD2       LYS  13 -10.442   6.046   5.447
  119   2HD   LYS  13          HD1       LYS  13  -9.676   5.947   3.861
  120   1HE   LYS  13          HE2       LYS  13 -11.682   6.077   2.740
  121   2HE   LYS  13          HE1       LYS  13 -12.554   5.171   3.993
  122   1HZ   LYS  13          HZ1       LYS  13 -12.396   7.061   5.460
  123   2HZ   LYS  13          HZ2       LYS  13 -13.126   7.548   4.006
  124   3HZ   LYS  13          HZ3       LYS  13 -11.500   7.932   4.314
  125    H    GLY  14           HN       GLY  14  -6.788   3.779   5.846
  126   1HA   GLY  14          HA2       GLY  14  -5.595   3.902   8.134
  127   2HA   GLY  14          HA1       GLY  14  -5.596   2.141   8.039
  128    H    GLU  15           HN       GLU  15  -3.168   3.352   8.264
  129    HA   GLU  15           HA       GLU  15  -2.030   3.365   5.489
  130   1HB   GLU  15          HB2       GLU  15  -0.210   4.690   6.553
  131   2HB   GLU  15          HB1       GLU  15  -1.786   5.443   6.790
  132   1HG   GLU  15          HG2       GLU  15  -1.919   4.698   9.051
  133   2HG   GLU  15          HG1       GLU  15  -0.574   3.577   8.837
  134    H    THR  16           HN       THR  16   0.287   2.468   5.433
  135    HA   THR  16           HA       THR  16   1.033   0.534   7.511
  136    HB   THR  16           HB       THR  16  -0.781  -0.638   6.343
  137    HG1  THR  16           HG1      THR  16   0.334  -2.445   6.161
  138   1HG2  THR  16          HG21      THR  16  -0.283  -1.269   3.885
  139   2HG2  THR  16          HG22      THR  16   0.837   0.094   3.899
  140   3HG2  THR  16          HG23      THR  16  -0.881   0.358   4.204
  141    H    THR  17           HN       THR  17   3.182  -0.207   7.235
  142    HA   THR  17           HA       THR  17   4.640   0.739   4.794
  143    HB   THR  17           HB       THR  17   6.467   1.426   6.391
  144    HG1  THR  17           HG1      THR  17   5.836   0.192   8.157
  145   1HG2  THR  17          HG21      THR  17   5.166   3.435   7.297
  146   2HG2  THR  17          HG22      THR  17   3.739   2.711   6.556
  147   3HG2  THR  17          HG23      THR  17   5.108   3.188   5.552
  148    H    THR  18           HN       THR  18   6.641  -0.482   4.407
  149    HA   THR  18           HA       THR  18   6.980  -2.958   6.005
  150    HB   THR  18           HB       THR  18   5.762  -2.657   3.351
  151    HG1  THR  18           HG1      THR  18   4.861  -3.907   4.935
  152   1HG2  THR  18          HG21      THR  18   6.911  -4.504   2.227
  153   2HG2  THR  18          HG22      THR  18   8.064  -4.626   3.557
  154   3HG2  THR  18          HG23      THR  18   8.034  -3.180   2.545
  155    H    GLU  19           HN       GLU  19   9.102  -3.999   5.491
  156    HA   GLU  19           HA       GLU  19  11.121  -2.010   4.497
  157   1HB   GLU  19          HB2       GLU  19  11.054  -2.609   6.971
  158   2HB   GLU  19          HB1       GLU  19  11.498  -4.251   6.505
  159   1HG   GLU  19          HG2       GLU  19  13.385  -2.896   5.139
  160   2HG   GLU  19          HG1       GLU  19  13.133  -1.766   6.471
  161    H    ALA  20           HN       ALA  20  11.896  -2.689   2.529
  162    HA   ALA  20           HA       ALA  20  12.697  -5.524   2.184
  163   1HB   ALA  20          HB1       ALA  20  10.455  -4.092   0.783
  164   2HB   ALA  20          HB2       ALA  20  10.486  -5.730   1.438
  165   3HB   ALA  20          HB3       ALA  20  11.337  -5.364  -0.063
  166    H    VAL  21           HN       VAL  21  13.590  -5.735  -0.198
  167    HA   VAL  21           HA       VAL  21  15.811  -3.982  -0.531
  168    HB   VAL  21           HB       VAL  21  15.617  -6.284  -1.416
  169   1HG1  VAL  21          HG11      VAL  21  13.151  -5.889  -2.121
  170   2HG1  VAL  21          HG12      VAL  21  14.155  -6.901  -3.159
  171   3HG1  VAL  21          HG13      VAL  21  13.839  -5.224  -3.602
  172   1HG2  VAL  21          HG21      VAL  21  15.961  -4.270  -3.651
  173   2HG2  VAL  21          HG22      VAL  21  16.648  -5.893  -3.586
  174   3HG2  VAL  21          HG23      VAL  21  17.200  -4.656  -2.457
  175    H    ASP  22           HN       ASP  22  12.596  -3.983  -2.023
  176    HA   ASP  22           HA       ASP  22  12.960  -1.158  -2.836
  177   1HB   ASP  22          HB2       ASP  22  13.934  -2.601  -4.608
  178   2HB   ASP  22          HB1       ASP  22  12.397  -3.456  -4.736
  179    H    ALA  23           HN       ALA  23  10.870  -0.216  -3.521
  180    HA   ALA  23           HA       ALA  23   8.637  -1.059  -1.943
  181   1HB   ALA  23          HB1       ALA  23   8.471   1.160  -2.513
  182   2HB   ALA  23          HB2       ALA  23   7.550   0.522  -3.874
  183   3HB   ALA  23          HB3       ALA  23   9.257   0.918  -4.073
  184    H    ALA  24           HN       ALA  24   9.654  -1.887  -5.207
  185    HA   ALA  24           HA       ALA  24   7.203  -2.921  -6.247
  186   1HB   ALA  24          HB1       ALA  24   9.476  -2.498  -7.373
  187   2HB   ALA  24          HB2       ALA  24   8.636  -3.972  -7.855
  188   3HB   ALA  24          HB3       ALA  24   9.974  -4.054  -6.709
  189    H    THR  25           HN       THR  25   9.819  -4.529  -4.421
  190    HA   THR  25           HA       THR  25   8.547  -7.117  -4.293
  191    HB   THR  25           HB       THR  25  10.708  -5.703  -2.695
  192    HG1  THR  25           HG1      THR  25  12.029  -7.034  -3.935
  193   1HG2  THR  25          HG21      THR  25  11.296  -7.875  -1.730
  194   2HG2  THR  25          HG22      THR  25   9.950  -8.639  -2.577
  195   3HG2  THR  25          HG23      THR  25   9.633  -7.463  -1.297
  196    H    ALA  26           HN       ALA  26   8.793  -4.426  -1.925
  197    HA   ALA  26           HA       ALA  26   7.259  -5.625   0.144
  198   1HB   ALA  26          HB1       ALA  26   7.763  -2.769  -0.728
  199   2HB   ALA  26          HB2       ALA  26   8.528  -3.652   0.593
  200   3HB   ALA  26          HB3       ALA  26   6.842  -3.143   0.733
  201    H    GLU  27           HN       GLU  27   6.171  -3.209  -2.264
  202    HA   GLU  27           HA       GLU  27   3.481  -3.009  -1.761
  203   1HB   GLU  27          HB2       GLU  27   4.794  -1.882  -3.550
  204   2HB   GLU  27          HB1       GLU  27   4.774  -3.377  -4.484
  205   1HG   GLU  27          HG2       GLU  27   2.162  -3.203  -4.136
  206   2HG   GLU  27          HG1       GLU  27   2.520  -1.495  -3.876
  207    H    LYS  28           HN       LYS  28   5.024  -5.801  -3.358
  208    HA   LYS  28           HA       LYS  28   2.602  -7.135  -4.182
  209   1HB   LYS  28          HB2       LYS  28   5.311  -8.227  -3.314
  210   2HB   LYS  28          HB1       LYS  28   4.106  -9.118  -4.243
  211   1HG   LYS  28          HG2       LYS  28   4.452  -7.854  -6.164
  212   2HG   LYS  28          HG1       LYS  28   5.055  -6.462  -5.264
  213   1HD   LYS  28          HD2       LYS  28   7.074  -7.250  -6.036
  214   2HD   LYS  28          HD1       LYS  28   6.949  -8.245  -4.585
  215   1HE   LYS  28          HE2       LYS  28   6.497 -10.167  -5.779
  216   2HE   LYS  28          HE1       LYS  28   5.638  -9.289  -7.061
  217   1HZ   LYS  28          HZ1       LYS  28   8.570  -9.262  -6.571
  218   2HZ   LYS  28          HZ2       LYS  28   7.771  -8.311  -7.731
  219   3HZ   LYS  28          HZ3       LYS  28   7.781 -10.004  -7.876
  220    H    VAL  29           HN       VAL  29   4.589  -7.291  -1.235
  221    HA   VAL  29           HA       VAL  29   2.919  -9.192   0.184
  222    HB   VAL  29           HB       VAL  29   5.052  -7.150   0.884
  223   1HG1  VAL  29          HG11      VAL  29   3.503  -7.266   2.823
  224   2HG1  VAL  29          HG12      VAL  29   5.069  -7.992   3.195
  225   3HG1  VAL  29          HG13      VAL  29   3.682  -9.023   2.845
  226   1HG2  VAL  29          HG21      VAL  29   5.589  -9.338  -0.266
  227   2HG2  VAL  29          HG22      VAL  29   5.011 -10.163   1.181
  228   3HG2  VAL  29          HG23      VAL  29   6.413  -9.097   1.275
  229    H    LEU  30           HN       LEU  30   3.020  -5.639  -0.079
  230    HA   LEU  30           HA       LEU  30   1.096  -5.103   1.977
  231   1HB   LEU  30          HB2       LEU  30   2.113  -3.673  -0.486
  232   2HB   LEU  30          HB1       LEU  30   0.872  -2.943   0.520
  233    HG   LEU  30           HG       LEU  30   3.407  -2.377   0.943
  234   1HD1  LEU  30          HD11      LEU  30   2.945  -2.177   3.406
  235   2HD1  LEU  30          HD12      LEU  30   1.430  -3.047   3.123
  236   3HD1  LEU  30          HD13      LEU  30   1.704  -1.480   2.358
  237   1HD2  LEU  30          HD21      LEU  30   3.147  -5.041   2.347
  238   2HD2  LEU  30          HD22      LEU  30   4.303  -3.818   2.822
  239   3HD2  LEU  30          HD23      LEU  30   4.389  -4.512   1.216
  240    H    LYS  31           HN       LYS  31   0.855  -5.965  -1.430
  241    HA   LYS  31           HA       LYS  31  -1.953  -5.449  -1.849
  242   1HB   LYS  31          HB2       LYS  31   0.088  -6.216  -3.413
  243   2HB   LYS  31          HB1       LYS  31  -0.502  -7.811  -3.012
  244   1HG   LYS  31          HG2       LYS  31  -2.364  -5.660  -4.022
  245   2HG   LYS  31          HG1       LYS  31  -1.478  -6.708  -5.130
  246   1HD   LYS  31          HD2       LYS  31  -3.391  -7.628  -2.958
  247   2HD   LYS  31          HD1       LYS  31  -3.712  -7.636  -4.691
  248   1HE   LYS  31          HE2       LYS  31  -1.253  -8.999  -4.377
  249   2HE   LYS  31          HE1       LYS  31  -2.325  -9.628  -3.104
  250   1HZ   LYS  31          HZ1       LYS  31  -2.745 -10.828  -5.137
  251   2HZ   LYS  31          HZ2       LYS  31  -2.965  -9.382  -6.002
  252   3HZ   LYS  31          HZ3       LYS  31  -4.082  -9.838  -4.806
  253    H    GLN  32           HN       GLN  32  -0.114  -8.278  -0.748
  254    HA   GLN  32           HA       GLN  32  -2.214 -10.142  -0.381
  255   1HB   GLN  32          HB2       GLN  32   0.503  -9.629   0.702
  256   2HB   GLN  32          HB1       GLN  32  -0.517 -10.744   1.611
  257   1HG   GLN  32          HG2       GLN  32  -0.988 -11.738  -0.809
  258   2HG   GLN  32          HG1       GLN  32   0.585 -11.015  -1.151
  259   1HE2  GLN  32          HE21      GLN  32   2.422 -11.700   0.319
  260   2HE2  GLN  32          HE22      GLN  32   2.369 -13.255   1.019
  261    H    TYR  33           HN       TYR  33  -0.999  -7.579   1.764
  262    HA   TYR  33           HA       TYR  33  -2.684  -8.138   4.044
  263   1HB   TYR  33          HB2       TYR  33  -0.687  -6.715   4.122
  264   2HB   TYR  33          HB1       TYR  33  -1.407  -5.593   2.968
  265    HD1  TYR  33           HD1      TYR  33  -1.757  -7.040   6.358
  266    HD2  TYR  33           HD2      TYR  33  -2.933  -3.904   3.675
  267    HE1  TYR  33           HE1      TYR  33  -2.862  -5.866   8.226
  268    HE2  TYR  33           HE2      TYR  33  -4.036  -2.718   5.549
  269    HH   TYR  33           HH       TYR  33  -3.536  -2.876   8.379
  270    H    ILE  34           HN       ILE  34  -3.041  -6.114   1.155
  271    HA   ILE  34           HA       ILE  34  -5.597  -4.949   1.810
  272    HB   ILE  34           HB       ILE  34  -4.207  -5.544  -0.822
  273   1HG1  ILE  34          HG12      ILE  34  -3.034  -4.126   0.995
  274   2HG1  ILE  34          HG11      ILE  34  -3.140  -3.443  -0.622
  275   1HG2  ILE  34          HG21      ILE  34  -6.574  -5.083  -1.203
  276   2HG2  ILE  34          HG22      ILE  34  -5.608  -3.709  -1.739
  277   3HG2  ILE  34          HG23      ILE  34  -6.476  -3.632  -0.206
  278   1HD1  ILE  34          HD11      ILE  34  -4.793  -1.905   0.013
  279   2HD1  ILE  34          HD12      ILE  34  -3.755  -1.954   1.439
  280   3HD1  ILE  34          HD13      ILE  34  -5.273  -2.853   1.420
  281    H    ASN  35           HN       ASN  35  -4.592  -8.011   0.398
  282    HA   ASN  35           HA       ASN  35  -7.005  -8.859  -0.842
  283   1HB   ASN  35          HB2       ASN  35  -4.676  -9.885  -0.884
  284   2HB   ASN  35          HB1       ASN  35  -5.036 -10.570   0.700
  285   1HD2  ASN  35          HD21      ASN  35  -4.651 -11.966  -1.973
  286   2HD2  ASN  35          HD22      ASN  35  -6.064 -12.882  -2.191
  287    H    ASP  36           HN       ASP  36  -6.083  -8.716   2.548
  288    HA   ASP  36           HA       ASP  36  -8.233 -10.447   3.509
  289   1HB   ASP  36          HB2       ASP  36  -5.978  -9.970   4.591
  290   2HB   ASP  36          HB1       ASP  36  -6.604  -8.374   5.005
  291    H    ASN  37           HN       ASN  37  -7.615  -6.923   3.794
  292    HA   ASN  37           HA       ASN  37 -10.173  -6.228   4.862
  293   1HB   ASN  37          HB2       ASN  37  -8.212  -4.661   3.149
  294   2HB   ASN  37          HB1       ASN  37  -9.506  -3.946   4.117
  295   1HD2  ASN  37          HD21      ASN  37  -8.700  -3.147   6.053
  296   2HD2  ASN  37          HD22      ASN  37  -7.451  -3.864   6.967
  297    H    GLY  38           HN       GLY  38  -9.060  -6.721   1.551
  298   1HA   GLY  38          HA2       GLY  38 -10.413  -7.181  -0.348
  299   2HA   GLY  38          HA1       GLY  38 -11.842  -6.788   0.609
  300    H    ILE  39           HN       ILE  39  -9.063  -4.649   0.425
  301    HA   ILE  39           HA       ILE  39 -10.760  -2.689  -1.086
  302    HB   ILE  39           HB       ILE  39  -8.523  -2.291   0.931
  303   1HG1  ILE  39          HG12      ILE  39 -10.585  -3.169   1.957
  304   2HG1  ILE  39          HG11      ILE  39 -10.339  -1.481   2.413
  305   1HG2  ILE  39          HG21      ILE  39 -10.240  -0.370  -0.643
  306   2HG2  ILE  39          HG22      ILE  39  -8.484  -0.393  -0.485
  307   3HG2  ILE  39          HG23      ILE  39  -9.485   0.103   0.880
  308   1HD1  ILE  39          HD11      ILE  39 -12.502  -2.696   0.830
  309   2HD1  ILE  39          HD12      ILE  39 -11.819  -1.247   0.094
  310   3HD1  ILE  39          HD13      ILE  39 -12.481  -1.178   1.727
  311    H    ASP  40           HN       ASP  40  -9.793  -3.901  -3.033
  312    HA   ASP  40           HA       ASP  40  -7.085  -2.783  -3.692
  313   1HB   ASP  40          HB2       ASP  40  -7.132  -5.237  -3.271
  314   2HB   ASP  40          HB1       ASP  40  -8.353  -5.412  -4.537
  315    H    GLY  41           HN       GLY  41  -7.503  -1.140  -5.138
  316   1HA   GLY  41          HA2       GLY  41  -9.217  -1.787  -7.489
  317   2HA   GLY  41          HA1       GLY  41  -9.508  -0.287  -6.603
  318    H    GLU  42           HN       GLU  42  -7.739   1.302  -6.543
  319    HA   GLU  42           HA       GLU  42  -5.828   1.000  -8.840
  320   1HB   GLU  42          HB2       GLU  42  -7.925   2.952  -8.209
  321   2HB   GLU  42          HB1       GLU  42  -6.368   3.720  -8.511
  322   1HG   GLU  42          HG2       GLU  42  -6.923   3.545 -10.703
  323   2HG   GLU  42          HG1       GLU  42  -6.461   1.852 -10.528
  324    H    TRP  43           HN       TRP  43  -3.761   1.017  -8.069
  325    HA   TRP  43           HA       TRP  43  -3.168   2.377  -5.480
  326   1HB   TRP  43          HB2       TRP  43  -1.693   0.396  -7.242
  327   2HB   TRP  43          HB1       TRP  43  -0.975   1.126  -5.820
  328    HD1  TRP  43           HD1      TRP  43  -4.652  -0.038  -5.913
  329    HE1  TRP  43           HE1      TRP  43  -4.907  -1.979  -4.252
  330    HE3  TRP  43           HE3      TRP  43   0.205  -0.651  -4.566
  331    HZ2  TRP  43           HZ2      TRP  43  -3.267  -3.560  -2.534
  332    HZ3  TRP  43           HZ3      TRP  43   0.842  -2.372  -2.887
  333    HH2  TRP  43           HH2      TRP  43  -0.882  -3.820  -1.874
  334    H    THR  44           HN       THR  44  -1.234   3.767  -5.396
  335    HA   THR  44           HA       THR  44  -0.170   4.757  -7.980
  336    HB   THR  44           HB       THR  44  -0.753   7.081  -7.387
  337    HG1  THR  44           HG1      THR  44  -0.957   7.156  -5.256
  338   1HG2  THR  44          HG21      THR  44  -3.241   5.371  -7.212
  339   2HG2  THR  44          HG22      THR  44  -2.323   5.565  -8.705
  340   3HG2  THR  44          HG23      THR  44  -3.074   6.967  -7.944
  341    H    TYR  45           HN       TYR  45   1.979   5.137  -7.734
  342    HA   TYR  45           HA       TYR  45   3.140   5.072  -5.001
  343   1HB   TYR  45          HB2       TYR  45   3.940   3.594  -6.846
  344   2HB   TYR  45          HB1       TYR  45   4.402   5.024  -7.766
  345    HD1  TYR  45           HD1      TYR  45   6.697   5.373  -7.751
  346    HD2  TYR  45           HD2      TYR  45   4.775   3.960  -4.180
  347    HE1  TYR  45           HE1      TYR  45   8.866   5.446  -6.555
  348    HE2  TYR  45           HE2      TYR  45   6.945   4.033  -2.983
  349    HH   TYR  45           HH       TYR  45   9.602   5.677  -4.096
  350    H    ASP  46           HN       ASP  46   4.798   6.739  -4.430
  351    HA   ASP  46           HA       ASP  46   4.758   9.223  -6.075
  352   1HB   ASP  46          HB2       ASP  46   4.094   9.183  -3.111
  353   2HB   ASP  46          HB1       ASP  46   4.063  10.578  -4.183
  354    H    ASP  47           HN       ASP  47   6.903   9.616  -6.363
  355    HA   ASP  47           HA       ASP  47   9.011   8.655  -4.659
  356   1HB   ASP  47          HB2       ASP  47  10.388  10.192  -6.061
  357   2HB   ASP  47          HB1       ASP  47   9.285   9.222  -7.037
  358    H    ALA  48           HN       ALA  48   6.862  11.347  -4.362
  359    HA   ALA  48           HA       ALA  48   8.279  13.377  -3.085
  360   1HB   ALA  48          HB1       ALA  48   5.544  12.156  -2.772
  361   2HB   ALA  48          HB2       ALA  48   5.991  13.711  -3.483
  362   3HB   ALA  48          HB3       ALA  48   6.025  13.500  -1.732
  363    H    THR  49           HN       THR  49   6.697  10.641  -1.388
  364    HA   THR  49           HA       THR  49   8.838  10.766   0.694
  365    HB   THR  49           HB       THR  49   6.919  12.105   1.448
  366    HG1  THR  49           HG1      THR  49   7.940  10.864   3.014
  367   1HG2  THR  49          HG21      THR  49   4.887  10.209   1.854
  368   2HG2  THR  49          HG22      THR  49   5.430   9.947   0.197
  369   3HG2  THR  49          HG23      THR  49   4.871  11.542   0.700
  370    H    LYS  50           HN       LYS  50   8.562   8.868  -1.424
  371    HA   LYS  50           HA       LYS  50   8.211   6.577  -1.908
  372   1HB   LYS  50          HB2       LYS  50   9.449   5.203  -0.241
  373   2HB   LYS  50          HB1       LYS  50  10.309   6.677  -0.677
  374   1HG   LYS  50          HG2       LYS  50   9.665   7.749   1.380
  375   2HG   LYS  50          HG1       LYS  50   8.548   6.442   1.778
  376   1HD   LYS  50          HD2       LYS  50  11.440   5.797   1.311
  377   2HD   LYS  50          HD1       LYS  50  10.963   6.511   2.851
  378   1HE   LYS  50          HE2       LYS  50  10.413   4.410   3.516
  379   2HE   LYS  50          HE1       LYS  50   9.050   4.500   2.383
  380   1HZ   LYS  50          HZ1       LYS  50  10.514   2.616   1.885
  381   2HZ   LYS  50          HZ2       LYS  50  11.820   3.680   1.674
  382   3HZ   LYS  50          HZ3       LYS  50  10.494   3.738   0.614
  383    H    THR  51           HN       THR  51   5.733   7.353  -1.364
  384    HA   THR  51           HA       THR  51   4.669   5.363   0.617
  385    HB   THR  51           HB       THR  51   3.566   8.039  -0.316
  386    HG1  THR  51           HG1      THR  51   5.389   8.155   1.072
  387   1HG2  THR  51          HG21      THR  51   1.985   7.683   1.619
  388   2HG2  THR  51          HG22      THR  51   2.577   6.025   1.717
  389   3HG2  THR  51          HG23      THR  51   1.739   6.578   0.267
  390    H    TRP  52           HN       TRP  52   2.383   4.628  -0.019
  391    HA   TRP  52           HA       TRP  52   2.099   4.427  -3.004
  392   1HB   TRP  52          HB2       TRP  52   2.013   2.393  -0.789
  393   2HB   TRP  52          HB1       TRP  52   1.149   2.103  -2.290
  394    HD1  TRP  52           HD1      TRP  52   4.627   2.245  -0.829
  395    HE1  TRP  52           HE1      TRP  52   6.316   1.454  -2.617
  396    HE3  TRP  52           HE3      TRP  52   1.551   2.020  -4.848
  397    HZ2  TRP  52           HZ2      TRP  52   6.332   0.799  -5.418
  398    HZ3  TRP  52           HZ3      TRP  52   2.399   1.306  -7.074
  399    HH2  TRP  52           HH2      TRP  52   4.787   0.695  -7.360
  400    H    THR  53           HN       THR  53  -0.265   3.144  -3.204
  401    HA   THR  53           HA       THR  53  -2.270   4.294  -1.376
  402    HB   THR  53           HB       THR  53  -2.426   4.953  -4.317
  403    HG1  THR  53           HG1      THR  53  -0.559   5.926  -3.722
  404   1HG2  THR  53          HG21      THR  53  -3.614   6.980  -3.023
  405   2HG2  THR  53          HG22      THR  53  -3.820   5.723  -1.803
  406   3HG2  THR  53          HG23      THR  53  -4.471   5.492  -3.426
  407    H    VAL  54           HN       VAL  54  -4.527   3.617  -2.137
  408    HA   VAL  54           HA       VAL  54  -4.916   1.524  -4.077
  409    HB   VAL  54           HB       VAL  54  -3.585   0.117  -2.671
  410   1HG1  VAL  54          HG11      VAL  54  -3.370   1.472  -0.717
  411   2HG1  VAL  54          HG12      VAL  54  -4.060  -0.065  -0.198
  412   3HG1  VAL  54          HG13      VAL  54  -5.092   1.352  -0.370
  413   1HG2  VAL  54          HG21      VAL  54  -6.016  -0.702  -3.218
  414   2HG2  VAL  54          HG22      VAL  54  -6.282  -0.497  -1.487
  415   3HG2  VAL  54          HG23      VAL  54  -5.041  -1.615  -2.061
  416    H    THR  55           HN       THR  55  -6.831   2.661  -4.529
  417    HA   THR  55           HA       THR  55  -8.805   3.075  -2.334
  418    HB   THR  55           HB       THR  55  -9.010   3.929  -5.227
  419    HG1  THR  55           HG1      THR  55  -7.079   4.748  -4.669
  420   1HG2  THR  55          HG21      THR  55 -10.806   4.154  -3.252
  421   2HG2  THR  55          HG22      THR  55 -10.604   5.408  -4.477
  422   3HG2  THR  55          HG23      THR  55  -9.843   5.588  -2.895
  423    H    GLU  56           HN       GLU  56 -10.827   2.045  -2.365
  424    HA   GLU  56           HA       GLU  56 -11.056  -0.463  -3.814
  425   1HB   GLU  56          HB2       GLU  56 -11.953   0.191  -1.504
  426   2HB   GLU  56          HB1       GLU  56 -13.227   1.067  -2.355
  427   1HG   GLU  56          HG2       GLU  56 -12.727  -1.745  -3.203
  428   2HG   GLU  56          HG1       GLU  56 -13.501  -1.508  -1.636
  Start of MODEL   30
    1   1H    THR   1          HT1       THR   1  14.877   6.373   5.109
    2   2H    THR   1          HT2       THR   1  14.500   5.000   6.035
    3   3H    THR   1          HT3       THR   1  13.339   6.219   5.805
    4    HA   THR   1           HA       THR   1  13.303   5.726   3.406
    5    HB   THR   1           HB       THR   1  15.080   3.421   4.256
    6    HG1  THR   1           HG1      THR   1  15.772   5.826   2.922
    7   1HG2  THR   1          HG21      THR   1  14.619   4.530   1.488
    8   2HG2  THR   1          HG22      THR   1  13.561   3.301   2.180
    9   3HG2  THR   1          HG23      THR   1  15.274   2.957   1.942
   10    H    THR   2           HN       THR   2  11.174   5.500   4.561
   11    HA   THR   2           HA       THR   2  10.479   2.615   5.023
   12    HB   THR   2           HB       THR   2   9.339   5.086   6.370
   13    HG1  THR   2           HG1      THR   2  10.767   4.771   7.911
   14   1HG2  THR   2          HG21      THR   2   9.125   2.237   7.315
   15   2HG2  THR   2          HG22      THR   2   7.984   2.879   6.134
   16   3HG2  THR   2          HG23      THR   2   8.110   3.618   7.730
   17    H    PHE   3           HN       PHE   3   8.956   1.907   3.590
   18    HA   PHE   3           HA       PHE   3   7.644   3.716   1.723
   19   1HB   PHE   3          HB2       PHE   3   7.259   0.767   2.350
   20   2HB   PHE   3          HB1       PHE   3   6.648   1.588   0.914
   21    HD1  PHE   3           HD1      PHE   3   8.735   3.269  -0.038
   22    HD2  PHE   3           HD2      PHE   3   9.084  -0.591   1.820
   23    HE1  PHE   3           HE1      PHE   3  10.918   2.924  -1.162
   24    HE2  PHE   3           HE2      PHE   3  11.267  -0.933   0.695
   25    HZ   PHE   3           HZ       PHE   3  12.184   0.824  -0.795
   26    H    LYS   4           HN       LYS   4   5.241   3.809   1.491
   27    HA   LYS   4           HA       LYS   4   3.710   3.281   4.002
   28   1HB   LYS   4          HB2       LYS   4   4.736   5.621   3.890
   29   2HB   LYS   4          HB1       LYS   4   3.671   5.921   2.522
   30   1HG   LYS   4          HG2       LYS   4   1.707   5.420   3.904
   31   2HG   LYS   4          HG1       LYS   4   2.750   5.072   5.281
   32   1HD   LYS   4          HD2       LYS   4   3.132   7.275   5.717
   33   2HD   LYS   4          HD1       LYS   4   3.224   7.698   4.007
   34   1HE   LYS   4          HE2       LYS   4   1.032   8.309   3.940
   35   2HE   LYS   4          HE1       LYS   4   0.522   6.876   4.854
   36   1HZ   LYS   4          HZ1       LYS   4   0.270   9.025   6.079
   37   2HZ   LYS   4          HZ2       LYS   4   1.963   9.168   6.071
   38   3HZ   LYS   4          HZ3       LYS   4   1.221   7.870   6.877
   39    H    LEU   5           HN       LEU   5   1.391   3.260   3.640
   40    HA   LEU   5           HA       LEU   5   0.353   3.536   0.893
   41   1HB   LEU   5          HB2       LEU   5   1.433   1.155   1.459
   42   2HB   LEU   5          HB1       LEU   5  -0.122   0.901   2.239
   43    HG   LEU   5           HG       LEU   5  -0.419   2.127  -0.403
   44   1HD1  LEU   5          HD11      LEU   5   1.690   0.574  -0.567
   45   2HD1  LEU   5          HD12      LEU   5   0.426   0.453  -1.797
   46   3HD1  LEU   5          HD13      LEU   5   0.505  -0.735  -0.485
   47   1HD2  LEU   5          HD21      LEU   5  -1.450  -0.428   0.870
   48   2HD2  LEU   5          HD22      LEU   5  -2.035   0.251  -0.648
   49   3HD2  LEU   5          HD23      LEU   5  -2.268   1.134   0.861
   50    H    ILE   6           HN       ILE   6  -1.756   4.230   1.028
   51    HA   ILE   6           HA       ILE   6  -3.063   4.173   3.716
   52    HB   ILE   6           HB       ILE   6  -3.426   5.866   1.227
   53   1HG1  ILE   6          HG12      ILE   6  -1.332   6.265   2.483
   54   2HG1  ILE   6          HG11      ILE   6  -2.423   7.644   2.606
   55   1HG2  ILE   6          HG21      ILE   6  -4.673   7.255   3.196
   56   2HG2  ILE   6          HG22      ILE   6  -5.036   5.606   3.706
   57   3HG2  ILE   6          HG23      ILE   6  -5.518   6.160   2.102
   58   1HD1  ILE   6          HD11      ILE   6  -3.241   6.660   4.800
   59   2HD1  ILE   6          HD12      ILE   6  -1.571   7.227   4.817
   60   3HD1  ILE   6          HD13      ILE   6  -1.916   5.503   4.686
   61    H    ILE   7           HN       ILE   7  -4.982   3.086   3.981
   62    HA   ILE   7           HA       ILE   7  -5.983   1.412   1.771
   63    HB   ILE   7           HB       ILE   7  -6.831   1.759   4.669
   64   1HG1  ILE   7          HG12      ILE   7  -5.177  -0.462   3.442
   65   2HG1  ILE   7          HG11      ILE   7  -4.450   0.959   4.194
   66   1HG2  ILE   7          HG21      ILE   7  -7.474  -0.386   2.622
   67   2HG2  ILE   7          HG22      ILE   7  -8.614   0.759   3.329
   68   3HG2  ILE   7          HG23      ILE   7  -7.873  -0.484   4.337
   69   1HD1  ILE   7          HD11      ILE   7  -6.084   0.338   6.185
   70   2HD1  ILE   7          HD12      ILE   7  -4.530  -0.478   6.015
   71   3HD1  ILE   7          HD13      ILE   7  -6.006  -1.267   5.458
   72    H    ASN   8           HN       ASN   8  -7.434   2.315   0.366
   73    HA   ASN   8           HA       ASN   8  -9.352   4.370   1.406
   74   1HB   ASN   8          HB2       ASN   8  -7.946   3.847  -1.198
   75   2HB   ASN   8          HB1       ASN   8  -9.473   4.729  -1.214
   76   1HD2  ASN   8          HD21      ASN   8  -8.182   6.665  -1.912
   77   2HD2  ASN   8          HD22      ASN   8  -7.324   7.559  -0.740
   78    H    GLY   9           HN       GLY   9 -10.082   1.813   2.007
   79   1HA   GLY   9          HA2       GLY   9 -11.686   0.614  -0.124
   80   2HA   GLY   9          HA1       GLY   9 -11.623   0.073   1.557
   81    H    LYS  10           HN       LYS  10 -14.025   0.433  -0.029
   82    HA   LYS  10           HA       LYS  10 -15.435   2.828   0.392
   83   1HB   LYS  10          HB2       LYS  10 -16.315  -0.069   0.340
   84   2HB   LYS  10          HB1       LYS  10 -17.437   1.290   0.249
   85   1HG   LYS  10          HG2       LYS  10 -15.750   2.055  -1.682
   86   2HG   LYS  10          HG1       LYS  10 -15.472   0.316  -1.776
   87   1HD   LYS  10          HD2       LYS  10 -17.271   0.593  -3.244
   88   2HD   LYS  10          HD1       LYS  10 -18.091   0.168  -1.741
   89   1HE   LYS  10          HE2       LYS  10 -18.708   2.428  -1.309
   90   2HE   LYS  10          HE1       LYS  10 -17.559   3.050  -2.511
   91   1HZ   LYS  10          HZ1       LYS  10 -19.970   1.394  -3.032
   92   2HZ   LYS  10          HZ2       LYS  10 -18.795   1.752  -4.206
   93   3HZ   LYS  10          HZ3       LYS  10 -19.715   3.000  -3.513
   94    H    THR  11           HN       THR  11 -14.710   0.231   2.646
   95    HA   THR  11           HA       THR  11 -16.133   1.760   4.803
   96    HB   THR  11           HB       THR  11 -15.854  -1.249   4.522
   97    HG1  THR  11           HG1      THR  11 -17.306  -0.870   3.032
   98   1HG2  THR  11          HG21      THR  11 -17.859  -1.025   6.180
   99   2HG2  THR  11          HG22      THR  11 -17.232   0.601   6.452
  100   3HG2  THR  11          HG23      THR  11 -16.220  -0.803   6.792
  101    H    LEU  12           HN       LEU  12 -13.534  -0.568   4.043
  102    HA   LEU  12           HA       LEU  12 -12.239  -0.144   6.662
  103   1HB   LEU  12          HB2       LEU  12 -11.521  -1.729   4.174
  104   2HB   LEU  12          HB1       LEU  12 -10.641  -1.813   5.700
  105    HG   LEU  12           HG       LEU  12 -13.595  -2.217   5.800
  106   1HD1  LEU  12          HD11      LEU  12 -12.714  -3.559   3.829
  107   2HD1  LEU  12          HD12      LEU  12 -13.461  -4.514   5.110
  108   3HD1  LEU  12          HD13      LEU  12 -11.704  -4.435   4.979
  109   1HD2  LEU  12          HD21      LEU  12 -11.869  -2.227   7.744
  110   2HD2  LEU  12          HD22      LEU  12 -11.405  -3.813   7.127
  111   3HD2  LEU  12          HD23      LEU  12 -13.054  -3.532   7.686
  112    H    LYS  13           HN       LYS  13 -10.445   1.158   6.987
  113    HA   LYS  13           HA       LYS  13  -8.943   2.236   4.666
  114   1HB   LYS  13          HB2       LYS  13 -10.953   3.655   6.304
  115   2HB   LYS  13          HB1       LYS  13  -9.429   4.522   6.112
  116   1HG   LYS  13          HG2       LYS  13  -9.730   4.833   3.864
  117   2HG   LYS  13          HG1       LYS  13 -10.533   3.277   3.652
  118   1HD   LYS  13          HD2       LYS  13 -12.385   4.604   3.406
  119   2HD   LYS  13          HD1       LYS  13 -12.386   4.527   5.169
  120   1HE   LYS  13          HE2       LYS  13 -10.650   6.637   4.006
  121   2HE   LYS  13          HE1       LYS  13 -12.397   6.878   3.801
  122   1HZ   LYS  13          HZ1       LYS  13 -12.737   6.525   6.128
  123   2HZ   LYS  13          HZ2       LYS  13 -11.538   7.717   5.956
  124   3HZ   LYS  13          HZ3       LYS  13 -11.107   6.126   6.369
  125    H    GLY  14           HN       GLY  14  -7.315   4.009   5.797
  126   1HA   GLY  14          HA2       GLY  14  -6.222   4.284   8.126
  127   2HA   GLY  14          HA1       GLY  14  -6.052   2.530   8.060
  128    H    GLU  15           HN       GLU  15  -3.698   3.495   8.342
  129    HA   GLU  15           HA       GLU  15  -2.504   3.752   5.599
  130   1HB   GLU  15          HB2       GLU  15  -0.819   5.230   6.700
  131   2HB   GLU  15          HB1       GLU  15  -2.455   5.873   6.830
  132   1HG   GLU  15          HG2       GLU  15  -2.548   5.552   9.097
  133   2HG   GLU  15          HG1       GLU  15  -1.581   4.080   9.035
  134    H    THR  16           HN       THR  16  -0.189   2.975   5.545
  135    HA   THR  16           HA       THR  16   0.717   1.206   7.712
  136    HB   THR  16           HB       THR  16  -1.004  -0.147   6.595
  137    HG1  THR  16           HG1      THR  16   0.293  -1.756   6.825
  138   1HG2  THR  16          HG21      THR  16  -1.169   0.764   4.417
  139   2HG2  THR  16          HG22      THR  16  -0.471  -0.834   4.165
  140   3HG2  THR  16          HG23      THR  16   0.562   0.596   4.118
  141    H    THR  17           HN       THR  17   2.919   0.616   7.447
  142    HA   THR  17           HA       THR  17   4.287   1.594   4.966
  143    HB   THR  17           HB       THR  17   6.069   2.455   6.528
  144    HG1  THR  17           HG1      THR  17   5.484   1.179   8.318
  145   1HG2  THR  17          HG21      THR  17   4.645   4.392   7.375
  146   2HG2  THR  17          HG22      THR  17   3.253   3.537   6.713
  147   3HG2  THR  17          HG23      THR  17   4.549   4.071   5.644
  148    H    THR  18           HN       THR  18   6.368   0.509   4.593
  149    HA   THR  18           HA       THR  18   6.888  -1.899   6.247
  150    HB   THR  18           HB       THR  18   5.595  -1.765   3.627
  151    HG1  THR  18           HG1      THR  18   4.834  -3.091   5.185
  152   1HG2  THR  18          HG21      THR  18   7.911  -2.087   2.776
  153   2HG2  THR  18          HG22      THR  18   6.869  -3.474   2.452
  154   3HG2  THR  18          HG23      THR  18   8.052  -3.545   3.759
  155    H    GLU  19           HN       GLU  19   9.072  -2.779   5.810
  156    HA   GLU  19           HA       GLU  19  10.943  -0.726   4.668
  157   1HB   GLU  19          HB2       GLU  19  10.880  -1.161   7.192
  158   2HB   GLU  19          HB1       GLU  19  11.511  -2.768   6.833
  159   1HG   GLU  19          HG2       GLU  19  13.249  -1.299   5.392
  160   2HG   GLU  19          HG1       GLU  19  12.855  -0.120   6.643
  161    H    ALA  20           HN       ALA  20  11.786  -1.500   2.767
  162    HA   ALA  20           HA       ALA  20  12.740  -4.314   2.649
  163   1HB   ALA  20          HB1       ALA  20  10.727  -4.809   1.682
  164   2HB   ALA  20          HB2       ALA  20  11.461  -4.091   0.248
  165   3HB   ALA  20          HB3       ALA  20  10.401  -3.123   1.275
  166    H    VAL  21           HN       VAL  21  13.647  -4.585   0.219
  167    HA   VAL  21           HA       VAL  21  15.891  -2.842  -0.071
  168    HB   VAL  21           HB       VAL  21  15.685  -5.168  -0.929
  169   1HG1  VAL  21          HG11      VAL  21  14.338  -5.756  -2.786
  170   2HG1  VAL  21          HG12      VAL  21  13.990  -4.068  -3.160
  171   3HG1  VAL  21          HG13      VAL  21  13.281  -4.817  -1.730
  172   1HG2  VAL  21          HG21      VAL  21  17.449  -3.966  -1.942
  173   2HG2  VAL  21          HG22      VAL  21  16.335  -2.953  -2.861
  174   3HG2  VAL  21          HG23      VAL  21  16.557  -4.646  -3.303
  175    H    ASP  22           HN       ASP  22  12.736  -2.903  -1.637
  176    HA   ASP  22           HA       ASP  22  13.066  -0.102  -2.541
  177   1HB   ASP  22          HB2       ASP  22  12.629  -2.543  -4.285
  178   2HB   ASP  22          HB1       ASP  22  12.477  -0.880  -4.875
  179    H    ALA  23           HN       ALA  23  10.961   0.779  -3.286
  180    HA   ALA  23           HA       ALA  23   8.746   0.034  -1.644
  181   1HB   ALA  23          HB1       ALA  23   9.258   1.785  -4.017
  182   2HB   ALA  23          HB2       ALA  23   8.665   2.222  -2.415
  183   3HB   ALA  23          HB3       ALA  23   7.579   1.467  -3.582
  184    H    ALA  24           HN       ALA  24   9.629  -0.884  -4.954
  185    HA   ALA  24           HA       ALA  24   7.211  -2.089  -5.818
  186   1HB   ALA  24          HB1       ALA  24  10.145  -2.463  -6.332
  187   2HB   ALA  24          HB2       ALA  24   8.886  -1.897  -7.430
  188   3HB   ALA  24          HB3       ALA  24   9.009  -3.613  -7.038
  189    H    THR  25           HN       THR  25   9.935  -3.546  -4.017
  190    HA   THR  25           HA       THR  25   8.807  -6.173  -3.762
  191    HB   THR  25           HB       THR  25  10.838  -4.552  -2.188
  192    HG1  THR  25           HG1      THR  25  12.225  -6.076  -3.277
  193   1HG2  THR  25          HG21      THR  25   9.839  -6.286  -0.710
  194   2HG2  THR  25          HG22      THR  25  11.528  -6.636  -1.094
  195   3HG2  THR  25          HG23      THR  25  10.237  -7.515  -1.915
  196    H    ALA  26           HN       ALA  26   8.743  -3.323  -1.606
  197    HA   ALA  26           HA       ALA  26   7.315  -4.502   0.544
  198   1HB   ALA  26          HB1       ALA  26   6.688  -2.072   0.998
  199   2HB   ALA  26          HB2       ALA  26   7.461  -1.674  -0.541
  200   3HB   ALA  26          HB3       ALA  26   8.415  -2.369   0.770
  201    H    GLU  27           HN       GLU  27   5.948  -2.329  -1.976
  202    HA   GLU  27           HA       GLU  27   3.268  -2.503  -1.394
  203   1HB   GLU  27          HB2       GLU  27   2.892  -2.018  -3.778
  204   2HB   GLU  27          HB1       GLU  27   4.289  -1.135  -3.170
  205   1HG   GLU  27          HG2       GLU  27   5.765  -2.316  -4.460
  206   2HG   GLU  27          HG1       GLU  27   4.856  -3.814  -4.323
  207    H    LYS  28           HN       LYS  28   5.171  -5.127  -2.785
  208    HA   LYS  28           HA       LYS  28   2.927  -6.725  -3.703
  209   1HB   LYS  28          HB2       LYS  28   5.729  -7.468  -2.768
  210   2HB   LYS  28          HB1       LYS  28   4.653  -8.524  -3.683
  211   1HG   LYS  28          HG2       LYS  28   4.831  -7.241  -5.631
  212   2HG   LYS  28          HG1       LYS  28   5.325  -5.795  -4.749
  213   1HD   LYS  28          HD2       LYS  28   7.407  -6.391  -5.480
  214   2HD   LYS  28          HD1       LYS  28   7.355  -7.467  -4.084
  215   1HE   LYS  28          HE2       LYS  28   7.943  -8.938  -5.833
  216   2HE   LYS  28          HE1       LYS  28   6.180  -9.130  -5.766
  217   1HZ   LYS  28          HZ1       LYS  28   7.016  -8.643  -8.031
  218   2HZ   LYS  28          HZ2       LYS  28   7.586  -7.144  -7.471
  219   3HZ   LYS  28          HZ3       LYS  28   5.921  -7.480  -7.463
  220    H    VAL  29           HN       VAL  29   4.842  -6.557  -0.710
  221    HA   VAL  29           HA       VAL  29   3.345  -8.605   0.719
  222    HB   VAL  29           HB       VAL  29   5.277  -6.366   1.399
  223   1HG1  VAL  29          HG11      VAL  29   4.040  -8.294   3.395
  224   2HG1  VAL  29          HG12      VAL  29   3.711  -6.559   3.319
  225   3HG1  VAL  29          HG13      VAL  29   5.328  -7.136   3.734
  226   1HG2  VAL  29          HG21      VAL  29   5.958  -8.586   0.322
  227   2HG2  VAL  29          HG22      VAL  29   5.526  -9.343   1.856
  228   3HG2  VAL  29          HG23      VAL  29   6.815  -8.141   1.798
  229    H    LEU  30           HN       LEU  30   3.107  -5.072   0.360
  230    HA   LEU  30           HA       LEU  30   1.109  -4.672   2.383
  231   1HB   LEU  30          HB2       LEU  30   1.982  -3.202  -0.114
  232   2HB   LEU  30          HB1       LEU  30   0.700  -2.573   0.904
  233    HG   LEU  30           HG       LEU  30   3.203  -1.787   1.252
  234   1HD1  LEU  30          HD11      LEU  30   1.299  -2.504   3.480
  235   2HD1  LEU  30          HD12      LEU  30   1.442  -0.959   2.639
  236   3HD1  LEU  30          HD13      LEU  30   2.743  -1.509   3.704
  237   1HD2  LEU  30          HD21      LEU  30   3.140  -4.390   2.792
  238   2HD2  LEU  30          HD22      LEU  30   4.227  -3.070   3.172
  239   3HD2  LEU  30          HD23      LEU  30   4.325  -3.851   1.607
  240    H    LYS  31           HN       LYS  31   1.024  -5.637  -1.006
  241    HA   LYS  31           HA       LYS  31  -1.801  -5.404  -1.509
  242   1HB   LYS  31          HB2       LYS  31   0.336  -6.047  -2.991
  243   2HB   LYS  31          HB1       LYS  31  -0.115  -7.672  -2.534
  244   1HG   LYS  31          HG2       LYS  31  -2.140  -5.747  -3.678
  245   2HG   LYS  31          HG1       LYS  31  -1.131  -6.751  -4.719
  246   1HD   LYS  31          HD2       LYS  31  -3.011  -7.757  -2.556
  247   2HD   LYS  31          HD1       LYS  31  -3.280  -7.866  -4.294
  248   1HE   LYS  31          HE2       LYS  31  -0.716  -8.979  -3.864
  249   2HE   LYS  31          HE1       LYS  31  -1.759  -9.652  -2.589
  250   1HZ   LYS  31          HZ1       LYS  31  -3.413 -10.200  -4.254
  251   2HZ   LYS  31          HZ2       LYS  31  -1.933 -10.926  -4.666
  252   3HZ   LYS  31          HZ3       LYS  31  -2.453  -9.530  -5.482
  253    H    GLN  32           HN       GLN  32   0.246  -8.010  -0.243
  254    HA   GLN  32           HA       GLN  32  -1.693 -10.035   0.156
  255   1HB   GLN  32          HB2       GLN  32   0.953  -9.256   1.230
  256   2HB   GLN  32          HB1       GLN  32   0.009 -10.360   2.231
  257   1HG   GLN  32          HG2       GLN  32  -0.370 -11.674   0.015
  258   2HG   GLN  32          HG1       GLN  32   1.024 -10.766  -0.570
  259   1HE2  GLN  32          HE21      GLN  32   0.093 -13.538   1.213
  260   2HE2  GLN  32          HE22      GLN  32   1.619 -13.905   1.882
  261    H    TYR  33           HN       TYR  33  -0.779  -7.269   2.195
  262    HA   TYR  33           HA       TYR  33  -2.499  -7.887   4.445
  263   1HB   TYR  33          HB2       TYR  33  -0.616  -6.325   4.572
  264   2HB   TYR  33          HB1       TYR  33  -1.341  -5.300   3.335
  265    HD1  TYR  33           HD1      TYR  33  -1.795  -6.639   6.756
  266    HD2  TYR  33           HD2      TYR  33  -3.000  -3.685   3.887
  267    HE1  TYR  33           HE1      TYR  33  -3.079  -5.471   8.509
  268    HE2  TYR  33           HE2      TYR  33  -4.284  -2.503   5.646
  269    HH   TYR  33           HH       TYR  33  -5.408  -3.252   7.920
  270    H    ILE  34           HN       ILE  34  -2.860  -5.952   1.488
  271    HA   ILE  34           HA       ILE  34  -5.522  -4.970   1.971
  272    HB   ILE  34           HB       ILE  34  -3.972  -5.585  -0.567
  273   1HG1  ILE  34          HG12      ILE  34  -3.000  -3.985   1.212
  274   2HG1  ILE  34          HG11      ILE  34  -3.095  -3.388  -0.441
  275   1HG2  ILE  34          HG21      ILE  34  -6.371  -5.335  -1.040
  276   2HG2  ILE  34          HG22      ILE  34  -5.467  -3.957  -1.667
  277   3HG2  ILE  34          HG23      ILE  34  -6.390  -3.798  -0.173
  278   1HD1  ILE  34          HD11      ILE  34  -3.968  -1.953   1.645
  279   2HD1  ILE  34          HD12      ILE  34  -5.434  -2.888   1.349
  280   3HD1  ILE  34          HD13      ILE  34  -4.761  -1.878   0.071
  281    H    ASN  35           HN       ASN  35  -4.232  -7.993   0.702
  282    HA   ASN  35           HA       ASN  35  -6.546  -9.076  -0.549
  283   1HB   ASN  35          HB2       ASN  35  -4.139  -9.903  -0.535
  284   2HB   ASN  35          HB1       ASN  35  -4.459 -10.571   1.065
  285   1HD2  ASN  35          HD21      ASN  35  -4.316 -12.805   0.371
  286   2HD2  ASN  35          HD22      ASN  35  -5.480 -13.506  -0.647
  287    H    ASP  36           HN       ASP  36  -5.673  -8.782   2.847
  288    HA   ASP  36           HA       ASP  36  -7.716 -10.639   3.819
  289   1HB   ASP  36          HB2       ASP  36  -5.766  -8.654   4.969
  290   2HB   ASP  36          HB1       ASP  36  -7.011  -9.356   6.003
  291    H    ASN  37           HN       ASN  37  -7.315  -7.077   3.902
  292    HA   ASN  37           HA       ASN  37  -9.880  -6.485   5.033
  293   1HB   ASN  37          HB2       ASN  37  -8.067  -4.893   3.184
  294   2HB   ASN  37          HB1       ASN  37  -9.377  -4.209   4.153
  295   1HD2  ASN  37          HD21      ASN  37  -8.618  -3.305   6.060
  296   2HD2  ASN  37          HD22      ASN  37  -7.283  -3.876   6.956
  297    H    GLY  38           HN       GLY  38  -8.816  -7.044   1.710
  298   1HA   GLY  38          HA2       GLY  38 -10.194  -7.708  -0.116
  299   2HA   GLY  38          HA1       GLY  38 -11.618  -7.340   0.858
  300    H    ILE  39           HN       ILE  39  -8.959  -5.077   0.458
  301    HA   ILE  39           HA       ILE  39 -10.799  -3.302  -1.114
  302    HB   ILE  39           HB       ILE  39  -8.555  -2.650   0.829
  303   1HG1  ILE  39          HG12      ILE  39 -10.535  -3.606   1.949
  304   2HG1  ILE  39          HG11      ILE  39 -10.386  -1.886   2.314
  305   1HG2  ILE  39          HG21      ILE  39 -10.503  -0.898  -0.693
  306   2HG2  ILE  39          HG22      ILE  39  -8.743  -0.885  -0.803
  307   3HG2  ILE  39          HG23      ILE  39  -9.538  -0.328   0.669
  308   1HD1  ILE  39          HD11      ILE  39 -11.991  -1.488   0.351
  309   2HD1  ILE  39          HD12      ILE  39 -12.689  -2.220   1.795
  310   3HD1  ILE  39          HD13      ILE  39 -12.306  -3.222   0.395
  311    H    ASP  40           HN       ASP  40  -9.795  -4.557  -3.009
  312    HA   ASP  40           HA       ASP  40  -7.116  -3.410  -3.736
  313   1HB   ASP  40          HB2       ASP  40  -8.383  -6.092  -3.928
  314   2HB   ASP  40          HB1       ASP  40  -7.423  -5.597  -5.327
  315    H    GLY  41           HN       GLY  41  -7.859  -1.592  -4.906
  316   1HA   GLY  41          HA2       GLY  41  -9.500  -2.220  -7.328
  317   2HA   GLY  41          HA1       GLY  41  -9.765  -0.746  -6.392
  318    H    GLU  42           HN       GLU  42  -8.084   0.889  -6.409
  319    HA   GLU  42           HA       GLU  42  -6.092   0.582  -8.632
  320   1HB   GLU  42          HB2       GLU  42  -8.353   2.409  -8.255
  321   2HB   GLU  42          HB1       GLU  42  -6.842   3.274  -8.536
  322   1HG   GLU  42          HG2       GLU  42  -6.621   2.481 -10.674
  323   2HG   GLU  42          HG1       GLU  42  -7.365   0.929 -10.288
  324    H    TRP  43           HN       TRP  43  -4.064   0.868  -7.834
  325    HA   TRP  43           HA       TRP  43  -3.675   2.363  -5.283
  326   1HB   TRP  43          HB2       TRP  43  -1.951   0.528  -6.976
  327   2HB   TRP  43          HB1       TRP  43  -1.361   1.342  -5.539
  328    HD1  TRP  43           HD1      TRP  43  -4.912  -0.128  -5.600
  329    HE1  TRP  43           HE1      TRP  43  -4.980  -2.127  -3.992
  330    HE3  TRP  43           HE3      TRP  43   0.021  -0.437  -4.393
  331    HZ2  TRP  43           HZ2      TRP  43  -3.189  -3.634  -2.364
  332    HZ3  TRP  43           HZ3      TRP  43   0.814  -2.154  -2.784
  333    HH2  TRP  43           HH2      TRP  43  -0.778  -3.744  -1.773
  334    H    THR  44           HN       THR  44  -1.753   3.845  -5.221
  335    HA   THR  44           HA       THR  44  -0.846   4.940  -7.820
  336    HB   THR  44           HB       THR  44  -1.546   7.214  -7.195
  337    HG1  THR  44           HG1      THR  44  -2.947   7.402  -5.360
  338   1HG2  THR  44          HG21      THR  44  -3.104   5.575  -8.408
  339   2HG2  THR  44          HG22      THR  44  -3.862   6.982  -7.663
  340   3HG2  THR  44          HG23      THR  44  -3.945   5.411  -6.867
  341    H    TYR  45           HN       TYR  45   1.288   5.442  -7.632
  342    HA   TYR  45           HA       TYR  45   2.535   5.356  -4.940
  343   1HB   TYR  45          HB2       TYR  45   3.383   3.973  -6.804
  344   2HB   TYR  45          HB1       TYR  45   3.662   5.426  -7.763
  345    HD1  TYR  45           HD1      TYR  45   4.369   4.408  -4.214
  346    HD2  TYR  45           HD2      TYR  45   5.908   5.997  -7.895
  347    HE1  TYR  45           HE1      TYR  45   6.600   4.678  -3.165
  348    HE2  TYR  45           HE2      TYR  45   8.138   6.268  -6.846
  349    HH   TYR  45           HH       TYR  45   9.374   5.077  -4.823
  350    H    ASP  46           HN       ASP  46   4.164   7.052  -4.389
  351    HA   ASP  46           HA       ASP  46   3.822   9.649  -5.832
  352   1HB   ASP  46          HB2       ASP  46   3.651   9.274  -2.819
  353   2HB   ASP  46          HB1       ASP  46   3.438  10.783  -3.700
  354    H    ASP  47           HN       ASP  47   5.813  10.507  -6.227
  355    HA   ASP  47           HA       ASP  47   8.239   9.322  -5.159
  356   1HB   ASP  47          HB2       ASP  47   7.970  10.319  -7.421
  357   2HB   ASP  47          HB1       ASP  47   7.759  11.906  -6.678
  358    H    ALA  48           HN       ALA  48   6.076  11.589  -3.822
  359    HA   ALA  48           HA       ALA  48   7.691  13.545  -2.586
  360   1HB   ALA  48          HB1       ALA  48   5.789  13.176  -0.751
  361   2HB   ALA  48          HB2       ALA  48   5.115  12.126  -2.000
  362   3HB   ALA  48          HB3       ALA  48   5.396  13.836  -2.339
  363    H    THR  49           HN       THR  49   6.414  10.732  -0.805
  364    HA   THR  49           HA       THR  49   9.077  10.418   0.538
  365    HB   THR  49           HB       THR  49   7.521  11.691   1.959
  366    HG1  THR  49           HG1      THR  49   7.913  10.495   3.678
  367   1HG2  THR  49          HG21      THR  49   5.570   9.694   2.561
  368   2HG2  THR  49          HG22      THR  49   5.595   9.911   0.810
  369   3HG2  THR  49          HG23      THR  49   5.310  11.294   1.868
  370    H    LYS  50           HN       LYS  50   7.894   8.915  -1.678
  371    HA   LYS  50           HA       LYS  50   7.543   6.691  -2.348
  372   1HB   LYS  50          HB2       LYS  50   8.836   6.198   0.355
  373   2HB   LYS  50          HB1       LYS  50   8.730   5.031  -0.961
  374   1HG   LYS  50          HG2       LYS  50  10.162   6.330  -2.363
  375   2HG   LYS  50          HG1       LYS  50  10.053   7.729  -1.295
  376   1HD   LYS  50          HD2       LYS  50  11.571   6.882   0.198
  377   2HD   LYS  50          HD1       LYS  50  11.054   5.216  -0.065
  378   1HE   LYS  50          HE2       LYS  50  12.539   4.892  -1.789
  379   2HE   LYS  50          HE1       LYS  50  12.368   6.557  -2.379
  380   1HZ   LYS  50          HZ1       LYS  50  13.709   5.815   0.166
  381   2HZ   LYS  50          HZ2       LYS  50  13.636   7.361  -0.534
  382   3HZ   LYS  50          HZ3       LYS  50  14.534   6.128  -1.282
  383    H    THR  51           HN       THR  51   5.234   7.823  -1.341
  384    HA   THR  51           HA       THR  51   4.079   5.873   0.598
  385    HB   THR  51           HB       THR  51   3.064   8.474  -0.609
  386    HG1  THR  51           HG1      THR  51   4.138   7.799   1.924
  387   1HG2  THR  51          HG21      THR  51   1.893   6.542   1.383
  388   2HG2  THR  51          HG22      THR  51   1.111   7.318   0.005
  389   3HG2  THR  51          HG23      THR  51   1.485   8.257   1.451
  390    H    TRP  52           HN       TRP  52   1.791   5.107   0.001
  391    HA   TRP  52           HA       TRP  52   1.482   4.700  -2.954
  392   1HB   TRP  52          HB2       TRP  52   1.554   2.739  -0.667
  393   2HB   TRP  52          HB1       TRP  52   0.744   2.344  -2.175
  394    HD1  TRP  52           HD1      TRP  52   4.178   2.796  -0.661
  395    HE1  TRP  52           HE1      TRP  52   5.955   2.091  -2.398
  396    HE3  TRP  52           HE3      TRP  52   1.200   2.211  -4.716
  397    HZ2  TRP  52           HZ2      TRP  52   6.074   1.363  -5.175
  398    HZ3  TRP  52           HZ3      TRP  52   2.143   1.508  -6.909
  399    HH2  TRP  52           HH2      TRP  52   4.578   1.082  -7.138
  400    H    THR  53           HN       THR  53  -0.790   3.268  -3.036
  401    HA   THR  53           HA       THR  53  -2.826   4.314  -1.185
  402    HB   THR  53           HB       THR  53  -3.001   4.966  -4.135
  403    HG1  THR  53           HG1      THR  53  -1.447   6.312  -3.672
  404   1HG2  THR  53          HG21      THR  53  -4.483   6.818  -2.966
  405   2HG2  THR  53          HG22      THR  53  -4.538   5.639  -1.656
  406   3HG2  THR  53          HG23      THR  53  -5.133   5.205  -3.259
  407    H    VAL  54           HN       VAL  54  -5.072   3.497  -1.979
  408    HA   VAL  54           HA       VAL  54  -5.197   1.279  -3.848
  409    HB   VAL  54           HB       VAL  54  -3.885   0.166  -2.138
  410   1HG1  VAL  54          HG11      VAL  54  -5.266   0.045   0.198
  411   2HG1  VAL  54          HG12      VAL  54  -5.686   1.669  -0.344
  412   3HG1  VAL  54          HG13      VAL  54  -3.996   1.221  -0.132
  413   1HG2  VAL  54          HG21      VAL  54  -6.580  -0.823  -1.323
  414   2HG2  VAL  54          HG22      VAL  54  -5.169  -1.729  -1.879
  415   3HG2  VAL  54          HG23      VAL  54  -6.191  -0.877  -3.043
  416    H    THR  55           HN       THR  55  -7.022   2.733  -4.387
  417    HA   THR  55           HA       THR  55  -9.261   2.909  -2.461
  418    HB   THR  55           HB       THR  55  -9.169   3.794  -5.352
  419    HG1  THR  55           HG1      THR  55  -8.302   5.753  -4.481
  420   1HG2  THR  55          HG21      THR  55 -10.722   4.507  -2.884
  421   2HG2  THR  55          HG22      THR  55 -11.309   4.195  -4.517
  422   3HG2  THR  55          HG23      THR  55 -10.496   5.716  -4.148
  423    H    GLU  56           HN       GLU  56 -11.077   1.613  -2.567
  424    HA   GLU  56           HA       GLU  56 -11.099  -0.814  -4.094
  425   1HB   GLU  56          HB2       GLU  56 -12.411   0.207  -1.933
  426   2HB   GLU  56          HB1       GLU  56 -13.674   0.329  -3.158
  427   1HG   GLU  56          HG2       GLU  56 -13.063  -2.115  -3.749
  428   2HG   GLU  56          HG1       GLU  56 -12.231  -2.138  -2.193
  Start of MODEL   31
    1   1H    THR   1          HT1       THR   1  14.940   2.777   3.298
    2   2H    THR   1          HT2       THR   1  15.573   4.313   2.942
    3   3H    THR   1          HT3       THR   1  14.366   3.639   1.955
    4    HA   THR   1           HA       THR   1  14.074   4.619   4.745
    5    HB   THR   1           HB       THR   1  12.402   6.067   3.522
    6    HG1  THR   1           HG1      THR   1  11.927   5.255   1.642
    7   1HG2  THR   1          HG21      THR   1  14.057   7.563   2.639
    8   2HG2  THR   1          HG22      THR   1  15.182   6.238   2.342
    9   3HG2  THR   1          HG23      THR   1  14.807   6.723   3.996
   10    H    THR   2           HN       THR   2  11.708   4.508   5.408
   11    HA   THR   2           HA       THR   2  10.686   1.784   5.008
   12    HB   THR   2           HB       THR   2   9.434   4.097   6.510
   13    HG1  THR   2           HG1      THR   2  11.541   2.358   7.260
   14   1HG2  THR   2          HG21      THR   2   8.129   1.995   6.269
   15   2HG2  THR   2          HG22      THR   2   8.575   2.314   7.945
   16   3HG2  THR   2          HG23      THR   2   9.460   1.108   7.011
   17    H    PHE   3           HN       PHE   3   9.099   1.241   3.564
   18    HA   PHE   3           HA       PHE   3   8.016   3.179   1.700
   19   1HB   PHE   3          HB2       PHE   3   7.277   0.300   2.333
   20   2HB   PHE   3          HB1       PHE   3   6.776   1.178   0.888
   21    HD1  PHE   3           HD1      PHE   3   9.063   2.618  -0.031
   22    HD2  PHE   3           HD2      PHE   3   8.930  -1.269   1.806
   23    HE1  PHE   3           HE1      PHE   3  11.203   2.022  -1.131
   24    HE2  PHE   3           HE2      PHE   3  11.070  -1.859   0.703
   25    HZ   PHE   3           HZ       PHE   3  12.207  -0.214  -0.763
   26    H    LYS   4           HN       LYS   4   5.508   3.211   1.362
   27    HA   LYS   4           HA       LYS   4   3.983   3.106   3.916
   28   1HB   LYS   4          HB2       LYS   4   5.243   5.356   3.432
   29   2HB   LYS   4          HB1       LYS   4   3.973   5.604   2.236
   30   1HG   LYS   4          HG2       LYS   4   2.306   5.104   4.111
   31   2HG   LYS   4          HG1       LYS   4   3.666   5.258   5.220
   32   1HD   LYS   4          HD2       LYS   4   3.177   7.469   5.237
   33   2HD   LYS   4          HD1       LYS   4   3.955   7.505   3.655
   34   1HE   LYS   4          HE2       LYS   4   1.604   6.829   2.737
   35   2HE   LYS   4          HE1       LYS   4   1.010   7.414   4.303
   36   1HZ   LYS   4          HZ1       LYS   4   1.182   9.170   2.554
   37   2HZ   LYS   4          HZ2       LYS   4   2.867   8.954   2.572
   38   3HZ   LYS   4          HZ3       LYS   4   2.063   9.502   3.965
   39    H    LEU   5           HN       LEU   5   1.680   3.151   3.568
   40    HA   LEU   5           HA       LEU   5   0.634   3.296   0.808
   41   1HB   LEU   5          HB2       LEU   5   1.559   0.897   1.592
   42   2HB   LEU   5          HB1       LEU   5  -0.025   0.816   2.351
   43    HG   LEU   5           HG       LEU   5  -0.218   1.836  -0.377
   44   1HD1  LEU   5          HD11      LEU   5   0.569   0.023  -1.635
   45   2HD1  LEU   5          HD12      LEU   5   0.609  -1.056  -0.231
   46   3HD1  LEU   5          HD13      LEU   5   1.833   0.208  -0.411
   47   1HD2  LEU   5          HD21      LEU   5  -1.380  -0.517   1.141
   48   2HD2  LEU   5          HD22      LEU   5  -1.851  -0.092  -0.505
   49   3HD2  LEU   5          HD23      LEU   5  -2.155   1.035   0.817
   50    H    ILE   6           HN       ILE   6  -1.480   4.034   0.864
   51    HA   ILE   6           HA       ILE   6  -2.749   4.322   3.560
   52    HB   ILE   6           HB       ILE   6  -3.026   5.815   0.935
   53   1HG1  ILE   6          HG12      ILE   6  -0.905   6.167   2.187
   54   2HG1  ILE   6          HG11      ILE   6  -1.890   7.629   2.128
   55   1HG2  ILE   6          HG21      ILE   6  -5.163   5.793   2.193
   56   2HG2  ILE   6          HG22      ILE   6  -4.444   7.403   2.165
   57   3HG2  ILE   6          HG23      ILE   6  -4.320   6.407   3.616
   58   1HD1  ILE   6          HD11      ILE   6  -1.063   7.363   4.390
   59   2HD1  ILE   6          HD12      ILE   6  -1.634   5.697   4.447
   60   3HD1  ILE   6          HD13      ILE   6  -2.793   7.022   4.397
   61    H    ILE   7           HN       ILE   7  -4.791   3.480   3.900
   62    HA   ILE   7           HA       ILE   7  -5.876   1.644   1.849
   63    HB   ILE   7           HB       ILE   7  -6.643   2.259   4.724
   64   1HG1  ILE   7          HG12      ILE   7  -5.119  -0.109   3.600
   65   2HG1  ILE   7          HG11      ILE   7  -4.337   1.296   4.325
   66   1HG2  ILE   7          HG21      ILE   7  -7.940   0.206   4.639
   67   2HG2  ILE   7          HG22      ILE   7  -7.400  -0.112   2.990
   68   3HG2  ILE   7          HG23      ILE   7  -8.469   1.252   3.321
   69   1HD1  ILE   7          HD11      ILE   7  -4.503  -0.098   6.176
   70   2HD1  ILE   7          HD12      ILE   7  -6.016  -0.818   5.626
   71   3HD1  ILE   7          HD13      ILE   7  -6.011   0.806   6.314
   72    H    ASN   8           HN       ASN   8  -7.234   2.580   0.367
   73    HA   ASN   8           HA       ASN   8  -9.084   4.752   1.285
   74   1HB   ASN   8          HB2       ASN   8  -7.737   4.023  -1.314
   75   2HB   ASN   8          HB1       ASN   8  -9.160   5.065  -1.310
   76   1HD2  ASN   8          HD21      ASN   8  -7.811   6.906  -2.019
   77   2HD2  ASN   8          HD22      ASN   8  -6.777   7.693  -0.914
   78    H    GLY   9           HN       GLY   9  -9.942   2.266   1.998
   79   1HA   GLY   9          HA2       GLY   9 -11.552   1.022  -0.103
   80   2HA   GLY   9          HA1       GLY   9 -11.555   0.577   1.609
   81    H    LYS  10           HN       LYS  10 -13.931   0.866   0.064
   82    HA   LYS  10           HA       LYS  10 -15.260   3.336   0.192
   83   1HB   LYS  10          HB2       LYS  10 -16.202   0.480   0.505
   84   2HB   LYS  10          HB1       LYS  10 -17.311   1.840   0.324
   85   1HG   LYS  10          HG2       LYS  10 -15.107   1.720  -1.656
   86   2HG   LYS  10          HG1       LYS  10 -16.311   0.437  -1.780
   87   1HD   LYS  10          HD2       LYS  10 -18.022   1.899  -2.306
   88   2HD   LYS  10          HD1       LYS  10 -17.288   3.240  -1.426
   89   1HE   LYS  10          HE2       LYS  10 -15.981   3.874  -3.217
   90   2HE   LYS  10          HE1       LYS  10 -15.794   2.208  -3.799
   91   1HZ   LYS  10          HZ1       LYS  10 -17.287   3.327  -5.268
   92   2HZ   LYS  10          HZ2       LYS  10 -18.227   3.904  -3.975
   93   3HZ   LYS  10          HZ3       LYS  10 -18.203   2.244  -4.338
   94    H    THR  11           HN       THR  11 -14.487   1.102   2.778
   95    HA   THR  11           HA       THR  11 -15.774   2.970   4.732
   96    HB   THR  11           HB       THR  11 -15.874  -0.064   4.764
   97    HG1  THR  11           HG1      THR  11 -17.454   0.253   3.436
   98   1HG2  THR  11          HG21      THR  11 -15.914   1.113   6.985
   99   2HG2  THR  11          HG22      THR  11 -17.385   0.206   6.633
  100   3HG2  THR  11          HG23      THR  11 -17.366   1.960   6.452
  101    H    LEU  12           HN       LEU  12 -13.494   0.253   4.272
  102    HA   LEU  12           HA       LEU  12 -12.135   0.738   6.821
  103   1HB   LEU  12          HB2       LEU  12 -11.556  -0.977   4.385
  104   2HB   LEU  12          HB1       LEU  12 -10.621  -1.044   5.880
  105    HG   LEU  12           HG       LEU  12 -13.610  -1.335   5.983
  106   1HD1  LEU  12          HD11      LEU  12 -13.056  -2.985   4.343
  107   2HD1  LEU  12          HD12      LEU  12 -13.164  -3.847   5.877
  108   3HD1  LEU  12          HD13      LEU  12 -11.585  -3.443   5.202
  109   1HD2  LEU  12          HD21      LEU  12 -11.873  -1.116   7.963
  110   2HD2  LEU  12          HD22      LEU  12 -11.579  -2.821   7.621
  111   3HD2  LEU  12          HD23      LEU  12 -13.194  -2.279   8.075
  112    H    LYS  13           HN       LYS  13 -10.181   1.825   7.108
  113    HA   LYS  13           HA       LYS  13  -8.623   2.766   4.778
  114   1HB   LYS  13          HB2       LYS  13 -10.310   4.491   6.589
  115   2HB   LYS  13          HB1       LYS  13  -8.888   5.158   5.786
  116   1HG   LYS  13          HG2       LYS  13  -9.988   3.982   3.660
  117   2HG   LYS  13          HG1       LYS  13 -11.461   4.209   4.603
  118   1HD   LYS  13          HD2       LYS  13 -11.039   6.595   4.786
  119   2HD   LYS  13          HD1       LYS  13  -9.474   6.415   3.994
  120   1HE   LYS  13          HE2       LYS  13 -10.893   5.347   2.044
  121   2HE   LYS  13          HE1       LYS  13 -12.226   6.249   2.793
  122   1HZ   LYS  13          HZ1       LYS  13 -10.885   8.244   2.743
  123   2HZ   LYS  13          HZ2       LYS  13 -11.014   7.608   1.173
  124   3HZ   LYS  13          HZ3       LYS  13  -9.582   7.397   2.063
  125    H    GLY  14           HN       GLY  14  -6.842   4.393   5.818
  126   1HA   GLY  14          HA2       GLY  14  -5.751   4.717   8.144
  127   2HA   GLY  14          HA1       GLY  14  -5.753   2.954   8.194
  128    H    GLU  15           HN       GLU  15  -3.371   4.477   8.340
  129    HA   GLU  15           HA       GLU  15  -2.110   4.184   5.650
  130   1HB   GLU  15          HB2       GLU  15  -1.909   6.328   6.845
  131   2HB   GLU  15          HB1       GLU  15  -1.230   5.500   8.245
  132   1HG   GLU  15          HG2       GLU  15   0.734   4.849   6.993
  133   2HG   GLU  15          HG1       GLU  15   0.032   5.444   5.489
  134    H    THR  16           HN       THR  16  -0.023   3.055   5.528
  135    HA   THR  16           HA       THR  16   0.769   1.349   7.812
  136    HB   THR  16           HB       THR  16  -1.074   0.121   6.744
  137    HG1  THR  16           HG1      THR  16   1.422  -0.991   5.998
  138   1HG2  THR  16          HG21      THR  16  -1.132   0.975   4.530
  139   2HG2  THR  16          HG22      THR  16  -0.631  -0.705   4.351
  140   3HG2  THR  16          HG23      THR  16   0.566   0.587   4.245
  141    H    THR  17           HN       THR  17   2.899   0.525   7.567
  142    HA   THR  17           HA       THR  17   4.357   1.239   5.051
  143    HB   THR  17           HB       THR  17   6.149   2.191   6.459
  144    HG1  THR  17           HG1      THR  17   6.142   1.571   8.448
  145   1HG2  THR  17          HG21      THR  17   3.727   3.373   5.875
  146   2HG2  THR  17          HG22      THR  17   5.134   4.217   6.522
  147   3HG2  THR  17          HG23      THR  17   3.870   3.647   7.612
  148    H    THR  18           HN       THR  18   6.368  -0.006   4.805
  149    HA   THR  18           HA       THR  18   6.694  -2.308   6.649
  150    HB   THR  18           HB       THR  18   5.497  -2.280   3.973
  151    HG1  THR  18           HG1      THR  18   4.603  -3.386   5.662
  152   1HG2  THR  18          HG21      THR  18   7.777  -2.851   3.222
  153   2HG2  THR  18          HG22      THR  18   6.671  -4.215   3.033
  154   3HG2  THR  18          HG23      THR  18   7.823  -4.191   4.369
  155    H    GLU  19           HN       GLU  19   8.820  -3.406   6.240
  156    HA   GLU  19           HA       GLU  19  10.854  -1.507   5.110
  157   1HB   GLU  19          HB2       GLU  19  10.852  -1.814   7.586
  158   2HB   GLU  19          HB1       GLU  19  11.082  -3.547   7.351
  159   1HG   GLU  19          HG2       GLU  19  13.107  -2.628   5.822
  160   2HG   GLU  19          HG1       GLU  19  13.015  -1.315   6.997
  161    H    ALA  20           HN       ALA  20  11.634  -2.342   3.204
  162    HA   ALA  20           HA       ALA  20  12.439  -5.195   3.094
  163   1HB   ALA  20          HB1       ALA  20  10.210  -3.879   1.563
  164   2HB   ALA  20          HB2       ALA  20  10.231  -5.457   2.353
  165   3HB   ALA  20          HB3       ALA  20  11.095  -5.220   0.834
  166    H    VAL  21           HN       VAL  21  13.384  -5.606   0.777
  167    HA   VAL  21           HA       VAL  21  15.583  -3.856   0.306
  168    HB   VAL  21           HB       VAL  21  15.441  -6.238  -0.346
  169   1HG1  VAL  21          HG11      VAL  21  12.981  -5.961  -1.127
  170   2HG1  VAL  21          HG12      VAL  21  14.021  -7.053  -2.041
  171   3HG1  VAL  21          HG13      VAL  21  13.686  -5.435  -2.656
  172   1HG2  VAL  21          HG21      VAL  21  16.521  -6.051  -2.510
  173   2HG2  VAL  21          HG22      VAL  21  17.007  -4.673  -1.522
  174   3HG2  VAL  21          HG23      VAL  21  15.785  -4.470  -2.778
  175    H    ASP  22           HN       ASP  22  12.393  -4.066  -1.223
  176    HA   ASP  22           HA       ASP  22  12.725  -1.334  -2.320
  177   1HB   ASP  22          HB2       ASP  22  13.737  -2.939  -3.923
  178   2HB   ASP  22          HB1       ASP  22  12.215  -3.828  -3.973
  179    H    ALA  23           HN       ALA  23  10.630  -0.480  -3.073
  180    HA   ALA  23           HA       ALA  23   8.391  -1.200  -1.454
  181   1HB   ALA  23          HB1       ALA  23   8.962   0.519  -3.826
  182   2HB   ALA  23          HB2       ALA  23   8.261   0.958  -2.269
  183   3HB   ALA  23          HB3       ALA  23   7.268   0.165  -3.491
  184    H    ALA  24           HN       ALA  24   9.465  -2.369  -4.589
  185    HA   ALA  24           HA       ALA  24   7.041  -3.541  -5.546
  186   1HB   ALA  24          HB1       ALA  24   8.622  -4.959  -6.852
  187   2HB   ALA  24          HB2       ALA  24   9.940  -4.412  -5.816
  188   3HB   ALA  24          HB3       ALA  24   9.107  -3.263  -6.863
  189    H    THR  25           HN       THR  25   9.650  -4.906  -3.521
  190    HA   THR  25           HA       THR  25   8.404  -7.480  -3.126
  191    HB   THR  25           HB       THR  25  10.531  -5.873  -1.671
  192    HG1  THR  25           HG1      THR  25  11.289  -6.555  -3.573
  193   1HG2  THR  25          HG21      THR  25   9.455  -7.473  -0.093
  194   2HG2  THR  25          HG22      THR  25  11.125  -7.917  -0.459
  195   3HG2  THR  25          HG23      THR  25   9.795  -8.784  -1.227
  196    H    ALA  26           HN       ALA  26   8.583  -4.541  -1.071
  197    HA   ALA  26           HA       ALA  26   7.037  -5.520   1.101
  198   1HB   ALA  26          HB1       ALA  26   7.491  -2.768  -0.084
  199   2HB   ALA  26          HB2       ALA  26   8.281  -3.485   1.319
  200   3HB   ALA  26          HB3       ALA  26   6.585  -3.003   1.416
  201    H    GLU  27           HN       GLU  27   5.942  -3.395  -1.565
  202    HA   GLU  27           HA       GLU  27   3.245  -3.197  -1.118
  203   1HB   GLU  27          HB2       GLU  27   4.560  -2.238  -3.000
  204   2HB   GLU  27          HB1       GLU  27   4.574  -3.823  -3.774
  205   1HG   GLU  27          HG2       GLU  27   1.964  -3.673  -3.492
  206   2HG   GLU  27          HG1       GLU  27   2.270  -1.941  -3.361
  207    H    LYS  28           HN       LYS  28   4.858  -6.117  -2.376
  208    HA   LYS  28           HA       LYS  28   2.477  -7.574  -3.099
  209   1HB   LYS  28          HB2       LYS  28   5.185  -8.508  -2.065
  210   2HB   LYS  28          HB1       LYS  28   4.012  -9.528  -2.898
  211   1HG   LYS  28          HG2       LYS  28   4.355  -8.483  -4.950
  212   2HG   LYS  28          HG1       LYS  28   4.929  -6.989  -4.207
  213   1HD   LYS  28          HD2       LYS  28   6.970  -7.822  -4.855
  214   2HD   LYS  28          HD1       LYS  28   6.837  -8.668  -3.313
  215   1HE   LYS  28          HE2       LYS  28   5.734 -10.584  -4.558
  216   2HE   LYS  28          HE1       LYS  28   6.175  -9.759  -6.066
  217   1HZ   LYS  28          HZ1       LYS  28   8.461  -9.751  -5.419
  218   2HZ   LYS  28          HZ2       LYS  28   7.892 -11.345  -5.273
  219   3HZ   LYS  28          HZ3       LYS  28   8.096 -10.382  -3.888
  220    H    VAL  29           HN       VAL  29   4.398  -7.378  -0.110
  221    HA   VAL  29           HA       VAL  29   2.707  -9.133   1.470
  222    HB   VAL  29           HB       VAL  29   4.824  -7.020   1.986
  223   1HG1  VAL  29          HG11      VAL  29   4.798  -7.603   4.376
  224   2HG1  VAL  29          HG12      VAL  29   3.418  -8.669   4.115
  225   3HG1  VAL  29          HG13      VAL  29   3.239  -6.925   3.897
  226   1HG2  VAL  29          HG21      VAL  29   5.814  -9.009   1.244
  227   2HG2  VAL  29          HG22      VAL  29   4.636 -10.021   2.079
  228   3HG2  VAL  29          HG23      VAL  29   5.887  -9.182   2.997
  229    H    LEU  30           HN       LEU  30   2.811  -5.621   0.854
  230    HA   LEU  30           HA       LEU  30   0.831  -4.893   2.796
  231   1HB   LEU  30          HB2       LEU  30   1.895  -3.705   0.225
  232   2HB   LEU  30          HB1       LEU  30   0.640  -2.886   1.138
  233    HG   LEU  30           HG       LEU  30   3.163  -2.270   1.538
  234   1HD1  LEU  30          HD11      LEU  30   1.433  -1.258   2.843
  235   2HD1  LEU  30          HD12      LEU  30   2.673  -1.837   3.962
  236   3HD1  LEU  30          HD13      LEU  30   1.172  -2.748   3.755
  237   1HD2  LEU  30          HD21      LEU  30   4.067  -3.520   3.533
  238   2HD2  LEU  30          HD22      LEU  30   4.129  -4.386   2.012
  239   3HD2  LEU  30          HD23      LEU  30   2.893  -4.779   3.203
  240    H    LYS  31           HN       LYS  31   0.686  -6.110  -0.505
  241    HA   LYS  31           HA       LYS  31  -2.102  -5.629  -1.064
  242   1HB   LYS  31          HB2       LYS  31  -0.027  -6.563  -2.478
  243   2HB   LYS  31          HB1       LYS  31  -0.631  -8.106  -1.926
  244   1HG   LYS  31          HG2       LYS  31  -2.457  -6.075  -3.213
  245   2HG   LYS  31          HG1       LYS  31  -1.544  -7.236  -4.175
  246   1HD   LYS  31          HD2       LYS  31  -3.523  -7.915  -1.975
  247   2HD   LYS  31          HD1       LYS  31  -3.792  -8.111  -3.706
  248   1HE   LYS  31          HE2       LYS  31  -1.349  -9.433  -3.176
  249   2HE   LYS  31          HE1       LYS  31  -2.457  -9.918  -1.871
  250   1HZ   LYS  31          HZ1       LYS  31  -4.130 -10.474  -3.477
  251   2HZ   LYS  31          HZ2       LYS  31  -2.701 -11.281  -3.917
  252   3HZ   LYS  31          HZ3       LYS  31  -3.185  -9.885  -4.756
  253    H    GLN  32           HN       GLN  32  -0.314  -8.326   0.384
  254    HA   GLN  32           HA       GLN  32  -2.435 -10.135   0.891
  255   1HB   GLN  32          HB2       GLN  32   0.265  -9.526   1.963
  256   2HB   GLN  32          HB1       GLN  32  -0.780 -10.523   2.976
  257   1HG   GLN  32          HG2       GLN  32  -1.131 -12.091   1.129
  258   2HG   GLN  32          HG1       GLN  32  -0.151 -11.080   0.067
  259   1HE2  GLN  32          HE21      GLN  32   0.242 -12.440   3.400
  260   2HE2  GLN  32          HE22      GLN  32   1.827 -13.011   3.130
  261    H    TYR  33           HN       TYR  33  -1.255  -7.361   2.778
  262    HA   TYR  33           HA       TYR  33  -2.987  -7.675   5.068
  263   1HB   TYR  33          HB2       TYR  33  -0.990  -6.251   5.036
  264   2HB   TYR  33          HB1       TYR  33  -1.685  -5.257   3.756
  265    HD1  TYR  33           HD1      TYR  33  -2.097  -6.333   7.274
  266    HD2  TYR  33           HD2      TYR  33  -3.231  -3.512   4.247
  267    HE1  TYR  33           HE1      TYR  33  -3.241  -4.971   8.983
  268    HE2  TYR  33           HE2      TYR  33  -4.374  -2.135   5.960
  269    HH   TYR  33           HH       TYR  33  -5.199  -3.236   8.953
  270    H    ILE  34           HN       ILE  34  -3.289  -5.967   1.974
  271    HA   ILE  34           HA       ILE  34  -5.854  -4.739   2.453
  272    HB   ILE  34           HB       ILE  34  -4.434  -5.627  -0.078
  273   1HG1  ILE  34          HG12      ILE  34  -3.283  -4.009   1.603
  274   2HG1  ILE  34          HG11      ILE  34  -3.327  -3.550  -0.093
  275   1HG2  ILE  34          HG21      ILE  34  -6.663  -5.203  -0.734
  276   2HG2  ILE  34          HG22      ILE  34  -5.815  -3.696  -1.076
  277   3HG2  ILE  34          HG23      ILE  34  -6.818  -3.834   0.367
  278   1HD1  ILE  34          HD11      ILE  34  -4.774  -1.812   0.285
  279   2HD1  ILE  34          HD12      ILE  34  -4.053  -1.880   1.894
  280   3HD1  ILE  34          HD13      ILE  34  -5.611  -2.652   1.591
  281    H    ASN  35           HN       ASN  35  -4.833  -7.940   1.417
  282    HA   ASN  35           HA       ASN  35  -7.224  -8.918   0.228
  283   1HB   ASN  35          HB2       ASN  35  -4.892  -9.939   0.345
  284   2HB   ASN  35          HB1       ASN  35  -5.290 -10.455   1.984
  285   1HD2  ASN  35          HD21      ASN  35  -5.865 -11.093  -1.418
  286   2HD2  ASN  35          HD22      ASN  35  -6.847 -12.459  -1.193
  287    H    ASP  36           HN       ASP  36  -6.318  -8.492   3.610
  288    HA   ASP  36           HA       ASP  36  -8.528 -10.060   4.697
  289   1HB   ASP  36          HB2       ASP  36  -6.318  -8.299   5.648
  290   2HB   ASP  36          HB1       ASP  36  -7.691  -8.504   6.737
  291    H    ASN  37           HN       ASN  37  -7.901  -6.611   4.087
  292    HA   ASN  37           HA       ASN  37 -10.408  -5.706   5.281
  293   1HB   ASN  37          HB2       ASN  37  -8.346  -4.437   3.449
  294   2HB   ASN  37          HB1       ASN  37  -9.676  -3.551   4.202
  295   1HD2  ASN  37          HD21      ASN  37  -8.977  -2.479   6.045
  296   2HD2  ASN  37          HD22      ASN  37  -7.813  -3.070   7.143
  297    H    GLY  38           HN       GLY  38  -9.318  -6.677   2.078
  298   1HA   GLY  38          HA2       GLY  38 -10.651  -7.281   0.217
  299   2HA   GLY  38          HA1       GLY  38 -12.082  -6.798   1.127
  300    H    ILE  39           HN       ILE  39  -9.154  -4.952   0.247
  301    HA   ILE  39           HA       ILE  39 -10.924  -3.037  -1.240
  302    HB   ILE  39           HB       ILE  39  -8.592  -2.461   0.622
  303   1HG1  ILE  39          HG12      ILE  39 -10.618  -3.185   1.831
  304   2HG1  ILE  39          HG11      ILE  39 -10.321  -1.465   2.091
  305   1HG2  ILE  39          HG21      ILE  39  -8.835  -0.852  -1.271
  306   2HG2  ILE  39          HG22      ILE  39  -9.152  -0.109   0.297
  307   3HG2  ILE  39          HG23      ILE  39 -10.495  -0.545  -0.759
  308   1HD1  ILE  39          HD11      ILE  39 -12.487  -1.186   1.474
  309   2HD1  ILE  39          HD12      ILE  39 -12.581  -2.794   0.757
  310   3HD1  ILE  39          HD13      ILE  39 -11.910  -1.454  -0.171
  311    H    ASP  40           HN       ASP  40 -10.121  -4.359  -3.132
  312    HA   ASP  40           HA       ASP  40  -7.294  -3.689  -3.881
  313   1HB   ASP  40          HB2       ASP  40  -7.950  -6.094  -3.628
  314   2HB   ASP  40          HB1       ASP  40  -9.152  -5.863  -4.902
  315    H    GLY  41           HN       GLY  41  -7.259  -1.969  -5.272
  316   1HA   GLY  41          HA2       GLY  41  -9.023  -2.010  -7.640
  317   2HA   GLY  41          HA1       GLY  41  -9.177  -0.601  -6.584
  318    H    GLU  42           HN       GLU  42  -7.663   1.020  -6.752
  319    HA   GLU  42           HA       GLU  42  -5.346   0.531  -8.597
  320   1HB   GLU  42          HB2       GLU  42  -7.130   2.942  -8.137
  321   2HB   GLU  42          HB1       GLU  42  -5.672   2.987  -9.130
  322   1HG   GLU  42          HG2       GLU  42  -6.600   1.198 -10.566
  323   2HG   GLU  42          HG1       GLU  42  -8.067   1.183  -9.586
  324    H    TRP  43           HN       TRP  43  -3.390   0.779  -7.620
  325    HA   TRP  43           HA       TRP  43  -3.251   2.102  -4.967
  326   1HB   TRP  43          HB2       TRP  43  -1.475   0.249  -6.550
  327   2HB   TRP  43          HB1       TRP  43  -0.932   1.016  -5.068
  328    HD1  TRP  43           HD1      TRP  43  -4.541  -0.253  -5.437
  329    HE1  TRP  43           HE1      TRP  43  -4.863  -2.224  -3.815
  330    HE3  TRP  43           HE3      TRP  43   0.237  -0.802  -3.793
  331    HZ2  TRP  43           HZ2      TRP  43  -3.298  -3.801  -2.020
  332    HZ3  TRP  43           HZ3      TRP  43   0.801  -2.536  -2.106
  333    HH2  TRP  43           HH2      TRP  43  -0.958  -4.030  -1.223
  334    H    THR  44           HN       THR  44  -1.365   1.981  -7.936
  335    HA   THR  44           HA       THR  44  -0.020   3.562  -9.035
  336    HB   THR  44           HB       THR  44  -0.807   5.768  -9.111
  337    HG1  THR  44           HG1      THR  44  -1.986   6.678  -7.334
  338   1HG2  THR  44          HG21      THR  44  -2.612   4.031  -9.599
  339   2HG2  THR  44          HG22      THR  44  -3.183   5.661  -9.238
  340   3HG2  THR  44          HG23      THR  44  -3.266   4.404  -8.004
  341    H    TYR  45           HN       TYR  45   2.062   4.090  -8.611
  342    HA   TYR  45           HA       TYR  45   2.897   4.305  -5.758
  343   1HB   TYR  45          HB2       TYR  45   3.904   2.603  -7.232
  344   2HB   TYR  45          HB1       TYR  45   4.412   3.859  -8.357
  345    HD1  TYR  45           HD1      TYR  45   4.543   3.555  -4.611
  346    HD2  TYR  45           HD2      TYR  45   6.717   4.142  -8.269
  347    HE1  TYR  45           HE1      TYR  45   6.634   3.880  -3.317
  348    HE2  TYR  45           HE2      TYR  45   8.805   4.468  -6.976
  349    HH   TYR  45           HH       TYR  45   9.428   3.515  -4.220
  350    H    ASP  46           HN       ASP  46   4.409   6.015  -5.138
  351    HA   ASP  46           HA       ASP  46   4.531   8.358  -7.000
  352   1HB   ASP  46          HB2       ASP  46   4.032   9.791  -5.022
  353   2HB   ASP  46          HB1       ASP  46   2.715   8.675  -5.376
  354    H    ASP  47           HN       ASP  47   6.574   9.187  -7.152
  355    HA   ASP  47           HA       ASP  47   8.744   7.973  -5.587
  356   1HB   ASP  47          HB2       ASP  47   8.817   8.419  -8.037
  357   2HB   ASP  47          HB1       ASP  47   8.734  10.149  -7.700
  358    H    ALA  48           HN       ALA  48   6.665  10.450  -4.815
  359    HA   ALA  48           HA       ALA  48   8.352  12.608  -4.001
  360   1HB   ALA  48          HB1       ALA  48   5.695  12.101  -4.063
  361   2HB   ALA  48          HB2       ALA  48   6.386  13.400  -3.091
  362   3HB   ALA  48          HB3       ALA  48   5.993  11.852  -2.343
  363    H    THR  49           HN       THR  49   7.243   9.712  -2.244
  364    HA   THR  49           HA       THR  49   9.649   9.774  -0.540
  365    HB   THR  49           HB       THR  49   8.095  11.330   0.554
  366    HG1  THR  49           HG1      THR  49   8.136   8.819   1.866
  367   1HG2  THR  49          HG21      THR  49   6.015   9.681   1.468
  368   2HG2  THR  49          HG22      THR  49   6.148   9.339  -0.257
  369   3HG2  THR  49          HG23      THR  49   5.887  10.993   0.297
  370    H    LYS  50           HN       LYS  50   8.422   7.964  -2.530
  371    HA   LYS  50           HA       LYS  50   7.992   5.668  -2.826
  372   1HB   LYS  50          HB2       LYS  50   9.279   5.579  -0.077
  373   2HB   LYS  50          HB1       LYS  50   9.150   4.228  -1.201
  374   1HG   LYS  50          HG2       LYS  50  10.573   5.334  -2.809
  375   2HG   LYS  50          HG1       LYS  50  10.573   6.820  -1.859
  376   1HD   LYS  50          HD2       LYS  50  12.093   6.017  -0.349
  377   2HD   LYS  50          HD1       LYS  50  11.457   4.374  -0.429
  378   1HE   LYS  50          HE2       LYS  50  12.776   3.806  -2.255
  379   2HE   LYS  50          HE1       LYS  50  12.856   5.478  -2.846
  380   1HZ   LYS  50          HZ1       LYS  50  14.937   4.713  -1.754
  381   2HZ   LYS  50          HZ2       LYS  50  14.074   4.555  -0.299
  382   3HZ   LYS  50          HZ3       LYS  50  14.251   6.081  -1.023
  383    H    THR  51           HN       THR  51   5.725   7.038  -1.975
  384    HA   THR  51           HA       THR  51   4.543   5.356   0.199
  385    HB   THR  51           HB       THR  51   3.651   7.935  -1.143
  386    HG1  THR  51           HG1      THR  51   4.693   7.405   1.439
  387   1HG2  THR  51          HG21      THR  51   2.146   7.967   0.976
  388   2HG2  THR  51          HG22      THR  51   2.443   6.229   1.028
  389   3HG2  THR  51          HG23      THR  51   1.656   6.947  -0.377
  390    H    TRP  52           HN       TRP  52   2.192   4.718  -0.238
  391    HA   TRP  52           HA       TRP  52   1.695   4.138  -3.135
  392   1HB   TRP  52          HB2       TRP  52   1.761   2.316  -0.728
  393   2HB   TRP  52          HB1       TRP  52   0.915   1.871  -2.205
  394    HD1  TRP  52           HD1      TRP  52   4.388   2.347  -0.768
  395    HE1  TRP  52           HE1      TRP  52   6.119   1.425  -2.449
  396    HE3  TRP  52           HE3      TRP  52   1.333   1.442  -4.712
  397    HZ2  TRP  52           HZ2      TRP  52   6.176   0.420  -5.140
  398    HZ3  TRP  52           HZ3      TRP  52   2.226   0.496  -6.831
  399    HH2  TRP  52           HH2      TRP  52   4.645  -0.016  -7.045
  400    H    THR  53           HN       THR  53  -0.635   2.870  -3.035
  401    HA   THR  53           HA       THR  53  -2.509   4.044  -1.097
  402    HB   THR  53           HB       THR  53  -3.087   4.623  -3.983
  403    HG1  THR  53           HG1      THR  53  -1.477   6.274  -2.337
  404   1HG2  THR  53          HG21      THR  53  -4.865   5.341  -2.731
  405   2HG2  THR  53          HG22      THR  53  -3.862   6.785  -2.595
  406   3HG2  THR  53          HG23      THR  53  -3.882   5.598  -1.291
  407    H    VAL  54           HN       VAL  54  -4.881   3.411  -2.072
  408    HA   VAL  54           HA       VAL  54  -5.092   1.083  -3.757
  409    HB   VAL  54           HB       VAL  54  -3.857   0.001  -1.949
  410   1HG1  VAL  54          HG11      VAL  54  -4.002   1.007   0.058
  411   2HG1  VAL  54          HG12      VAL  54  -5.465   0.056   0.301
  412   3HG1  VAL  54          HG13      VAL  54  -5.576   1.706  -0.307
  413   1HG2  VAL  54          HG21      VAL  54  -5.220  -1.840  -1.692
  414   2HG2  VAL  54          HG22      VAL  54  -6.145  -0.993  -2.938
  415   3HG2  VAL  54          HG23      VAL  54  -6.626  -0.867  -1.246
  416    H    THR  55           HN       THR  55  -6.825   2.622  -4.377
  417    HA   THR  55           HA       THR  55  -9.067   3.003  -2.488
  418    HB   THR  55           HB       THR  55  -8.828   3.755  -5.415
  419    HG1  THR  55           HG1      THR  55  -8.036   5.262  -3.150
  420   1HG2  THR  55          HG21      THR  55 -10.374   5.542  -4.787
  421   2HG2  THR  55          HG22      THR  55 -10.330   5.017  -3.104
  422   3HG2  THR  55          HG23      THR  55 -11.056   3.981  -4.333
  423    H    GLU  56           HN       GLU  56 -11.009   1.884  -2.615
  424    HA   GLU  56           HA       GLU  56 -11.122  -0.618  -4.078
  425   1HB   GLU  56          HB2       GLU  56 -12.239   0.314  -1.837
  426   2HB   GLU  56          HB1       GLU  56 -13.550   0.719  -2.945
  427   1HG   GLU  56          HG2       GLU  56 -12.371  -2.008  -3.185
  428   2HG   GLU  56          HG1       GLU  56 -13.373  -1.689  -1.769
  Start of MODEL   32
    1   1H    THR   1          HT1       THR   1  14.294   3.979   4.882
    2   2H    THR   1          HT2       THR   1  15.842   3.517   4.355
    3   3H    THR   1          HT3       THR   1  14.967   2.515   5.412
    4    HA   THR   1           HA       THR   1  14.160   3.156   2.618
    5    HB   THR   1           HB       THR   1  15.298   0.617   3.826
    6    HG1  THR   1           HG1      THR   1  16.605   2.540   2.208
    7   1HG2  THR   1          HG21      THR   1  15.058   1.492   0.938
    8   2HG2  THR   1          HG22      THR   1  13.871   0.472   1.750
    9   3HG2  THR   1          HG23      THR   1  15.525  -0.100   1.535
   10    H    THR   2           HN       THR   2  12.248   3.598   4.476
   11    HA   THR   2           HA       THR   2  10.727   1.036   4.787
   12    HB   THR   2           HB       THR   2  10.178   3.696   6.115
   13    HG1  THR   2           HG1      THR   2  11.528   2.942   7.790
   14   1HG2  THR   2          HG21      THR   2   8.553   1.720   6.186
   15   2HG2  THR   2          HG22      THR   2   9.045   2.382   7.745
   16   3HG2  THR   2          HG23      THR   2   9.771   0.888   7.152
   17    H    PHE   3           HN       PHE   3   9.153   0.764   3.266
   18    HA   PHE   3           HA       PHE   3   8.196   2.980   1.608
   19   1HB   PHE   3          HB2       PHE   3   7.379   0.063   1.863
   20   2HB   PHE   3          HB1       PHE   3   6.892   1.140   0.553
   21    HD1  PHE   3           HD1      PHE   3   9.165   2.605  -0.258
   22    HD2  PHE   3           HD2      PHE   3   9.025  -1.444   1.178
   23    HE1  PHE   3           HE1      PHE   3  11.280   2.107  -1.452
   24    HE2  PHE   3           HE2      PHE   3  11.141  -1.939  -0.017
   25    HZ   PHE   3           HZ       PHE   3  12.268  -0.163  -1.331
   26    H    LYS   4           HN       LYS   4   5.752   3.288   1.355
   27    HA   LYS   4           HA       LYS   4   4.238   2.838   3.895
   28   1HB   LYS   4          HB2       LYS   4   5.537   5.121   3.580
   29   2HB   LYS   4          HB1       LYS   4   4.191   5.504   2.510
   30   1HG   LYS   4          HG2       LYS   4   2.664   4.776   4.446
   31   2HG   LYS   4          HG1       LYS   4   4.106   4.862   5.456
   32   1HD   LYS   4          HD2       LYS   4   3.527   7.045   5.711
   33   2HD   LYS   4          HD1       LYS   4   4.275   7.238   4.125
   34   1HE   LYS   4          HE2       LYS   4   1.917   6.608   3.191
   35   2HE   LYS   4          HE1       LYS   4   1.344   7.041   4.813
   36   1HZ   LYS   4          HZ1       LYS   4   3.136   8.758   3.183
   37   2HZ   LYS   4          HZ2       LYS   4   2.374   9.165   4.646
   38   3HZ   LYS   4          HZ3       LYS   4   1.452   8.951   3.235
   39    H    LEU   5           HN       LEU   5   1.957   2.796   3.587
   40    HA   LEU   5           HA       LEU   5   0.865   3.300   0.871
   41   1HB   LEU   5          HB2       LEU   5   1.747   0.833   1.360
   42   2HB   LEU   5          HB1       LEU   5   0.214   0.696   2.210
   43    HG   LEU   5           HG       LEU   5  -0.128   1.976  -0.393
   44   1HD1  LEU   5          HD11      LEU   5   1.872   0.305  -0.694
   45   2HD1  LEU   5          HD12      LEU   5   0.541   0.284  -1.856
   46   3HD1  LEU   5          HD13      LEU   5   0.616  -0.932  -0.573
   47   1HD2  LEU   5          HD21      LEU   5  -1.264  -0.437   1.038
   48   2HD2  LEU   5          HD22      LEU   5  -1.782   0.031  -0.582
   49   3HD2  LEU   5          HD23      LEU   5  -2.031   1.130   0.775
   50    H    ILE   6           HN       ILE   6  -1.207   4.108   1.030
   51    HA   ILE   6           HA       ILE   6  -2.459   4.146   3.747
   52    HB   ILE   6           HB       ILE   6  -2.709   5.904   1.288
   53   1HG1  ILE   6          HG12      ILE   6  -0.578   6.098   2.538
   54   2HG1  ILE   6          HG11      ILE   6  -1.544   7.565   2.680
   55   1HG2  ILE   6          HG21      ILE   6  -4.790   6.255   2.220
   56   2HG2  ILE   6          HG22      ILE   6  -3.852   7.389   3.193
   57   3HG2  ILE   6          HG23      ILE   6  -4.259   5.799   3.839
   58   1HD1  ILE   6          HD11      ILE   6  -0.642   5.743   4.763
   59   2HD1  ILE   6          HD12      ILE   6  -2.391   5.960   4.815
   60   3HD1  ILE   6          HD13      ILE   6  -1.325   7.361   4.917
   61    H    ILE   7           HN       ILE   7  -4.467   3.226   4.025
   62    HA   ILE   7           HA       ILE   7  -5.623   1.669   1.800
   63    HB   ILE   7           HB       ILE   7  -6.386   2.000   4.723
   64   1HG1  ILE   7          HG12      ILE   7  -4.925  -0.310   3.421
   65   2HG1  ILE   7          HG11      ILE   7  -4.073   1.046   4.161
   66   1HG2  ILE   7          HG21      ILE   7  -7.533  -0.218   4.317
   67   2HG2  ILE   7          HG22      ILE   7  -7.250   0.025   2.593
   68   3HG2  ILE   7          HG23      ILE   7  -8.275   1.149   3.485
   69   1HD1  ILE   7          HD11      ILE   7  -4.205  -0.420   5.962
   70   2HD1  ILE   7          HD12      ILE   7  -5.769  -1.060   5.458
   71   3HD1  ILE   7          HD13      ILE   7  -5.668   0.535   6.203
   72    H    ASN   8           HN       ASN   8  -7.156   2.570   0.497
   73    HA   ASN   8           HA       ASN   8  -8.860   4.780   1.601
   74   1HB   ASN   8          HB2       ASN   8  -7.632   4.184  -1.089
   75   2HB   ASN   8          HB1       ASN   8  -9.030   5.252  -0.967
   76   1HD2  ASN   8          HD21      ASN   8  -7.563   7.044  -1.682
   77   2HD2  ASN   8          HD22      ASN   8  -6.515   7.769  -0.548
   78    H    GLY   9           HN       GLY   9  -9.782   2.304   2.214
   79   1HA   GLY   9          HA2       GLY   9 -11.495   1.220   0.101
   80   2HA   GLY   9          HA1       GLY   9 -11.445   0.672   1.781
   81    H    LYS  10           HN       LYS  10 -13.841   1.205   0.229
   82    HA   LYS  10           HA       LYS  10 -15.072   3.692   0.673
   83   1HB   LYS  10          HB2       LYS  10 -16.169   0.868   0.649
   84   2HB   LYS  10          HB1       LYS  10 -17.180   2.310   0.550
   85   1HG   LYS  10          HG2       LYS  10 -16.051   3.007  -1.501
   86   2HG   LYS  10          HG1       LYS  10 -14.944   1.638  -1.386
   87   1HD   LYS  10          HD2       LYS  10 -16.546   0.106  -2.025
   88   2HD   LYS  10          HD1       LYS  10 -17.873   1.056  -1.355
   89   1HE   LYS  10          HE2       LYS  10 -17.475   2.746  -3.213
   90   2HE   LYS  10          HE1       LYS  10 -16.376   1.559  -3.945
   91   1HZ   LYS  10          HZ1       LYS  10 -18.097  -0.043  -4.044
   92   2HZ   LYS  10          HZ2       LYS  10 -18.753   1.388  -4.682
   93   3HZ   LYS  10          HZ3       LYS  10 -19.143   0.902  -3.102
   94    H    THR  11           HN       THR  11 -14.523   1.033   2.910
   95    HA   THR  11           HA       THR  11 -15.790   2.660   5.091
   96    HB   THR  11           HB       THR  11 -15.682  -0.359   4.969
   97    HG1  THR  11           HG1      THR  11 -16.857   0.091   3.212
   98   1HG2  THR  11          HG21      THR  11 -17.202  -0.296   6.719
   99   2HG2  THR  11          HG22      THR  11 -17.824   1.289   6.259
  100   3HG2  THR  11          HG23      THR  11 -16.259   1.154   7.061
  101    H    LEU  12           HN       LEU  12 -13.357   0.178   4.280
  102    HA   LEU  12           HA       LEU  12 -12.013   0.401   6.878
  103   1HB   LEU  12          HB2       LEU  12 -11.331  -0.950   4.246
  104   2HB   LEU  12          HB1       LEU  12 -10.427  -1.177   5.744
  105    HG   LEU  12           HG       LEU  12 -13.394  -1.593   5.781
  106   1HD1  LEU  12          HD11      LEU  12 -13.291  -3.743   4.859
  107   2HD1  LEU  12          HD12      LEU  12 -11.543  -3.853   5.065
  108   3HD1  LEU  12          HD13      LEU  12 -12.219  -2.833   3.795
  109   1HD2  LEU  12          HD21      LEU  12 -12.935  -2.785   7.705
  110   2HD2  LEU  12          HD22      LEU  12 -11.540  -1.705   7.715
  111   3HD2  LEU  12          HD23      LEU  12 -11.376  -3.352   7.106
  112    H    LYS  13           HN       LYS  13  -9.764   1.140   7.077
  113    HA   LYS  13           HA       LYS  13  -8.475   2.642   4.937
  114   1HB   LYS  13          HB2       LYS  13 -10.551   3.907   6.269
  115   2HB   LYS  13          HB1       LYS  13  -9.133   4.474   7.150
  116   1HG   LYS  13          HG2       LYS  13  -8.107   5.273   5.103
  117   2HG   LYS  13          HG1       LYS  13  -9.395   4.559   4.131
  118   1HD   LYS  13          HD2       LYS  13 -10.892   6.073   5.786
  119   2HD   LYS  13          HD1       LYS  13  -9.416   7.038   5.774
  120   1HE   LYS  13          HE2       LYS  13 -10.820   6.076   3.257
  121   2HE   LYS  13          HE1       LYS  13 -11.013   7.699   3.951
  122   1HZ   LYS  13          HZ1       LYS  13  -8.484   6.429   3.049
  123   2HZ   LYS  13          HZ2       LYS  13  -8.553   7.886   3.920
  124   3HZ   LYS  13          HZ3       LYS  13  -9.241   7.786   2.370
  125    H    GLY  14           HN       GLY  14  -6.661   4.113   6.136
  126   1HA   GLY  14          HA2       GLY  14  -5.402   4.115   8.374
  127   2HA   GLY  14          HA1       GLY  14  -5.456   2.358   8.234
  128    H    GLU  15           HN       GLU  15  -3.001   3.635   8.428
  129    HA   GLU  15           HA       GLU  15  -1.915   3.578   5.634
  130   1HB   GLU  15          HB2       GLU  15  -0.071   4.922   6.644
  131   2HB   GLU  15          HB1       GLU  15  -1.643   5.688   6.860
  132   1HG   GLU  15          HG2       GLU  15  -1.737   5.150   9.142
  133   2HG   GLU  15          HG1       GLU  15  -0.555   3.850   8.984
  134    H    THR  16           HN       THR  16   0.376   2.670   5.523
  135    HA   THR  16           HA       THR  16   1.193   0.797   7.637
  136    HB   THR  16           HB       THR  16  -0.637  -0.413   6.531
  137    HG1  THR  16           HG1      THR  16   1.904  -1.383   5.732
  138   1HG2  THR  16          HG21      THR  16  -0.732   0.599   4.373
  139   2HG2  THR  16          HG22      THR  16  -0.260  -1.077   4.094
  140   3HG2  THR  16          HG23      THR  16   0.953   0.203   4.030
  141    H    THR  17           HN       THR  17   3.300  -0.120   7.206
  142    HA   THR  17           HA       THR  17   4.721   0.925   4.788
  143    HB   THR  17           HB       THR  17   6.563   1.618   6.296
  144    HG1  THR  17           HG1      THR  17   6.498   0.599   8.131
  145   1HG2  THR  17          HG21      THR  17   4.164   2.927   5.889
  146   2HG2  THR  17          HG22      THR  17   5.604   3.645   6.609
  147   3HG2  THR  17          HG23      THR  17   4.340   2.981   7.643
  148    H    THR  18           HN       THR  18   6.713  -0.299   4.328
  149    HA   THR  18           HA       THR  18   7.071  -2.830   5.826
  150    HB   THR  18           HB       THR  18   5.674  -2.478   3.291
  151    HG1  THR  18           HG1      THR  18   5.056  -3.822   5.009
  152   1HG2  THR  18          HG21      THR  18   8.011  -4.413   3.184
  153   2HG2  THR  18          HG22      THR  18   7.914  -2.894   2.291
  154   3HG2  THR  18          HG23      THR  18   6.765  -4.192   1.953
  155    H    GLU  19           HN       GLU  19   9.140  -3.902   5.165
  156    HA   GLU  19           HA       GLU  19  11.138  -1.932   4.095
  157   1HB   GLU  19          HB2       GLU  19  11.168  -2.543   6.574
  158   2HB   GLU  19          HB1       GLU  19  11.595  -4.180   6.076
  159   1HG   GLU  19          HG2       GLU  19  13.411  -2.788   4.635
  160   2HG   GLU  19          HG1       GLU  19  13.224  -1.695   6.007
  161    H    ALA  20           HN       ALA  20  11.804  -2.625   2.092
  162    HA   ALA  20           HA       ALA  20  12.520  -5.484   1.717
  163   1HB   ALA  20          HB1       ALA  20  10.386  -5.737   0.902
  164   2HB   ALA  20          HB2       ALA  20  11.111  -5.061  -0.557
  165   3HB   ALA  20          HB3       ALA  20  10.212  -4.018   0.547
  166    H    VAL  21           HN       VAL  21  13.327  -5.689  -0.713
  167    HA   VAL  21           HA       VAL  21  15.630  -4.057  -1.065
  168    HB   VAL  21           HB       VAL  21  15.270  -6.308  -2.021
  169   1HG1  VAL  21          HG11      VAL  21  12.813  -5.743  -2.627
  170   2HG1  VAL  21          HG12      VAL  21  13.720  -6.773  -3.735
  171   3HG1  VAL  21          HG13      VAL  21  13.491  -5.065  -4.107
  172   1HG2  VAL  21          HG21      VAL  21  16.199  -5.877  -4.260
  173   2HG2  VAL  21          HG22      VAL  21  16.942  -4.818  -3.061
  174   3HG2  VAL  21          HG23      VAL  21  15.698  -4.190  -4.143
  175    H    ASP  22           HN       ASP  22  12.378  -3.809  -2.454
  176    HA   ASP  22           HA       ASP  22  12.910  -0.988  -3.199
  177   1HB   ASP  22          HB2       ASP  22  13.684  -2.449  -5.052
  178   2HB   ASP  22          HB1       ASP  22  12.084  -3.186  -5.122
  179    H    ALA  23           HN       ALA  23  10.871   0.130  -3.745
  180    HA   ALA  23           HA       ALA  23   8.662  -0.550  -2.074
  181   1HB   ALA  23          HB1       ALA  23   9.242   1.329  -4.328
  182   2HB   ALA  23          HB2       ALA  23   8.735   1.687  -2.678
  183   3HB   ALA  23          HB3       ALA  23   7.555   1.118  -3.858
  184    H    ALA  24           HN       ALA  24   9.362  -1.341  -5.449
  185    HA   ALA  24           HA       ALA  24   6.794  -2.259  -6.277
  186   1HB   ALA  24          HB1       ALA  24   8.300  -3.739  -7.790
  187   2HB   ALA  24          HB2       ALA  24   9.652  -2.956  -6.971
  188   3HB   ALA  24          HB3       ALA  24   8.505  -1.991  -7.901
  189    H    THR  25           HN       THR  25   9.476  -4.007  -4.697
  190    HA   THR  25           HA       THR  25   8.188  -6.573  -4.584
  191    HB   THR  25           HB       THR  25  10.391  -5.210  -2.999
  192    HG1  THR  25           HG1      THR  25  10.778  -5.699  -5.189
  193   1HG2  THR  25          HG21      THR  25   9.344  -6.993  -1.611
  194   2HG2  THR  25          HG22      THR  25  10.990  -7.411  -2.100
  195   3HG2  THR  25          HG23      THR  25   9.613  -8.143  -2.924
  196    H    ALA  26           HN       ALA  26   8.418  -3.899  -2.219
  197    HA   ALA  26           HA       ALA  26   7.008  -5.155  -0.099
  198   1HB   ALA  26          HB1       ALA  26   6.578  -2.735   0.582
  199   2HB   ALA  26          HB2       ALA  26   7.307  -2.262  -0.958
  200   3HB   ALA  26          HB3       ALA  26   8.267  -3.127   0.241
  201    H    GLU  27           HN       GLU  27   5.690  -2.709  -2.387
  202    HA   GLU  27           HA       GLU  27   3.032  -2.748  -1.674
  203   1HB   GLU  27          HB2       GLU  27   2.579  -2.036  -3.982
  204   2HB   GLU  27          HB1       GLU  27   4.073  -1.314  -3.392
  205   1HG   GLU  27          HG2       GLU  27   5.349  -2.417  -4.914
  206   2HG   GLU  27          HG1       GLU  27   4.450  -3.915  -4.726
  207    H    LYS  28           HN       LYS  28   4.687  -5.372  -3.352
  208    HA   LYS  28           HA       LYS  28   2.299  -6.746  -4.275
  209   1HB   LYS  28          HB2       LYS  28   5.088  -7.730  -3.547
  210   2HB   LYS  28          HB1       LYS  28   3.901  -8.650  -4.472
  211   1HG   LYS  28          HG2       LYS  28   4.061  -7.241  -6.332
  212   2HG   LYS  28          HG1       LYS  28   4.695  -5.898  -5.382
  213   1HD   LYS  28          HD2       LYS  28   6.690  -6.574  -6.278
  214   2HD   LYS  28          HD1       LYS  28   6.643  -7.729  -4.946
  215   1HE   LYS  28          HE2       LYS  28   5.891  -9.491  -6.341
  216   2HE   LYS  28          HE1       LYS  28   5.383  -8.371  -7.621
  217   1HZ   LYS  28          HZ1       LYS  28   8.181  -8.722  -6.682
  218   2HZ   LYS  28          HZ2       LYS  28   7.664  -7.715  -7.949
  219   3HZ   LYS  28          HZ3       LYS  28   7.549  -9.403  -8.100
  220    H    VAL  29           HN       VAL  29   4.348  -6.915  -1.380
  221    HA   VAL  29           HA       VAL  29   2.803  -8.980  -0.028
  222    HB   VAL  29           HB       VAL  29   4.905  -6.914   0.691
  223   1HG1  VAL  29          HG11      VAL  29   3.646  -8.875   2.639
  224   2HG1  VAL  29          HG12      VAL  29   3.436  -7.122   2.681
  225   3HG1  VAL  29          HG13      VAL  29   5.028  -7.828   2.969
  226   1HG2  VAL  29          HG21      VAL  29   5.246  -9.216  -0.528
  227   2HG2  VAL  29          HG22      VAL  29   5.082  -9.883   1.097
  228   3HG2  VAL  29          HG23      VAL  29   6.367  -8.728   0.744
  229    H    LEU  30           HN       LEU  30   2.876  -5.404   0.058
  230    HA   LEU  30           HA       LEU  30   0.961  -5.000   2.125
  231   1HB   LEU  30          HB2       LEU  30   1.822  -3.459  -0.329
  232   2HB   LEU  30          HB1       LEU  30   0.623  -2.804   0.771
  233    HG   LEU  30           HG       LEU  30   3.153  -2.170   1.081
  234   1HD1  LEU  30          HD11      LEU  30   1.340  -3.020   3.338
  235   2HD1  LEU  30          HD12      LEU  30   1.514  -1.407   2.641
  236   3HD1  LEU  30          HD13      LEU  30   2.840  -2.115   3.575
  237   1HD2  LEU  30          HD21      LEU  30   4.239  -3.658   2.795
  238   2HD2  LEU  30          HD22      LEU  30   4.189  -4.314   1.172
  239   3HD2  LEU  30          HD23      LEU  30   3.063  -4.892   2.397
  240    H    LYS  31           HN       LYS  31   0.634  -5.794  -1.289
  241    HA   LYS  31           HA       LYS  31  -2.182  -5.321  -1.646
  242   1HB   LYS  31          HB2       LYS  31  -0.179  -6.063  -3.254
  243   2HB   LYS  31          HB1       LYS  31  -0.711  -7.669  -2.822
  244   1HG   LYS  31          HG2       LYS  31  -2.661  -5.585  -3.807
  245   2HG   LYS  31          HG1       LYS  31  -1.767  -6.611  -4.928
  246   1HD   LYS  31          HD2       LYS  31  -3.618  -7.566  -2.719
  247   2HD   LYS  31          HD1       LYS  31  -3.953  -7.613  -4.447
  248   1HE   LYS  31          HE2       LYS  31  -1.459  -8.896  -4.157
  249   2HE   LYS  31          HE1       LYS  31  -2.470  -9.524  -2.835
  250   1HZ   LYS  31          HZ1       LYS  31  -2.753 -10.678  -5.044
  251   2HZ   LYS  31          HZ2       LYS  31  -3.453  -9.243  -5.624
  252   3HZ   LYS  31          HZ3       LYS  31  -4.182 -10.090  -4.345
  253    H    GLN  32           HN       GLN  32  -0.267  -8.070  -0.518
  254    HA   GLN  32           HA       GLN  32  -2.286 -10.007  -0.106
  255   1HB   GLN  32          HB2       GLN  32   0.393  -9.783   0.270
  256   2HB   GLN  32          HB1       GLN  32  -0.172  -9.766   1.938
  257   1HG   GLN  32          HG2       GLN  32  -0.056 -12.044   1.673
  258   2HG   GLN  32          HG1       GLN  32  -1.670 -11.798   1.004
  259   1HE2  GLN  32          HE21      GLN  32   1.522 -12.899   0.271
  260   2HE2  GLN  32          HE22      GLN  32   1.299 -13.107  -1.407
  261    H    TYR  33           HN       TYR  33  -1.134  -7.385   2.010
  262    HA   TYR  33           HA       TYR  33  -2.852  -7.921   4.273
  263   1HB   TYR  33          HB2       TYR  33  -0.862  -6.487   4.370
  264   2HB   TYR  33          HB1       TYR  33  -1.564  -5.386   3.185
  265    HD1  TYR  33           HD1      TYR  33  -1.977  -6.784   6.588
  266    HD2  TYR  33           HD2      TYR  33  -3.108  -3.693   3.835
  267    HE1  TYR  33           HE1      TYR  33  -3.125  -5.587   8.415
  268    HE2  TYR  33           HE2      TYR  33  -4.255  -2.484   5.668
  269    HH   TYR  33           HH       TYR  33  -5.334  -3.205   7.956
  270    H    ILE  34           HN       ILE  34  -3.139  -5.883   1.380
  271    HA   ILE  34           HA       ILE  34  -5.740  -4.771   1.933
  272    HB   ILE  34           HB       ILE  34  -4.264  -5.377  -0.651
  273   1HG1  ILE  34          HG12      ILE  34  -3.145  -3.914   1.156
  274   2HG1  ILE  34          HG11      ILE  34  -3.250  -3.243  -0.466
  275   1HG2  ILE  34          HG21      ILE  34  -5.668  -3.576  -1.630
  276   2HG2  ILE  34          HG22      ILE  34  -6.577  -3.492  -0.120
  277   3HG2  ILE  34          HG23      ILE  34  -6.626  -4.959  -1.098
  278   1HD1  ILE  34          HD11      ILE  34  -3.919  -1.760   1.583
  279   2HD1  ILE  34          HD12      ILE  34  -5.420  -2.686   1.542
  280   3HD1  ILE  34          HD13      ILE  34  -4.933  -1.734   0.140
  281    H    ASN  35           HN       ASN  35  -4.603  -7.809   0.577
  282    HA   ASN  35           HA       ASN  35  -6.936  -8.759  -0.724
  283   1HB   ASN  35          HB2       ASN  35  -4.505  -9.652  -0.553
  284   2HB   ASN  35          HB1       ASN  35  -5.066 -10.476   0.900
  285   1HD2  ASN  35          HD21      ASN  35  -6.394  -9.939  -2.424
  286   2HD2  ASN  35          HD22      ASN  35  -6.857 -11.556  -2.652
  287    H    ASP  36           HN       ASP  36  -6.122  -8.571   2.693
  288    HA   ASP  36           HA       ASP  36  -8.312 -10.325   3.561
  289   1HB   ASP  36          HB2       ASP  36  -6.122 -10.085   4.729
  290   2HB   ASP  36          HB1       ASP  36  -6.515  -8.400   5.073
  291    H    ASN  37           HN       ASN  37  -7.585  -6.824   3.824
  292    HA   ASN  37           HA       ASN  37 -10.060  -6.038   5.016
  293   1HB   ASN  37          HB2       ASN  37  -8.165  -4.559   3.156
  294   2HB   ASN  37          HB1       ASN  37  -9.380  -3.792   4.185
  295   1HD2  ASN  37          HD21      ASN  37  -8.903  -3.552   6.429
  296   2HD2  ASN  37          HD22      ASN  37  -7.422  -4.038   7.122
  297    H    GLY  38           HN       GLY  38  -9.165  -6.689   1.674
  298   1HA   GLY  38          HA2       GLY  38 -10.627  -7.136  -0.139
  299   2HA   GLY  38          HA1       GLY  38 -11.991  -6.689   0.887
  300    H    ILE  39           HN       ILE  39  -9.169  -4.633   0.459
  301    HA   ILE  39           HA       ILE  39 -10.912  -2.674  -1.003
  302    HB   ILE  39           HB       ILE  39  -8.575  -2.249   0.893
  303   1HG1  ILE  39          HG12      ILE  39 -10.588  -3.083   2.046
  304   2HG1  ILE  39          HG11      ILE  39 -10.307  -1.386   2.445
  305   1HG2  ILE  39          HG21      ILE  39 -10.404  -0.329  -0.566
  306   2HG2  ILE  39          HG22      ILE  39  -8.645  -0.416  -0.650
  307   3HG2  ILE  39          HG23      ILE  39  -9.430   0.146   0.826
  308   1HD1  ILE  39          HD11      ILE  39 -12.475  -1.073   1.856
  309   2HD1  ILE  39          HD12      ILE  39 -12.561  -2.622   1.019
  310   3HD1  ILE  39          HD13      ILE  39 -11.902  -1.210   0.194
  311    H    ASP  40           HN       ASP  40 -10.037  -3.987  -2.941
  312    HA   ASP  40           HA       ASP  40  -7.315  -2.994  -3.729
  313   1HB   ASP  40          HB2       ASP  40  -8.750  -5.588  -3.918
  314   2HB   ASP  40          HB1       ASP  40  -7.807  -5.132  -5.342
  315    H    GLY  41           HN       GLY  41  -7.947  -1.124  -4.872
  316   1HA   GLY  41          HA2       GLY  41  -9.716  -1.605  -7.238
  317   2HA   GLY  41          HA1       GLY  41  -9.837  -0.123  -6.284
  318    H    GLU  42           HN       GLU  42  -8.014   1.365  -6.329
  319    HA   GLU  42           HA       GLU  42  -6.134   0.933  -8.626
  320   1HB   GLU  42          HB2       GLU  42  -8.280   2.861  -8.242
  321   2HB   GLU  42          HB1       GLU  42  -6.736   3.689  -8.439
  322   1HG   GLU  42          HG2       GLU  42  -6.410   2.876 -10.584
  323   2HG   GLU  42          HG1       GLU  42  -7.390   1.436 -10.301
  324    H    TRP  43           HN       TRP  43  -4.070   1.059  -7.874
  325    HA   TRP  43           HA       TRP  43  -3.502   2.539  -5.348
  326   1HB   TRP  43          HB2       TRP  43  -1.961   0.566  -7.065
  327   2HB   TRP  43          HB1       TRP  43  -1.280   1.343  -5.648
  328    HD1  TRP  43           HD1      TRP  43  -4.930   0.131  -5.634
  329    HE1  TRP  43           HE1      TRP  43  -5.115  -1.840  -4.003
  330    HE3  TRP  43           HE3      TRP  43  -0.013  -0.515  -4.498
  331    HZ2  TRP  43           HZ2      TRP  43  -3.413  -3.450  -2.382
  332    HZ3  TRP  43           HZ3      TRP  43   0.680  -2.269  -2.880
  333    HH2  TRP  43           HH2      TRP  43  -1.009  -3.729  -1.826
  334    H    THR  44           HN       THR  44  -1.361   3.778  -5.386
  335    HA   THR  44           HA       THR  44  -0.584   4.866  -8.035
  336    HB   THR  44           HB       THR  44  -0.953   7.172  -7.273
  337    HG1  THR  44           HG1      THR  44  -0.980   7.394  -5.199
  338   1HG2  THR  44          HG21      THR  44  -3.499   5.658  -6.700
  339   2HG2  THR  44          HG22      THR  44  -2.822   5.744  -8.326
  340   3HG2  THR  44          HG23      THR  44  -3.309   7.221  -7.494
  341    H    TYR  45           HN       TYR  45   1.606   5.156  -8.057
  342    HA   TYR  45           HA       TYR  45   3.078   4.856  -5.484
  343   1HB   TYR  45          HB2       TYR  45   3.516   3.324  -7.380
  344   2HB   TYR  45          HB1       TYR  45   3.945   4.701  -8.393
  345    HD1  TYR  45           HD1      TYR  45   4.775   3.782  -4.844
  346    HD2  TYR  45           HD2      TYR  45   6.241   4.725  -8.769
  347    HE1  TYR  45           HE1      TYR  45   7.103   3.683  -3.998
  348    HE2  TYR  45           HE2      TYR  45   8.568   4.630  -7.923
  349    HH   TYR  45           HH       TYR  45   9.813   3.623  -6.079
  350    H    ASP  46           HN       ASP  46   4.863   6.324  -5.018
  351    HA   ASP  46           HA       ASP  46   5.127   8.784  -6.642
  352   1HB   ASP  46          HB2       ASP  46   4.587  10.202  -4.660
  353   2HB   ASP  46          HB1       ASP  46   3.213   9.227  -5.175
  354    H    ASP  47           HN       ASP  47   7.254   9.355  -6.640
  355    HA   ASP  47           HA       ASP  47   9.143   7.983  -4.850
  356   1HB   ASP  47          HB2       ASP  47   9.378   8.421  -7.352
  357   2HB   ASP  47          HB1       ASP  47   9.657  10.114  -6.939
  358    H    ALA  48           HN       ALA  48   7.527  11.064  -4.943
  359    HA   ALA  48           HA       ALA  48   9.384  12.795  -3.694
  360   1HB   ALA  48          HB1       ALA  48   6.435  12.514  -3.941
  361   2HB   ALA  48          HB2       ALA  48   7.468  13.890  -4.329
  362   3HB   ALA  48          HB3       ALA  48   7.002  13.581  -2.656
  363    H    THR  49           HN       THR  49   7.463  10.181  -2.327
  364    HA   THR  49           HA       THR  49   8.983  10.372   0.201
  365    HB   THR  49           HB       THR  49   7.101  11.921   0.491
  366    HG1  THR  49           HG1      THR  49   6.375  11.042   2.360
  367   1HG2  THR  49          HG21      THR  49   4.762  10.737   0.533
  368   2HG2  THR  49          HG22      THR  49   5.534   9.577  -0.546
  369   3HG2  THR  49          HG23      THR  49   5.431  11.275  -1.007
  370    H    LYS  50           HN       LYS  50   8.652   8.435  -2.028
  371    HA   LYS  50           HA       LYS  50   8.082   6.180  -2.468
  372   1HB   LYS  50          HB2       LYS  50   9.317   4.770  -0.936
  373   2HB   LYS  50          HB1       LYS  50  10.186   6.287  -1.130
  374   1HG   LYS  50          HG2       LYS  50   8.240   6.173   1.122
  375   2HG   LYS  50          HG1       LYS  50   9.679   5.178   1.280
  376   1HD   LYS  50          HD2       LYS  50  10.141   7.939   0.304
  377   2HD   LYS  50          HD1       LYS  50   9.607   7.798   1.979
  378   1HE   LYS  50          HE2       LYS  50  11.504   5.808   1.845
  379   2HE   LYS  50          HE1       LYS  50  12.193   7.046   0.775
  380   1HZ   LYS  50          HZ1       LYS  50  11.869   8.700   2.461
  381   2HZ   LYS  50          HZ2       LYS  50  12.737   7.410   3.147
  382   3HZ   LYS  50          HZ3       LYS  50  11.080   7.593   3.475
  383    H    THR  51           HN       THR  51   5.749   7.535  -1.435
  384    HA   THR  51           HA       THR  51   4.530   5.606   0.472
  385    HB   THR  51           HB       THR  51   3.491   8.171  -0.780
  386    HG1  THR  51           HG1      THR  51   4.751   7.665   1.710
  387   1HG2  THR  51          HG21      THR  51   2.480   6.281   1.311
  388   2HG2  THR  51          HG22      THR  51   1.588   7.150   0.063
  389   3HG2  THR  51          HG23      THR  51   2.152   8.003   1.500
  390    H    TRP  52           HN       TRP  52   2.231   4.907  -0.094
  391    HA   TRP  52           HA       TRP  52   1.884   4.446  -3.036
  392   1HB   TRP  52          HB2       TRP  52   1.876   2.563  -0.685
  393   2HB   TRP  52          HB1       TRP  52   0.993   2.170  -2.156
  394    HD1  TRP  52           HD1      TRP  52   4.474   2.381  -0.733
  395    HE1  TRP  52           HE1      TRP  52   6.160   1.516  -2.486
  396    HE3  TRP  52           HE3      TRP  52   1.395   1.990  -4.749
  397    HZ2  TRP  52           HZ2      TRP  52   6.179   0.749  -5.253
  398    HZ3  TRP  52           HZ3      TRP  52   2.251   1.188  -6.939
  399    HH2  TRP  52           HH2      TRP  52   4.640   0.566  -7.193
  400    H    THR  53           HN       THR  53  -0.482   3.187  -3.092
  401    HA   THR  53           HA       THR  53  -2.422   4.372  -1.228
  402    HB   THR  53           HB       THR  53  -2.537   5.069  -4.173
  403    HG1  THR  53           HG1      THR  53  -1.519   6.557  -1.984
  404   1HG2  THR  53          HG21      THR  53  -4.044   5.885  -1.700
  405   2HG2  THR  53          HG22      THR  53  -4.679   5.327  -3.247
  406   3HG2  THR  53          HG23      THR  53  -3.989   6.944  -3.109
  407    H    VAL  54           HN       VAL  54  -4.716   3.718  -1.952
  408    HA   VAL  54           HA       VAL  54  -5.047   1.549  -3.853
  409    HB   VAL  54           HB       VAL  54  -3.803   0.296  -2.204
  410   1HG1  VAL  54          HG11      VAL  54  -3.744   1.419  -0.217
  411   2HG1  VAL  54          HG12      VAL  54  -5.008   0.261   0.191
  412   3HG1  VAL  54          HG13      VAL  54  -5.437   1.896  -0.310
  413   1HG2  VAL  54          HG21      VAL  54  -5.247  -1.471  -1.871
  414   2HG2  VAL  54          HG22      VAL  54  -6.224  -0.534  -3.009
  415   3HG2  VAL  54          HG23      VAL  54  -6.547  -0.433  -1.279
  416    H    THR  55           HN       THR  55  -6.779   3.065  -4.388
  417    HA   THR  55           HA       THR  55  -8.960   3.436  -2.415
  418    HB   THR  55           HB       THR  55  -8.836   4.317  -5.308
  419    HG1  THR  55           HG1      THR  55  -7.656   5.494  -3.014
  420   1HG2  THR  55          HG21      THR  55 -10.955   4.629  -4.055
  421   2HG2  THR  55          HG22      THR  55 -10.207   6.170  -4.475
  422   3HG2  THR  55          HG23      THR  55 -10.079   5.547  -2.831
  423    H    GLU  56           HN       GLU  56 -10.646   2.008  -2.345
  424    HA   GLU  56           HA       GLU  56 -10.928  -0.254  -4.066
  425   1HB   GLU  56          HB2       GLU  56 -11.880   0.417  -1.683
  426   2HB   GLU  56          HB1       GLU  56 -13.261   0.972  -2.629
  427   1HG   GLU  56          HG2       GLU  56 -12.913  -1.429  -3.784
  428   2HG   GLU  56          HG1       GLU  56 -12.256  -1.797  -2.188
  Start of MODEL   33
    1   1H    THR   1          HT1       THR   1  15.691   4.522   4.178
    2   2H    THR   1          HT2       THR   1  15.177   3.477   5.415
    3   3H    THR   1          HT3       THR   1  14.133   4.682   4.829
    4    HA   THR   1           HA       THR   1  14.155   3.567   2.621
    5    HB   THR   1           HB       THR   1  15.141   1.255   2.678
    6    HG1  THR   1           HG1      THR   1  15.045   1.012   4.948
    7   1HG2  THR   1          HG21      THR   1  16.378   3.450   2.014
    8   2HG2  THR   1          HG22      THR   1  17.332   1.990   2.272
    9   3HG2  THR   1          HG23      THR   1  17.251   3.224   3.530
   10    H    THR   2           HN       THR   2  12.027   4.043   3.883
   11    HA   THR   2           HA       THR   2  10.817   1.432   4.729
   12    HB   THR   2           HB       THR   2  10.251   4.164   5.917
   13    HG1  THR   2           HG1      THR   2  12.316   3.672   6.481
   14   1HG2  THR   2          HG21      THR   2   8.442   2.571   6.215
   15   2HG2  THR   2          HG22      THR   2   9.285   2.760   7.752
   16   3HG2  THR   2          HG23      THR   2   9.574   1.333   6.757
   17    H    PHE   3           HN       PHE   3   9.229   0.958   3.272
   18    HA   PHE   3           HA       PHE   3   8.039   3.005   1.546
   19   1HB   PHE   3          HB2       PHE   3   7.470   0.048   1.968
   20   2HB   PHE   3          HB1       PHE   3   6.861   1.016   0.625
   21    HD1  PHE   3           HD1      PHE   3   8.983   2.604  -0.336
   22    HD2  PHE   3           HD2      PHE   3   9.210  -1.362   1.305
   23    HE1  PHE   3           HE1      PHE   3  11.094   2.211  -1.575
   24    HE2  PHE   3           HE2      PHE   3  11.320  -1.753   0.064
   25    HZ   PHE   3           HZ       PHE   3  12.262   0.033  -1.374
   26    H    LYS   4           HN       LYS   4   5.693   3.409   1.468
   27    HA   LYS   4           HA       LYS   4   4.192   2.721   3.964
   28   1HB   LYS   4          HB2       LYS   4   5.367   4.979   4.059
   29   2HB   LYS   4          HB1       LYS   4   4.328   5.487   2.737
   30   1HG   LYS   4          HG2       LYS   4   2.333   4.963   4.097
   31   2HG   LYS   4          HG1       LYS   4   3.379   4.494   5.435
   32   1HD   LYS   4          HD2       LYS   4   3.879   6.648   5.976
   33   2HD   LYS   4          HD1       LYS   4   3.949   7.159   4.291
   34   1HE   LYS   4          HE2       LYS   4   1.907   8.111   4.561
   35   2HE   LYS   4          HE1       LYS   4   1.228   6.489   4.802
   36   1HZ   LYS   4          HZ1       LYS   4   2.440   8.240   6.876
   37   2HZ   LYS   4          HZ2       LYS   4   1.995   6.621   7.136
   38   3HZ   LYS   4          HZ3       LYS   4   0.811   7.781   6.762
   39    H    LEU   5           HN       LEU   5   1.927   2.636   3.664
   40    HA   LEU   5           HA       LEU   5   0.810   3.301   0.990
   41   1HB   LEU   5          HB2       LEU   5   1.725   0.816   1.378
   42   2HB   LEU   5          HB1       LEU   5   0.177   0.628   2.189
   43    HG   LEU   5           HG       LEU   5  -0.142   2.032  -0.347
   44   1HD1  LEU   5          HD11      LEU   5   1.909   0.447  -0.718
   45   2HD1  LEU   5          HD12      LEU   5   0.589   0.434  -1.894
   46   3HD1  LEU   5          HD13      LEU   5   0.698  -0.841  -0.670
   47   1HD2  LEU   5          HD21      LEU   5  -1.223  -0.528   0.862
   48   2HD2  LEU   5          HD22      LEU   5  -1.769   0.121  -0.684
   49   3HD2  LEU   5          HD23      LEU   5  -2.018   1.045   0.798
   50    H    ILE   6           HN       ILE   6  -1.296   4.028   1.185
   51    HA   ILE   6           HA       ILE   6  -2.509   3.951   3.918
   52    HB   ILE   6           HB       ILE   6  -2.832   5.783   1.524
   53   1HG1  ILE   6          HG12      ILE   6  -0.687   5.975   2.751
   54   2HG1  ILE   6          HG11      ILE   6  -1.677   7.420   2.950
   55   1HG2  ILE   6          HG21      ILE   6  -4.915   6.011   2.517
   56   2HG2  ILE   6          HG22      ILE   6  -3.994   7.192   3.447
   57   3HG2  ILE   6          HG23      ILE   6  -4.312   5.594   4.121
   58   1HD1  ILE   6          HD11      ILE   6  -2.459   5.722   5.045
   59   2HD1  ILE   6          HD12      ILE   6  -1.438   7.153   5.178
   60   3HD1  ILE   6          HD13      ILE   6  -0.705   5.564   4.966
   61    H    ILE   7           HN       ILE   7  -4.486   2.958   4.185
   62    HA   ILE   7           HA       ILE   7  -5.630   1.464   1.914
   63    HB   ILE   7           HB       ILE   7  -6.348   1.645   4.860
   64   1HG1  ILE   7          HG12      ILE   7  -4.776  -0.474   3.357
   65   2HG1  ILE   7          HG11      ILE   7  -4.041   0.792   4.341
   66   1HG2  ILE   7          HG21      ILE   7  -7.514  -0.513   4.432
   67   2HG2  ILE   7          HG22      ILE   7  -7.159  -0.342   2.713
   68   3HG2  ILE   7          HG23      ILE   7  -8.223   0.815   3.513
   69   1HD1  ILE   7          HD11      ILE   7  -5.782  -0.131   6.149
   70   2HD1  ILE   7          HD12      ILE   7  -4.190  -0.861   5.941
   71   3HD1  ILE   7          HD13      ILE   7  -5.605  -1.603   5.193
   72    H    ASN   8           HN       ASN   8  -7.117   2.472   0.635
   73    HA   ASN   8           HA       ASN   8  -8.914   4.534   1.863
   74   1HB   ASN   8          HB2       ASN   8  -7.723   4.082  -0.874
   75   2HB   ASN   8          HB1       ASN   8  -9.143   5.108  -0.676
   76   1HD2  ASN   8          HD21      ASN   8  -7.663   6.922  -1.393
   77   2HD2  ASN   8          HD22      ASN   8  -6.638   7.645  -0.237
   78    H    GLY   9           HN       GLY   9  -9.683   1.961   2.358
   79   1HA   GLY   9          HA2       GLY   9 -11.425   0.930   0.246
   80   2HA   GLY   9          HA1       GLY   9 -11.290   0.287   1.888
   81    H    LYS  10           HN       LYS  10 -13.755   0.830   0.420
   82    HA   LYS  10           HA       LYS  10 -15.068   3.224   1.091
   83   1HB   LYS  10          HB2       LYS  10 -16.084   0.374   0.887
   84   2HB   LYS  10          HB1       LYS  10 -17.121   1.801   0.866
   85   1HG   LYS  10          HG2       LYS  10 -15.785   2.640  -1.106
   86   2HG   LYS  10          HG1       LYS  10 -14.974   1.074  -1.144
   87   1HD   LYS  10          HD2       LYS  10 -16.686   0.566  -2.581
   88   2HD   LYS  10          HD1       LYS  10 -17.537   0.235  -1.072
   89   1HE   LYS  10          HE2       LYS  10 -18.039   2.868  -1.219
   90   2HE   LYS  10          HE1       LYS  10 -17.854   2.534  -2.952
   91   1HZ   LYS  10          HZ1       LYS  10 -19.540   0.937  -1.097
   92   2HZ   LYS  10          HZ2       LYS  10 -19.410   0.731  -2.779
   93   3HZ   LYS  10          HZ3       LYS  10 -20.138   2.129  -2.145
   94    H    THR  11           HN       THR  11 -14.385   0.400   3.082
   95    HA   THR  11           HA       THR  11 -15.676   1.784   5.414
   96    HB   THR  11           HB       THR  11 -15.387  -1.203   5.018
   97    HG1  THR  11           HG1      THR  11 -17.177  -1.203   3.883
   98   1HG2  THR  11          HG21      THR  11 -17.240   0.500   6.708
   99   2HG2  THR  11          HG22      THR  11 -15.846  -0.402   7.302
  100   3HG2  THR  11          HG23      THR  11 -17.239  -1.262   6.647
  101    H    LEU  12           HN       LEU  12 -13.102  -0.447   4.353
  102    HA   LEU  12           HA       LEU  12 -11.705  -0.249   6.948
  103   1HB   LEU  12          HB2       LEU  12 -11.115  -1.612   4.300
  104   2HB   LEU  12          HB1       LEU  12 -10.125  -1.797   5.748
  105    HG   LEU  12           HG       LEU  12 -13.085  -2.308   5.887
  106   1HD1  LEU  12          HD11      LEU  12 -10.946  -4.106   4.747
  107   2HD1  LEU  12          HD12      LEU  12 -12.541  -3.744   4.089
  108   3HD1  LEU  12          HD13      LEU  12 -12.387  -4.773   5.513
  109   1HD2  LEU  12          HD21      LEU  12 -10.640  -3.361   7.345
  110   2HD2  LEU  12          HD22      LEU  12 -12.293  -3.892   7.657
  111   3HD2  LEU  12          HD23      LEU  12 -11.828  -2.221   7.978
  112    H    LYS  13           HN       LYS  13  -9.736   0.857   7.249
  113    HA   LYS  13           HA       LYS  13  -8.407   2.216   4.995
  114   1HB   LYS  13          HB2       LYS  13 -10.195   3.538   7.006
  115   2HB   LYS  13          HB1       LYS  13  -8.781   4.422   6.431
  116   1HG   LYS  13          HG2       LYS  13  -9.705   3.549   4.065
  117   2HG   LYS  13          HG1       LYS  13 -11.230   3.595   4.950
  118   1HD   LYS  13          HD2       LYS  13  -9.294   5.920   4.910
  119   2HD   LYS  13          HD1       LYS  13 -10.604   5.748   3.741
  120   1HE   LYS  13          HE2       LYS  13 -11.254   5.515   6.666
  121   2HE   LYS  13          HE1       LYS  13 -11.019   7.126   5.958
  122   1HZ   LYS  13          HZ1       LYS  13 -12.554   6.482   4.167
  123   2HZ   LYS  13          HZ2       LYS  13 -13.309   6.467   5.689
  124   3HZ   LYS  13          HZ3       LYS  13 -12.846   5.008   4.953
  125    H    GLY  14           HN       GLY  14  -6.737   3.893   6.206
  126   1HA   GLY  14          HA2       GLY  14  -5.488   4.028   8.435
  127   2HA   GLY  14          HA1       GLY  14  -5.424   2.267   8.345
  128    H    GLU  15           HN       GLU  15  -3.006   3.087   8.531
  129    HA   GLU  15           HA       GLU  15  -1.924   3.345   5.742
  130   1HB   GLU  15          HB2       GLU  15  -0.086   4.649   6.810
  131   2HB   GLU  15          HB1       GLU  15  -1.661   5.397   7.072
  132   1HG   GLU  15          HG2       GLU  15  -1.789   4.469   9.316
  133   2HG   GLU  15          HG1       GLU  15  -0.302   3.555   9.062
  134    H    THR  16           HN       THR  16   0.301   2.377   5.524
  135    HA   THR  16           HA       THR  16   1.150   0.438   7.578
  136    HB   THR  16           HB       THR  16  -0.703  -0.716   6.453
  137    HG1  THR  16           HG1      THR  16   0.420  -2.533   5.991
  138   1HG2  THR  16          HG21      THR  16   0.867  -0.086   3.935
  139   2HG2  THR  16          HG22      THR  16  -0.768   0.441   4.337
  140   3HG2  THR  16          HG23      THR  16  -0.449  -1.260   4.002
  141    H    THR  17           HN       THR  17   3.319  -0.152   7.291
  142    HA   THR  17           HA       THR  17   4.666   0.777   4.776
  143    HB   THR  17           HB       THR  17   6.545   1.467   6.322
  144    HG1  THR  17           HG1      THR  17   6.208   1.425   8.458
  145   1HG2  THR  17          HG21      THR  17   4.951   3.356   7.406
  146   2HG2  THR  17          HG22      THR  17   3.854   2.712   6.186
  147   3HG2  THR  17          HG23      THR  17   5.421   3.362   5.707
  148    H    THR  18           HN       THR  18   6.668  -0.405   4.306
  149    HA   THR  18           HA       THR  18   7.097  -2.898   5.858
  150    HB   THR  18           HB       THR  18   5.809  -2.563   3.237
  151    HG1  THR  18           HG1      THR  18   5.003  -3.831   4.902
  152   1HG2  THR  18          HG21      THR  18   6.944  -4.377   2.056
  153   2HG2  THR  18          HG22      THR  18   8.119  -4.528   3.363
  154   3HG2  THR  18          HG23      THR  18   8.073  -3.061   2.383
  155    H    GLU  19           HN       GLU  19   9.225  -3.888   5.273
  156    HA   GLU  19           HA       GLU  19  11.177  -1.847   4.254
  157   1HB   GLU  19          HB2       GLU  19  11.107  -2.605   6.740
  158   2HB   GLU  19          HB1       GLU  19  11.775  -4.126   6.146
  159   1HG   GLU  19          HG2       GLU  19  13.434  -2.414   4.890
  160   2HG   GLU  19          HG1       GLU  19  13.039  -1.436   6.304
  161    H    ALA  20           HN       ALA  20  11.961  -2.477   2.273
  162    HA   ALA  20           HA       ALA  20  12.786  -5.290   1.852
  163   1HB   ALA  20          HB1       ALA  20  11.361  -5.078  -0.371
  164   2HB   ALA  20          HB2       ALA  20  10.459  -3.893   0.576
  165   3HB   ALA  20          HB3       ALA  20  10.585  -5.561   1.137
  166    H    VAL  21           HN       VAL  21  13.590  -5.433  -0.579
  167    HA   VAL  21           HA       VAL  21  15.782  -3.646  -0.935
  168    HB   VAL  21           HB       VAL  21  15.588  -5.929  -1.868
  169   1HG1  VAL  21          HG11      VAL  21  14.085  -6.520  -3.586
  170   2HG1  VAL  21          HG12      VAL  21  13.734  -4.837  -3.974
  171   3HG1  VAL  21          HG13      VAL  21  13.098  -5.550  -2.492
  172   1HG2  VAL  21          HG21      VAL  21  16.520  -5.463  -4.084
  173   2HG2  VAL  21          HG22      VAL  21  17.139  -4.297  -2.913
  174   3HG2  VAL  21          HG23      VAL  21  15.858  -3.829  -4.032
  175    H    ASP  22           HN       ASP  22  12.524  -3.654  -2.334
  176    HA   ASP  22           HA       ASP  22  12.831  -0.805  -3.087
  177   1HB   ASP  22          HB2       ASP  22  13.772  -2.192  -4.919
  178   2HB   ASP  22          HB1       ASP  22  12.244  -3.064  -5.026
  179    H    ALA  23           HN       ALA  23  10.717   0.143  -3.646
  180    HA   ALA  23           HA       ALA  23   8.533  -0.786  -2.052
  181   1HB   ALA  23          HB1       ALA  23   7.306   0.879  -3.696
  182   2HB   ALA  23          HB2       ALA  23   8.940   1.198  -4.277
  183   3HB   ALA  23          HB3       ALA  23   8.531   1.496  -2.587
  184    H    ALA  24           HN       ALA  24   9.477  -1.489  -5.365
  185    HA   ALA  24           HA       ALA  24   7.010  -2.514  -6.379
  186   1HB   ALA  24          HB1       ALA  24   8.905  -2.089  -7.815
  187   2HB   ALA  24          HB2       ALA  24   8.609  -3.827  -7.867
  188   3HB   ALA  24          HB3       ALA  24   9.925  -3.186  -6.883
  189    H    THR  25           HN       THR  25   9.692  -4.149  -4.680
  190    HA   THR  25           HA       THR  25   8.457  -6.757  -4.611
  191    HB   THR  25           HB       THR  25  10.641  -5.371  -3.019
  192    HG1  THR  25           HG1      THR  25  11.041  -5.814  -5.212
  193   1HG2  THR  25          HG21      THR  25   9.625  -7.196  -1.660
  194   2HG2  THR  25          HG22      THR  25  11.281  -7.569  -2.150
  195   3HG2  THR  25          HG23      THR  25   9.923  -8.320  -2.990
  196    H    ALA  26           HN       ALA  26   8.739  -4.152  -2.150
  197    HA   ALA  26           HA       ALA  26   7.264  -5.446  -0.094
  198   1HB   ALA  26          HB1       ALA  26   8.524  -3.488   0.419
  199   2HB   ALA  26          HB2       ALA  26   6.841  -2.984   0.595
  200   3HB   ALA  26          HB3       ALA  26   7.748  -2.558  -0.862
  201    H    GLU  27           HN       GLU  27   6.112  -2.949  -2.385
  202    HA   GLU  27           HA       GLU  27   3.436  -2.773  -1.814
  203   1HB   GLU  27          HB2       GLU  27   4.706  -1.585  -3.595
  204   2HB   GLU  27          HB1       GLU  27   4.660  -3.048  -4.578
  205   1HG   GLU  27          HG2       GLU  27   2.060  -2.886  -4.158
  206   2HG   GLU  27          HG1       GLU  27   2.424  -1.189  -3.845
  207    H    LYS  28           HN       LYS  28   4.948  -5.510  -3.525
  208    HA   LYS  28           HA       LYS  28   2.507  -6.823  -4.336
  209   1HB   LYS  28          HB2       LYS  28   5.242  -7.934  -3.576
  210   2HB   LYS  28          HB1       LYS  28   4.015  -8.797  -4.503
  211   1HG   LYS  28          HG2       LYS  28   4.311  -7.473  -6.391
  212   2HG   LYS  28          HG1       LYS  28   4.925  -6.105  -5.461
  213   1HD   LYS  28          HD2       LYS  28   6.929  -6.854  -6.312
  214   2HD   LYS  28          HD1       LYS  28   6.851  -7.886  -4.883
  215   1HE   LYS  28          HE2       LYS  28   5.516  -9.515  -6.466
  216   2HE   LYS  28          HE1       LYS  28   6.321  -8.600  -7.757
  217   1HZ   LYS  28          HZ1       LYS  28   7.701  -9.790  -5.409
  218   2HZ   LYS  28          HZ2       LYS  28   8.438  -8.981  -6.708
  219   3HZ   LYS  28          HZ3       LYS  28   7.676 -10.478  -6.959
  220    H    VAL  29           HN       VAL  29   4.589  -7.101  -1.456
  221    HA   VAL  29           HA       VAL  29   2.958  -9.038  -0.052
  222    HB   VAL  29           HB       VAL  29   5.087  -6.996   0.662
  223   1HG1  VAL  29          HG11      VAL  29   3.574  -7.174   2.626
  224   2HG1  VAL  29          HG12      VAL  29   5.155  -7.894   2.951
  225   3HG1  VAL  29          HG13      VAL  29   3.771  -8.930   2.601
  226   1HG2  VAL  29          HG21      VAL  29   5.391  -9.338  -0.526
  227   2HG2  VAL  29          HG22      VAL  29   5.246  -9.953   1.121
  228   3HG2  VAL  29          HG23      VAL  29   6.529  -8.814   0.715
  229    H    LEU  30           HN       LEU  30   3.036  -5.479  -0.210
  230    HA   LEU  30           HA       LEU  30   1.131  -5.014   1.881
  231   1HB   LEU  30          HB2       LEU  30   2.101  -3.506  -0.555
  232   2HB   LEU  30          HB1       LEU  30   0.875  -2.815   0.494
  233    HG   LEU  30           HG       LEU  30   3.416  -2.246   0.881
  234   1HD1  LEU  30          HD11      LEU  30   2.996  -2.096   3.352
  235   2HD1  LEU  30          HD12      LEU  30   1.484  -2.974   3.083
  236   3HD1  LEU  30          HD13      LEU  30   1.728  -1.390   2.343
  237   1HD2  LEU  30          HD21      LEU  30   4.413  -4.381   1.092
  238   2HD2  LEU  30          HD22      LEU  30   3.189  -4.943   2.228
  239   3HD2  LEU  30          HD23      LEU  30   4.349  -3.727   2.715
  240    H    LYS  31           HN       LYS  31   0.862  -5.825  -1.531
  241    HA   LYS  31           HA       LYS  31  -1.945  -5.304  -1.943
  242   1HB   LYS  31          HB2       LYS  31  -0.059  -5.978  -3.609
  243   2HB   LYS  31          HB1       LYS  31  -0.308  -7.603  -3.040
  244   1HG   LYS  31          HG2       LYS  31  -2.881  -6.917  -3.539
  245   2HG   LYS  31          HG1       LYS  31  -2.068  -5.920  -4.742
  246   1HD   LYS  31          HD2       LYS  31  -2.704  -8.178  -5.615
  247   2HD   LYS  31          HD1       LYS  31  -0.969  -7.877  -5.692
  248   1HE   LYS  31          HE2       LYS  31  -0.496  -9.348  -3.947
  249   2HE   LYS  31          HE1       LYS  31  -2.131  -9.242  -3.265
  250   1HZ   LYS  31          HZ1       LYS  31  -1.977 -11.301  -4.452
  251   2HZ   LYS  31          HZ2       LYS  31  -1.334 -10.534  -5.826
  252   3HZ   LYS  31          HZ3       LYS  31  -2.948 -10.259  -5.373
  253    H    GLN  32           HN       GLN  32  -0.113  -8.181  -0.992
  254    HA   GLN  32           HA       GLN  32  -2.185 -10.039  -0.572
  255   1HB   GLN  32          HB2       GLN  32   0.549  -9.519   0.491
  256   2HB   GLN  32          HB1       GLN  32  -0.442 -10.706   1.342
  257   1HG   GLN  32          HG2       GLN  32  -0.533 -12.148  -0.473
  258   2HG   GLN  32          HG1       GLN  32  -0.286 -10.850  -1.642
  259   1HE2  GLN  32          HE21      GLN  32   1.375 -13.029   0.608
  260   2HE2  GLN  32          HE22      GLN  32   2.948 -12.704   0.034
  261    H    TYR  33           HN       TYR  33  -0.921  -7.529   1.609
  262    HA   TYR  33           HA       TYR  33  -2.528  -8.153   3.923
  263   1HB   TYR  33          HB2       TYR  33  -0.536  -6.716   3.958
  264   2HB   TYR  33          HB1       TYR  33  -1.317  -5.566   2.873
  265    HD1  TYR  33           HD1      TYR  33  -1.482  -7.111   6.231
  266    HD2  TYR  33           HD2      TYR  33  -2.851  -3.935   3.692
  267    HE1  TYR  33           HE1      TYR  33  -2.518  -6.009   8.181
  268    HE2  TYR  33           HE2      TYR  33  -3.885  -2.820   5.648
  269    HH   TYR  33           HH       TYR  33  -3.145  -3.472   8.743
  270    H    ILE  34           HN       ILE  34  -3.014  -6.060   1.097
  271    HA   ILE  34           HA       ILE  34  -5.549  -4.934   1.886
  272    HB   ILE  34           HB       ILE  34  -4.287  -5.460  -0.823
  273   1HG1  ILE  34          HG12      ILE  34  -3.049  -4.065   1.007
  274   2HG1  ILE  34          HG11      ILE  34  -3.164  -3.406  -0.619
  275   1HG2  ILE  34          HG21      ILE  34  -6.807  -4.163  -0.029
  276   2HG2  ILE  34          HG22      ILE  34  -6.316  -4.816  -1.592
  277   3HG2  ILE  34          HG23      ILE  34  -5.803  -3.199  -1.113
  278   1HD1  ILE  34          HD11      ILE  34  -5.419  -2.703   1.155
  279   2HD1  ILE  34          HD12      ILE  34  -4.489  -1.686   0.055
  280   3HD1  ILE  34          HD13      ILE  34  -3.858  -2.055   1.661
  281    H    ASN  35           HN       ASN  35  -4.593  -7.993   0.458
  282    HA   ASN  35           HA       ASN  35  -6.972  -8.848  -0.803
  283   1HB   ASN  35          HB2       ASN  35  -4.659  -9.913  -0.702
  284   2HB   ASN  35          HB1       ASN  35  -5.117 -10.553   0.877
  285   1HD2  ASN  35          HD21      ASN  35  -5.282 -12.783   0.271
  286   2HD2  ASN  35          HD22      ASN  35  -6.427 -13.350  -0.846
  287    H    ASP  36           HN       ASP  36  -5.974  -9.494   2.589
  288    HA   ASP  36           HA       ASP  36  -8.412 -10.747   3.395
  289   1HB   ASP  36          HB2       ASP  36  -7.545 -10.251   5.680
  290   2HB   ASP  36          HB1       ASP  36  -6.295 -10.904   4.622
  291    H    ASN  37           HN       ASN  37  -7.580  -7.365   2.993
  292    HA   ASN  37           HA       ASN  37  -9.856  -6.382   4.582
  293   1HB   ASN  37          HB2       ASN  37  -7.875  -5.058   2.697
  294   2HB   ASN  37          HB1       ASN  37  -9.019  -4.190   3.726
  295   1HD2  ASN  37          HD21      ASN  37  -5.932  -4.404   3.775
  296   2HD2  ASN  37          HD22      ASN  37  -5.585  -4.826   5.391
  297    H    GLY  38           HN       GLY  38  -9.101  -7.078   1.215
  298   1HA   GLY  38          HA2       GLY  38 -10.584  -7.318  -0.606
  299   2HA   GLY  38          HA1       GLY  38 -11.917  -6.925   0.480
  300    H    ILE  39           HN       ILE  39  -9.063  -4.897   0.074
  301    HA   ILE  39           HA       ILE  39 -10.823  -2.806  -1.166
  302    HB   ILE  39           HB       ILE  39  -8.383  -2.551   0.627
  303   1HG1  ILE  39          HG12      ILE  39 -10.321  -3.440   1.852
  304   2HG1  ILE  39          HG11      ILE  39 -10.020  -1.766   2.327
  305   1HG2  ILE  39          HG21      ILE  39 -10.209  -0.551  -0.695
  306   2HG2  ILE  39          HG22      ILE  39  -8.446  -0.585  -0.668
  307   3HG2  ILE  39          HG23      ILE  39  -9.341  -0.146   0.786
  308   1HD1  ILE  39          HD11      ILE  39 -12.332  -2.929   0.902
  309   2HD1  ILE  39          HD12      ILE  39 -11.735  -1.416   0.220
  310   3HD1  ILE  39          HD13      ILE  39 -12.240  -1.484   1.909
  311    H    ASP  40           HN       ASP  40  -9.966  -4.198  -3.154
  312    HA   ASP  40           HA       ASP  40  -7.290  -3.163  -4.026
  313   1HB   ASP  40          HB2       ASP  40  -8.931  -5.631  -4.522
  314   2HB   ASP  40          HB1       ASP  40  -7.762  -5.124  -5.746
  315    H    GLY  41           HN       GLY  41  -7.577  -1.352  -5.285
  316   1HA   GLY  41          HA2       GLY  41  -9.512  -1.514  -7.530
  317   2HA   GLY  41          HA1       GLY  41  -9.647  -0.138  -6.431
  318    H    GLU  42           HN       GLU  42  -7.852   1.373  -6.330
  319    HA   GLU  42           HA       GLU  42  -5.905   1.162  -8.598
  320   1HB   GLU  42          HB2       GLU  42  -8.134   3.004  -8.165
  321   2HB   GLU  42          HB1       GLU  42  -6.608   3.868  -8.347
  322   1HG   GLU  42          HG2       GLU  42  -6.324   3.201 -10.523
  323   2HG   GLU  42          HG1       GLU  42  -7.116   1.647 -10.262
  324    H    TRP  43           HN       TRP  43  -3.880   1.328  -7.748
  325    HA   TRP  43           HA       TRP  43  -3.480   2.716  -5.140
  326   1HB   TRP  43          HB2       TRP  43  -1.766   0.912  -6.881
  327   2HB   TRP  43          HB1       TRP  43  -1.198   1.637  -5.388
  328    HD1  TRP  43           HD1      TRP  43  -4.781   0.264  -5.605
  329    HE1  TRP  43           HE1      TRP  43  -4.939  -1.817  -4.117
  330    HE3  TRP  43           HE3      TRP  43   0.115  -0.251  -4.312
  331    HZ2  TRP  43           HZ2      TRP  43  -3.230  -3.461  -2.541
  332    HZ3  TRP  43           HZ3      TRP  43   0.820  -2.079  -2.784
  333    HH2  TRP  43           HH2      TRP  43  -0.841  -3.677  -1.902
  334    H    THR  44           HN       THR  44  -1.450   4.098  -5.023
  335    HA   THR  44           HA       THR  44  -0.577   5.301  -7.589
  336    HB   THR  44           HB       THR  44  -1.148   7.559  -6.820
  337    HG1  THR  44           HG1      THR  44  -2.257   7.834  -4.902
  338   1HG2  THR  44          HG21      THR  44  -3.612   5.854  -6.450
  339   2HG2  THR  44          HG22      THR  44  -2.845   6.056  -8.025
  340   3HG2  THR  44          HG23      THR  44  -3.494   7.458  -7.174
  341    H    TYR  45           HN       TYR  45   1.576   5.697  -7.466
  342    HA   TYR  45           HA       TYR  45   2.956   5.350  -4.870
  343   1HB   TYR  45          HB2       TYR  45   3.709   4.139  -6.856
  344   2HB   TYR  45          HB1       TYR  45   3.860   5.644  -7.758
  345    HD1  TYR  45           HD1      TYR  45   6.080   6.197  -8.122
  346    HD2  TYR  45           HD2      TYR  45   4.941   4.533  -4.329
  347    HE1  TYR  45           HE1      TYR  45   8.405   6.464  -7.308
  348    HE2  TYR  45           HE2      TYR  45   7.270   4.800  -3.513
  349    HH   TYR  45           HH       TYR  45   9.875   5.494  -5.603
  350    H    ASP  46           HN       ASP  46   4.347   7.000  -3.990
  351    HA   ASP  46           HA       ASP  46   4.085   9.725  -5.224
  352   1HB   ASP  46          HB2       ASP  46   3.995   9.000  -2.272
  353   2HB   ASP  46          HB1       ASP  46   3.796  10.611  -2.954
  354    H    ASP  47           HN       ASP  47   6.039  10.715  -5.499
  355    HA   ASP  47           HA       ASP  47   8.509   9.395  -4.692
  356   1HB   ASP  47          HB2       ASP  47   9.517  11.350  -5.849
  357   2HB   ASP  47          HB1       ASP  47   8.237  10.613  -6.811
  358    H    ALA  48           HN       ALA  48   6.386  11.369  -2.957
  359    HA   ALA  48           HA       ALA  48   8.017  13.224  -1.578
  360   1HB   ALA  48          HB1       ALA  48   5.497  11.691  -1.089
  361   2HB   ALA  48          HB2       ALA  48   5.754  13.437  -1.140
  362   3HB   ALA  48          HB3       ALA  48   6.220  12.519   0.292
  363    H    THR  49           HN       THR  49   6.905  10.174  -0.097
  364    HA   THR  49           HA       THR  49   9.653   9.760   1.029
  365    HB   THR  49           HB       THR  49   8.142  10.860   2.660
  366    HG1  THR  49           HG1      THR  49   9.145   9.639   4.013
  367   1HG2  THR  49          HG21      THR  49   6.398   8.436   2.145
  368   2HG2  THR  49          HG22      THR  49   5.997  10.114   1.776
  369   3HG2  THR  49          HG23      THR  49   6.139   9.590   3.455
  370    H    LYS  50           HN       LYS  50   8.356   8.480  -1.260
  371    HA   LYS  50           HA       LYS  50   8.014   6.324  -2.134
  372   1HB   LYS  50          HB2       LYS  50   9.205   5.415   0.506
  373   2HB   LYS  50          HB1       LYS  50   9.220   4.537  -1.019
  374   1HG   LYS  50          HG2       LYS  50  10.577   7.214  -0.586
  375   2HG   LYS  50          HG1       LYS  50  11.403   5.658  -0.501
  376   1HD   LYS  50          HD2       LYS  50   9.857   6.627  -2.920
  377   2HD   LYS  50          HD1       LYS  50  11.605   6.777  -2.740
  378   1HE   LYS  50          HE2       LYS  50  11.297   4.132  -2.165
  379   2HE   LYS  50          HE1       LYS  50   9.980   4.367  -3.331
  380   1HZ   LYS  50          HZ1       LYS  50  11.899   3.958  -4.614
  381   2HZ   LYS  50          HZ2       LYS  50  12.856   5.004  -3.678
  382   3HZ   LYS  50          HZ3       LYS  50  11.655   5.634  -4.703
  383    H    THR  51           HN       THR  51   5.754   7.437  -1.028
  384    HA   THR  51           HA       THR  51   4.538   5.451   0.814
  385    HB   THR  51           HB       THR  51   3.057   7.770  -0.378
  386    HG1  THR  51           HG1      THR  51   4.301   9.216   0.499
  387   1HG2  THR  51          HG21      THR  51   2.668   5.986   1.753
  388   2HG2  THR  51          HG22      THR  51   1.738   7.446   1.416
  389   3HG2  THR  51          HG23      THR  51   3.115   7.514   2.514
  390    H    TRP  52           HN       TRP  52   1.958   5.310   0.037
  391    HA   TRP  52           HA       TRP  52   1.750   4.706  -2.849
  392   1HB   TRP  52          HB2       TRP  52   1.837   2.694  -0.605
  393   2HB   TRP  52          HB1       TRP  52   0.969   2.347  -2.097
  394    HD1  TRP  52           HD1      TRP  52   4.438   2.625  -0.664
  395    HE1  TRP  52           HE1      TRP  52   6.159   1.958  -2.470
  396    HE3  TRP  52           HE3      TRP  52   1.368   2.350  -4.689
  397    HZ2  TRP  52           HZ2      TRP  52   6.204   1.374  -5.284
  398    HZ3  TRP  52           HZ3      TRP  52   2.250   1.735  -6.931
  399    HH2  TRP  52           HH2      TRP  52   4.665   1.244  -7.229
  400    H    THR  53           HN       THR  53  -0.567   3.336  -2.932
  401    HA   THR  53           HA       THR  53  -2.535   4.351  -1.001
  402    HB   THR  53           HB       THR  53  -2.669   5.216  -3.904
  403    HG1  THR  53           HG1      THR  53  -1.097   6.476  -3.244
  404   1HG2  THR  53          HG21      THR  53  -4.832   5.380  -3.079
  405   2HG2  THR  53          HG22      THR  53  -4.196   6.970  -2.658
  406   3HG2  THR  53          HG23      THR  53  -4.289   5.705  -1.433
  407    H    VAL  54           HN       VAL  54  -4.812   3.650  -1.756
  408    HA   VAL  54           HA       VAL  54  -5.054   1.563  -3.767
  409    HB   VAL  54           HB       VAL  54  -3.766   0.318  -2.126
  410   1HG1  VAL  54          HG11      VAL  54  -5.230   0.147   0.197
  411   2HG1  VAL  54          HG12      VAL  54  -5.443   1.836  -0.255
  412   3HG1  VAL  54          HG13      VAL  54  -3.823   1.179  -0.042
  413   1HG2  VAL  54          HG21      VAL  54  -5.112  -1.544  -1.976
  414   2HG2  VAL  54          HG22      VAL  54  -6.111  -0.591  -3.081
  415   3HG2  VAL  54          HG23      VAL  54  -6.490  -0.628  -1.359
  416    H    THR  55           HN       THR  55  -6.845   3.032  -4.251
  417    HA   THR  55           HA       THR  55  -9.032   3.284  -2.276
  418    HB   THR  55           HB       THR  55  -8.996   4.163  -5.169
  419    HG1  THR  55           HG1      THR  55  -7.916   6.004  -4.474
  420   1HG2  THR  55          HG21      THR  55 -10.232   5.292  -2.641
  421   2HG2  THR  55          HG22      THR  55 -11.092   4.446  -3.928
  422   3HG2  THR  55          HG23      THR  55 -10.357   6.018  -4.244
  423    H    GLU  56           HN       GLU  56 -10.693   1.823  -2.207
  424    HA   GLU  56           HA       GLU  56 -10.886  -0.475  -3.889
  425   1HB   GLU  56          HB2       GLU  56 -11.876   0.156  -1.535
  426   2HB   GLU  56          HB1       GLU  56 -13.247   0.745  -2.476
  427   1HG   GLU  56          HG2       GLU  56 -12.119  -2.008  -2.955
  428   2HG   GLU  56          HG1       GLU  56 -13.295  -1.724  -1.671
  Start of MODEL   34
    1   1H    THR   1          HT1       THR   1  15.791   2.627   3.178
    2   2H    THR   1          HT2       THR   1  14.852   1.254   3.526
    3   3H    THR   1          HT3       THR   1  14.750   2.631   4.517
    4    HA   THR   1           HA       THR   1  13.865   3.898   2.583
    5    HB   THR   1           HB       THR   1  13.658   1.124   1.386
    6    HG1  THR   1           HG1      THR   1  15.509   1.522   0.319
    7   1HG2  THR   1          HG21      THR   1  13.528   2.671  -0.710
    8   2HG2  THR   1          HG22      THR   1  13.156   3.940   0.457
    9   3HG2  THR   1          HG23      THR   1  12.108   2.527   0.326
   10    H    THR   2           HN       THR   2  11.976   4.361   3.642
   11    HA   THR   2           HA       THR   2  10.264   2.123   4.629
   12    HB   THR   2           HB       THR   2   9.991   5.086   5.168
   13    HG1  THR   2           HG1      THR   2  12.066   4.637   5.726
   14   1HG2  THR   2          HG21      THR   2   9.378   3.782   7.462
   15   2HG2  THR   2          HG22      THR   2   8.924   2.554   6.282
   16   3HG2  THR   2          HG23      THR   2   8.188   4.155   6.216
   17    H    PHE   3           HN       PHE   3   9.128   1.551   2.723
   18    HA   PHE   3           HA       PHE   3   8.002   3.373   0.826
   19   1HB   PHE   3          HB2       PHE   3   7.204   0.576   1.702
   20   2HB   PHE   3          HB1       PHE   3   6.634   1.360   0.227
   21    HD1  PHE   3           HD1      PHE   3   8.703   2.561  -1.116
   22    HD2  PHE   3           HD2      PHE   3   8.981  -0.915   1.401
   23    HE1  PHE   3           HE1      PHE   3  10.777   1.875  -2.288
   24    HE2  PHE   3           HE2      PHE   3  11.053  -1.597   0.225
   25    HZ   PHE   3           HZ       PHE   3  11.952  -0.202  -1.617
   26    H    LYS   4           HN       LYS   4   5.520   3.566   0.533
   27    HA   LYS   4           HA       LYS   4   4.065   3.741   3.137
   28   1HB   LYS   4          HB2       LYS   4   5.364   5.883   2.169
   29   2HB   LYS   4          HB1       LYS   4   3.888   6.023   1.217
   30   1HG   LYS   4          HG2       LYS   4   2.620   5.756   3.431
   31   2HG   LYS   4          HG1       LYS   4   4.171   6.037   4.220
   32   1HD   LYS   4          HD2       LYS   4   3.572   8.228   4.077
   33   2HD   LYS   4          HD1       LYS   4   4.165   8.076   2.423
   34   1HE   LYS   4          HE2       LYS   4   2.060   8.203   1.533
   35   2HE   LYS   4          HE1       LYS   4   1.354   7.212   2.825
   36   1HZ   LYS   4          HZ1       LYS   4   1.567   9.068   4.342
   37   2HZ   LYS   4          HZ2       LYS   4   0.650   9.538   2.991
   38   3HZ   LYS   4          HZ3       LYS   4   2.273  10.023   3.131
   39    H    LEU   5           HN       LEU   5   1.816   3.487   2.907
   40    HA   LEU   5           HA       LEU   5   0.636   3.446   0.180
   41   1HB   LEU   5          HB2       LEU   5   1.618   1.147   1.107
   42   2HB   LEU   5          HB1       LEU   5   0.109   1.127   2.009
   43    HG   LEU   5           HG       LEU   5  -0.336   1.876  -0.778
   44   1HD1  LEU   5          HD11      LEU   5   1.722   0.243  -0.813
   45   2HD1  LEU   5          HD12      LEU   5   0.372  -0.035  -1.920
   46   3HD1  LEU   5          HD13      LEU   5   0.512  -0.989  -0.435
   47   1HD2  LEU   5          HD21      LEU   5  -1.396  -0.049   1.255
   48   2HD2  LEU   5          HD22      LEU   5  -1.791  -0.324  -0.442
   49   3HD2  LEU   5          HD23      LEU   5  -2.247   1.192   0.336
   50    H    ILE   6           HN       ILE   6  -1.402   4.298   0.254
   51    HA   ILE   6           HA       ILE   6  -2.603   4.832   2.931
   52    HB   ILE   6           HB       ILE   6  -2.997   5.980   0.154
   53   1HG1  ILE   6          HG12      ILE   6  -0.847   6.519   1.267
   54   2HG1  ILE   6          HG11      ILE   6  -1.865   7.948   1.092
   55   1HG2  ILE   6          HG21      ILE   6  -5.090   6.345   1.139
   56   2HG2  ILE   6          HG22      ILE   6  -4.210   7.808   1.583
   57   3HG2  ILE   6          HG23      ILE   6  -4.409   6.509   2.758
   58   1HD1  ILE   6          HD11      ILE   6  -2.597   6.832   3.566
   59   2HD1  ILE   6          HD12      ILE   6  -1.621   8.278   3.310
   60   3HD1  ILE   6          HD13      ILE   6  -0.839   6.710   3.510
   61    H    ILE   7           HN       ILE   7  -4.445   3.767   3.522
   62    HA   ILE   7           HA       ILE   7  -5.655   1.798   1.704
   63    HB   ILE   7           HB       ILE   7  -6.292   2.664   4.545
   64   1HG1  ILE   7          HG12      ILE   7  -3.990   1.807   4.300
   65   2HG1  ILE   7          HG11      ILE   7  -4.987   0.668   5.200
   66   1HG2  ILE   7          HG21      ILE   7  -8.190   1.481   3.926
   67   2HG2  ILE   7          HG22      ILE   7  -7.162   0.164   4.490
   68   3HG2  ILE   7          HG23      ILE   7  -7.316   0.484   2.763
   69   1HD1  ILE   7          HD11      ILE   7  -4.181   0.485   2.284
   70   2HD1  ILE   7          HD12      ILE   7  -5.380  -0.571   3.031
   71   3HD1  ILE   7          HD13      ILE   7  -3.708  -0.601   3.591
   72    H    ASN   8           HN       ASN   8  -7.300   2.369   0.346
   73    HA   ASN   8           HA       ASN   8  -9.060   4.675   1.113
   74   1HB   ASN   8          HB2       ASN   8  -7.878   3.661  -1.460
   75   2HB   ASN   8          HB1       ASN   8  -9.378   4.587  -1.508
   76   1HD2  ASN   8          HD21      ASN   8  -8.087   6.314  -2.638
   77   2HD2  ASN   8          HD22      ASN   8  -7.115   7.363  -1.709
   78    H    GLY   9           HN       GLY   9  -9.800   2.303   2.218
   79   1HA   GLY   9          HA2       GLY   9 -11.587   0.813   0.430
   80   2HA   GLY   9          HA1       GLY   9 -11.370   0.523   2.161
   81    H    LYS  10           HN       LYS  10 -13.865   0.869   0.520
   82    HA   LYS  10           HA       LYS  10 -15.159   3.332   0.922
   83   1HB   LYS  10          HB2       LYS  10 -16.233   0.498   1.025
   84   2HB   LYS  10          HB1       LYS  10 -17.222   1.938   0.779
   85   1HG   LYS  10          HG2       LYS  10 -15.583   2.437  -1.189
   86   2HG   LYS  10          HG1       LYS  10 -15.167   0.727  -1.059
   87   1HD   LYS  10          HD2       LYS  10 -17.222   0.026  -1.806
   88   2HD   LYS  10          HD1       LYS  10 -18.067   1.398  -1.087
   89   1HE   LYS  10          HE2       LYS  10 -17.650   2.786  -2.911
   90   2HE   LYS  10          HE1       LYS  10 -16.185   1.900  -3.378
   91   1HZ   LYS  10          HZ1       LYS  10 -18.182   1.437  -4.795
   92   2HZ   LYS  10          HZ2       LYS  10 -18.900   0.705  -3.440
   93   3HZ   LYS  10          HZ3       LYS  10 -17.471   0.063  -4.098
   94    H    THR  11           HN       THR  11 -14.604   0.684   3.191
   95    HA   THR  11           HA       THR  11 -16.019   2.242   5.330
   96    HB   THR  11           HB       THR  11 -15.298  -0.698   5.325
   97    HG1  THR  11           HG1      THR  11 -17.311  -1.067   4.449
   98   1HG2  THR  11          HG21      THR  11 -15.917   0.140   7.493
   99   2HG2  THR  11          HG22      THR  11 -17.305  -0.748   6.863
  100   3HG2  THR  11          HG23      THR  11 -17.294   1.015   6.821
  101    H    LEU  12           HN       LEU  12 -13.036   0.589   4.419
  102    HA   LEU  12           HA       LEU  12 -11.796   1.289   7.047
  103   1HB   LEU  12          HB2       LEU  12 -11.016  -0.532   4.749
  104   2HB   LEU  12          HB1       LEU  12 -10.018  -0.283   6.182
  105    HG   LEU  12           HG       LEU  12 -12.883  -1.015   6.601
  106   1HD1  LEU  12          HD11      LEU  12 -12.690  -3.214   5.958
  107   2HD1  LEU  12          HD12      LEU  12 -10.952  -3.257   6.256
  108   3HD1  LEU  12          HD13      LEU  12 -11.576  -2.510   4.786
  109   1HD2  LEU  12          HD21      LEU  12 -11.543  -2.461   8.359
  110   2HD2  LEU  12          HD22      LEU  12 -11.743  -0.727   8.616
  111   3HD2  LEU  12          HD23      LEU  12 -10.228  -1.354   7.965
  112    H    LYS  13           HN       LYS  13  -9.649   2.312   7.000
  113    HA   LYS  13           HA       LYS  13  -8.577   3.457   4.544
  114   1HB   LYS  13          HB2       LYS  13 -10.784   4.722   5.627
  115   2HB   LYS  13          HB1       LYS  13  -9.450   5.626   6.344
  116   1HG   LYS  13          HG2       LYS  13  -8.587   6.253   4.232
  117   2HG   LYS  13          HG1       LYS  13  -9.521   5.017   3.389
  118   1HD   LYS  13          HD2       LYS  13 -10.785   6.919   2.934
  119   2HD   LYS  13          HD1       LYS  13 -11.586   6.316   4.385
  120   1HE   LYS  13          HE2       LYS  13  -9.835   7.828   5.648
  121   2HE   LYS  13          HE1       LYS  13  -9.740   8.672   4.090
  122   1HZ   LYS  13          HZ1       LYS  13 -11.523   9.642   5.313
  123   2HZ   LYS  13          HZ2       LYS  13 -12.181   8.121   5.689
  124   3HZ   LYS  13          HZ3       LYS  13 -12.216   8.693   4.090
  125    H    GLY  14           HN       GLY  14  -6.839   5.199   5.216
  126   1HA   GLY  14          HA2       GLY  14  -5.588   5.922   7.362
  127   2HA   GLY  14          HA1       GLY  14  -5.476   4.190   7.671
  128    H    GLU  15           HN       GLU  15  -3.084   4.942   7.623
  129    HA   GLU  15           HA       GLU  15  -2.052   4.600   4.828
  130   1HB   GLU  15          HB2       GLU  15  -0.271   6.220   5.462
  131   2HB   GLU  15          HB1       GLU  15  -1.876   6.940   5.578
  132   1HG   GLU  15          HG2       GLU  15  -1.894   6.491   8.014
  133   2HG   GLU  15          HG1       GLU  15  -0.274   5.804   7.892
  134    H    THR  16           HN       THR  16   0.216   3.704   4.818
  135    HA   THR  16           HA       THR  16   1.147   2.388   7.294
  136    HB   THR  16           HB       THR  16  -0.627   0.899   6.479
  137    HG1  THR  16           HG1      THR  16   0.827  -0.420   7.244
  138   1HG2  THR  16          HG21      THR  16   0.921   1.086   3.887
  139   2HG2  THR  16          HG22      THR  16  -0.790   1.413   4.166
  140   3HG2  THR  16          HG23      THR  16  -0.190  -0.243   4.222
  141    H    THR  17           HN       THR  17   3.285   1.459   7.035
  142    HA   THR  17           HA       THR  17   4.667   2.025   4.443
  143    HB   THR  17           HB       THR  17   6.469   3.131   5.712
  144    HG1  THR  17           HG1      THR  17   4.740   2.652   7.907
  145   1HG2  THR  17          HG21      THR  17   4.064   4.231   5.074
  146   2HG2  THR  17          HG22      THR  17   5.408   5.148   5.753
  147   3HG2  THR  17          HG23      THR  17   4.120   4.562   6.805
  148    H    THR  18           HN       THR  18   6.696   0.805   4.238
  149    HA   THR  18           HA       THR  18   7.171  -1.296   6.270
  150    HB   THR  18           HB       THR  18   5.847  -1.572   3.656
  151    HG1  THR  18           HG1      THR  18   5.121  -2.431   5.630
  152   1HG2  THR  18          HG21      THR  18   8.212  -3.396   4.199
  153   2HG2  THR  18          HG22      THR  18   8.092  -2.217   2.892
  154   3HG2  THR  18          HG23      THR  18   7.007  -3.609   2.927
  155    H    GLU  19           HN       GLU  19   9.317  -2.314   5.936
  156    HA   GLU  19           HA       GLU  19  11.207  -0.541   4.420
  157   1HB   GLU  19          HB2       GLU  19  11.175  -0.698   7.022
  158   2HB   GLU  19          HB1       GLU  19  11.896  -2.290   6.783
  159   1HG   GLU  19          HG2       GLU  19  13.479  -0.871   5.139
  160   2HG   GLU  19          HG1       GLU  19  13.052   0.408   6.277
  161    H    ALA  20           HN       ALA  20  11.975  -1.607   2.632
  162    HA   ALA  20           HA       ALA  20  12.866  -4.421   2.875
  163   1HB   ALA  20          HB1       ALA  20  11.399  -4.763   0.689
  164   2HB   ALA  20          HB2       ALA  20  10.478  -3.419   1.367
  165   3HB   ALA  20          HB3       ALA  20  10.668  -4.912   2.288
  166    H    VAL  21           HN       VAL  21  13.692  -5.132   0.582
  167    HA   VAL  21           HA       VAL  21  15.795  -3.403  -0.256
  168    HB   VAL  21           HB       VAL  21  15.713  -5.856  -0.555
  169   1HG1  VAL  21          HG11      VAL  21  14.239  -6.949  -2.032
  170   2HG1  VAL  21          HG12      VAL  21  13.810  -5.449  -2.852
  171   3HG1  VAL  21          HG13      VAL  21  13.206  -5.768  -1.226
  172   1HG2  VAL  21          HG21      VAL  21  15.945  -4.253  -3.111
  173   2HG2  VAL  21          HG22      VAL  21  16.490  -5.921  -2.944
  174   3HG2  VAL  21          HG23      VAL  21  17.246  -4.647  -1.987
  175    H    ASP  22           HN       ASP  22  12.542  -3.927  -1.573
  176    HA   ASP  22           HA       ASP  22  12.715  -1.361  -3.041
  177   1HB   ASP  22          HB2       ASP  22  13.744  -3.122  -4.458
  178   2HB   ASP  22          HB1       ASP  22  12.262  -4.069  -4.332
  179    H    ALA  23           HN       ALA  23  10.553  -0.733  -3.872
  180    HA   ALA  23           HA       ALA  23   8.404  -1.275  -2.071
  181   1HB   ALA  23          HB1       ALA  23   8.555  -0.143  -4.880
  182   2HB   ALA  23          HB2       ALA  23   8.487   0.756  -3.365
  183   3HB   ALA  23          HB3       ALA  23   7.072  -0.134  -3.926
  184    H    ALA  24           HN       ALA  24   9.434  -2.886  -5.019
  185    HA   ALA  24           HA       ALA  24   7.045  -4.292  -5.695
  186   1HB   ALA  24          HB1       ALA  24   8.756  -5.932  -6.667
  187   2HB   ALA  24          HB2       ALA  24  10.001  -4.916  -5.942
  188   3HB   ALA  24          HB3       ALA  24   8.935  -4.254  -7.182
  189    H    THR  25           HN       THR  25   9.757  -5.229  -3.563
  190    HA   THR  25           HA       THR  25   8.599  -7.732  -2.708
  191    HB   THR  25           HB       THR  25  10.731  -5.869  -1.613
  192    HG1  THR  25           HG1      THR  25  10.900  -8.407  -2.853
  193   1HG2  THR  25          HG21      THR  25   9.761  -7.231   0.233
  194   2HG2  THR  25          HG22      THR  25  11.429  -7.689  -0.129
  195   3HG2  THR  25          HG23      THR  25  10.097  -8.693  -0.701
  196    H    ALA  26           HN       ALA  26   8.786  -4.500  -1.143
  197    HA   ALA  26           HA       ALA  26   7.342  -5.161   1.213
  198   1HB   ALA  26          HB1       ALA  26   6.848  -2.636   1.168
  199   2HB   ALA  26          HB2       ALA  26   7.681  -2.612  -0.392
  200   3HB   ALA  26          HB3       ALA  26   8.550  -3.095   1.063
  201    H    GLU  27           HN       GLU  27   6.112  -3.487  -1.700
  202    HA   GLU  27           HA       GLU  27   3.428  -3.264  -1.194
  203   1HB   GLU  27          HB2       GLU  27   4.657  -2.586  -3.246
  204   2HB   GLU  27          HB1       GLU  27   4.692  -4.271  -3.765
  205   1HG   GLU  27          HG2       GLU  27   2.095  -4.154  -3.452
  206   2HG   GLU  27          HG1       GLU  27   2.339  -2.410  -3.554
  207    H    LYS  28           HN       LYS  28   5.058  -6.321  -2.035
  208    HA   LYS  28           HA       LYS  28   2.681  -7.906  -2.437
  209   1HB   LYS  28          HB2       LYS  28   5.447  -8.620  -1.381
  210   2HB   LYS  28          HB1       LYS  28   4.265  -9.784  -1.979
  211   1HG   LYS  28          HG2       LYS  28   4.496  -9.091  -4.188
  212   2HG   LYS  28          HG1       LYS  28   5.065  -7.485  -3.732
  213   1HD   LYS  28          HD2       LYS  28   7.095  -8.387  -4.330
  214   2HD   LYS  28          HD1       LYS  28   7.050  -8.952  -2.659
  215   1HE   LYS  28          HE2       LYS  28   6.474 -11.141  -3.276
  216   2HE   LYS  28          HE1       LYS  28   5.813 -10.627  -4.842
  217   1HZ   LYS  28          HZ1       LYS  28   8.670 -10.436  -4.042
  218   2HZ   LYS  28          HZ2       LYS  28   8.021  -9.979  -5.544
  219   3HZ   LYS  28          HZ3       LYS  28   8.029 -11.614  -5.081
  220    H    VAL  29           HN       VAL  29   4.711  -7.235   0.409
  221    HA   VAL  29           HA       VAL  29   3.117  -8.740   2.307
  222    HB   VAL  29           HB       VAL  29   5.187  -6.522   2.419
  223   1HG1  VAL  29          HG11      VAL  29   3.923  -7.900   4.813
  224   2HG1  VAL  29          HG12      VAL  29   3.665  -6.212   4.361
  225   3HG1  VAL  29          HG13      VAL  29   5.268  -6.759   4.864
  226   1HG2  VAL  29          HG21      VAL  29   5.819  -8.885   1.829
  227   2HG2  VAL  29          HG22      VAL  29   5.251  -9.380   3.424
  228   3HG2  VAL  29          HG23      VAL  29   6.617  -8.274   3.278
  229    H    LEU  30           HN       LEU  30   3.114  -5.369   1.142
  230    HA   LEU  30           HA       LEU  30   1.195  -4.384   3.032
  231   1HB   LEU  30          HB2       LEU  30   2.140  -3.582   0.271
  232   2HB   LEU  30          HB1       LEU  30   0.901  -2.654   1.098
  233    HG   LEU  30           HG       LEU  30   3.423  -1.943   1.305
  234   1HD1  LEU  30          HD11      LEU  30   1.521  -2.117   3.641
  235   2HD1  LEU  30          HD12      LEU  30   1.728  -0.773   2.515
  236   3HD1  LEU  30          HD13      LEU  30   3.015  -1.171   3.662
  237   1HD2  LEU  30          HD21      LEU  30   4.423  -2.865   3.424
  238   2HD2  LEU  30          HD22      LEU  30   4.455  -3.944   2.047
  239   3HD2  LEU  30          HD23      LEU  30   3.272  -4.182   3.329
  240    H    LYS  31           HN       LYS  31   0.956  -6.060  -0.056
  241    HA   LYS  31           HA       LYS  31  -1.869  -5.743  -0.548
  242   1HB   LYS  31          HB2       LYS  31   0.185  -6.806  -1.906
  243   2HB   LYS  31          HB1       LYS  31  -0.349  -8.272  -1.122
  244   1HG   LYS  31          HG2       LYS  31  -2.286  -6.490  -2.600
  245   2HG   LYS  31          HG1       LYS  31  -1.371  -7.747  -3.431
  246   1HD   LYS  31          HD2       LYS  31  -3.241  -8.169  -1.077
  247   2HD   LYS  31          HD1       LYS  31  -3.571  -8.608  -2.751
  248   1HE   LYS  31          HE2       LYS  31  -1.064  -9.777  -2.140
  249   2HE   LYS  31          HE1       LYS  31  -2.120 -10.117  -0.748
  250   1HZ   LYS  31          HZ1       LYS  31  -2.668 -10.663  -3.617
  251   2HZ   LYS  31          HZ2       LYS  31  -3.878 -10.705  -2.424
  252   3HZ   LYS  31          HZ3       LYS  31  -2.571 -11.788  -2.352
  253    H    GLN  32           HN       GLN  32   0.068  -8.152   1.190
  254    HA   GLN  32           HA       GLN  32  -1.984  -9.924   2.028
  255   1HB   GLN  32          HB2       GLN  32   0.725  -9.089   2.970
  256   2HB   GLN  32          HB1       GLN  32  -0.263 -10.082   4.043
  257   1HG   GLN  32          HG2       GLN  32  -0.562 -11.735   2.220
  258   2HG   GLN  32          HG1       GLN  32   0.477 -10.757   1.184
  259   1HE2  GLN  32          HE21      GLN  32   2.700 -11.159   1.318
  260   2HE2  GLN  32          HE22      GLN  32   3.444 -12.070   2.554
  261    H    TYR  33           HN       TYR  33  -0.816  -6.874   3.428
  262    HA   TYR  33           HA       TYR  33  -2.425  -6.911   5.834
  263   1HB   TYR  33          HB2       TYR  33  -0.472  -5.465   5.527
  264   2HB   TYR  33          HB1       TYR  33  -1.233  -4.678   4.144
  265    HD1  TYR  33           HD1      TYR  33  -1.484  -5.233   7.794
  266    HD2  TYR  33           HD2      TYR  33  -2.820  -2.920   4.435
  267    HE1  TYR  33           HE1      TYR  33  -2.601  -3.660   9.330
  268    HE2  TYR  33           HE2      TYR  33  -3.936  -1.332   5.975
  269    HH   TYR  33           HH       TYR  33  -4.803  -1.892   8.882
  270    H    ILE  34           HN       ILE  34  -2.921  -5.749   2.528
  271    HA   ILE  34           HA       ILE  34  -5.487  -4.483   2.963
  272    HB   ILE  34           HB       ILE  34  -4.139  -5.670   0.516
  273   1HG1  ILE  34          HG12      ILE  34  -2.978  -3.816   1.906
  274   2HG1  ILE  34          HG11      ILE  34  -3.124  -3.562   0.173
  275   1HG2  ILE  34          HG21      ILE  34  -5.620  -3.979  -0.701
  276   2HG2  ILE  34          HG22      ILE  34  -6.547  -3.867   0.795
  277   3HG2  ILE  34          HG23      ILE  34  -6.432  -5.407  -0.057
  278   1HD1  ILE  34          HD11      ILE  34  -3.720  -1.524   1.418
  279   2HD1  ILE  34          HD12      ILE  34  -4.957  -2.416   2.305
  280   3HD1  ILE  34          HD13      ILE  34  -5.128  -2.160   0.568
  281    H    ASN  35           HN       ASN  35  -4.426  -7.768   2.237
  282    HA   ASN  35           HA       ASN  35  -6.945  -8.885   1.433
  283   1HB   ASN  35          HB2       ASN  35  -4.329  -9.858   2.499
  284   2HB   ASN  35          HB1       ASN  35  -5.686 -10.981   2.439
  285   1HD2  ASN  35          HD21      ASN  35  -5.021 -12.259   0.641
  286   2HD2  ASN  35          HD22      ASN  35  -4.811 -11.625  -0.919
  287    H    ASP  36           HN       ASP  36  -5.546  -8.169   4.578
  288    HA   ASP  36           HA       ASP  36  -7.424  -9.766   6.129
  289   1HB   ASP  36          HB2       ASP  36  -5.025  -8.673   6.605
  290   2HB   ASP  36          HB1       ASP  36  -6.026  -7.362   7.231
  291    H    ASN  37           HN       ASN  37  -7.275  -6.400   5.022
  292    HA   ASN  37           HA       ASN  37  -9.672  -5.605   6.532
  293   1HB   ASN  37          HB2       ASN  37  -7.908  -4.303   4.433
  294   2HB   ASN  37          HB1       ASN  37  -9.259  -3.476   5.216
  295   1HD2  ASN  37          HD21      ASN  37  -6.341  -2.837   5.451
  296   2HD2  ASN  37          HD22      ASN  37  -5.978  -2.957   7.113
  297    H    GLY  38           HN       GLY  38  -8.821  -6.518   3.218
  298   1HA   GLY  38          HA2       GLY  38 -10.330  -7.462   1.619
  299   2HA   GLY  38          HA1       GLY  38 -11.684  -6.919   2.611
  300    H    ILE  39           HN       ILE  39  -9.017  -4.809   1.712
  301    HA   ILE  39           HA       ILE  39 -10.939  -3.212   0.053
  302    HB   ILE  39           HB       ILE  39  -8.470  -2.402   1.628
  303   1HG1  ILE  39          HG12      ILE  39 -10.341  -3.064   3.088
  304   2HG1  ILE  39          HG11      ILE  39 -10.101  -1.316   3.151
  305   1HG2  ILE  39          HG21      ILE  39  -9.422  -0.077   1.222
  306   2HG2  ILE  39          HG22      ILE  39 -10.488  -0.814   0.025
  307   3HG2  ILE  39          HG23      ILE  39  -8.739  -0.873  -0.196
  308   1HD1  ILE  39          HD11      ILE  39 -11.895  -1.196   1.289
  309   2HD1  ILE  39          HD12      ILE  39 -12.445  -1.567   2.923
  310   3HD1  ILE  39          HD13      ILE  39 -12.277  -2.859   1.734
  311    H    ASP  40           HN       ASP  40 -10.184  -4.819  -1.700
  312    HA   ASP  40           HA       ASP  40  -7.556  -3.959  -2.866
  313   1HB   ASP  40          HB2       ASP  40  -7.619  -6.205  -3.960
  314   2HB   ASP  40          HB1       ASP  40  -7.669  -6.320  -2.199
  315    H    GLY  41           HN       GLY  41  -7.957  -2.487  -4.475
  316   1HA   GLY  41          HA2       GLY  41 -10.006  -3.177  -6.516
  317   2HA   GLY  41          HA1       GLY  41 -10.089  -1.584  -5.759
  318    H    GLU  42           HN       GLU  42  -8.268  -0.116  -6.088
  319    HA   GLU  42           HA       GLU  42  -6.508  -0.839  -8.403
  320   1HB   GLU  42          HB2       GLU  42  -8.684   1.085  -8.206
  321   2HB   GLU  42          HB1       GLU  42  -7.173   1.900  -8.604
  322   1HG   GLU  42          HG2       GLU  42  -7.624   1.287 -10.740
  323   2HG   GLU  42          HG1       GLU  42  -7.063  -0.309 -10.243
  324    H    TRP  43           HN       TRP  43  -4.413  -0.545  -7.794
  325    HA   TRP  43           HA       TRP  43  -3.777   1.313  -5.548
  326   1HB   TRP  43          HB2       TRP  43  -2.262  -0.870  -7.013
  327   2HB   TRP  43          HB1       TRP  43  -1.532   0.139  -5.779
  328    HD1  TRP  43           HD1      TRP  43  -5.135  -1.160  -5.391
  329    HE1  TRP  43           HE1      TRP  43  -5.173  -2.839  -3.450
  330    HE3  TRP  43           HE3      TRP  43  -0.157  -1.435  -4.393
  331    HZ2  TRP  43           HZ2      TRP  43  -3.336  -4.096  -1.666
  332    HZ3  TRP  43           HZ3      TRP  43   0.675  -2.866  -2.540
  333    HH2  TRP  43           HH2      TRP  43  -0.900  -4.192  -1.184
  334    H    THR  44           HN       THR  44  -1.817   2.704  -5.856
  335    HA   THR  44           HA       THR  44  -1.040   3.291  -8.655
  336    HB   THR  44           HB       THR  44  -1.630   5.665  -8.406
  337    HG1  THR  44           HG1      THR  44  -2.685   6.363  -6.579
  338   1HG2  THR  44          HG21      THR  44  -3.317   3.930  -9.228
  339   2HG2  THR  44          HG22      THR  44  -3.991   5.456  -8.657
  340   3HG2  THR  44          HG23      THR  44  -4.047   4.027  -7.625
  341    H    TYR  45           HN       TYR  45   1.114   3.736  -8.683
  342    HA   TYR  45           HA       TYR  45   2.508   4.140  -6.084
  343   1HB   TYR  45          HB2       TYR  45   3.157   2.318  -7.650
  344   2HB   TYR  45          HB1       TYR  45   3.516   3.523  -8.884
  345    HD1  TYR  45           HD1      TYR  45   5.804   3.799  -9.167
  346    HD2  TYR  45           HD2      TYR  45   4.238   3.258  -5.204
  347    HE1  TYR  45           HE1      TYR  45   8.079   4.094  -8.228
  348    HE2  TYR  45           HE2      TYR  45   6.514   3.552  -4.265
  349    HH   TYR  45           HH       TYR  45   8.777   4.902  -5.322
  350    H    ASP  46           HN       ASP  46   4.229   5.834  -6.000
  351    HA   ASP  46           HA       ASP  46   4.057   7.975  -8.063
  352   1HB   ASP  46          HB2       ASP  46   3.673   8.488  -5.093
  353   2HB   ASP  46          HB1       ASP  46   3.562   9.671  -6.391
  354    H    ASP  47           HN       ASP  47   6.165   8.283  -8.602
  355    HA   ASP  47           HA       ASP  47   8.419   7.528  -6.992
  356   1HB   ASP  47          HB2       ASP  47   8.128   7.967  -9.547
  357   2HB   ASP  47          HB1       ASP  47   8.451   9.652  -9.134
  358    H    ALA  48           HN       ALA  48   6.360  10.307  -6.867
  359    HA   ALA  48           HA       ALA  48   7.970  12.438  -6.048
  360   1HB   ALA  48          HB1       ALA  48   5.669  12.831  -6.276
  361   2HB   ALA  48          HB2       ALA  48   5.861  12.853  -4.522
  362   3HB   ALA  48          HB3       ALA  48   5.235  11.408  -5.324
  363    H    THR  49           HN       THR  49   6.323  10.267  -3.731
  364    HA   THR  49           HA       THR  49   8.717  10.439  -1.936
  365    HB   THR  49           HB       THR  49   7.011  12.060  -1.229
  366    HG1  THR  49           HG1      THR  49   6.658  11.204   0.854
  367   1HG2  THR  49          HG21      THR  49   4.885  11.553  -1.826
  368   2HG2  THR  49          HG22      THR  49   4.844  10.589  -0.351
  369   3HG2  THR  49          HG23      THR  49   5.226   9.823  -1.894
  370    H    LYS  50           HN       LYS  50   8.140   8.289  -3.658
  371    HA   LYS  50           HA       LYS  50   7.585   5.997  -3.766
  372   1HB   LYS  50          HB2       LYS  50   8.823   4.787  -2.030
  373   2HB   LYS  50          HB1       LYS  50   9.735   6.195  -2.565
  374   1HG   LYS  50          HG2       LYS  50   9.211   7.417  -0.598
  375   2HG   LYS  50          HG1       LYS  50   7.921   6.300  -0.152
  376   1HD   LYS  50          HD2       LYS  50   9.611   5.554   1.250
  377   2HD   LYS  50          HD1       LYS  50   9.893   4.531  -0.158
  378   1HE   LYS  50          HE2       LYS  50  11.990   5.377  -0.310
  379   2HE   LYS  50          HE1       LYS  50  11.299   6.984  -0.607
  380   1HZ   LYS  50          HZ1       LYS  50  12.633   7.021   1.398
  381   2HZ   LYS  50          HZ2       LYS  50  11.744   5.730   2.054
  382   3HZ   LYS  50          HZ3       LYS  50  10.998   7.236   1.797
  383    H    THR  51           HN       THR  51   5.231   7.311  -3.056
  384    HA   THR  51           HA       THR  51   4.106   5.792  -0.749
  385    HB   THR  51           HB       THR  51   3.055   8.089  -2.437
  386    HG1  THR  51           HG1      THR  51   4.170   7.946   0.165
  387   1HG2  THR  51          HG21      THR  51   1.492   8.280  -0.373
  388   2HG2  THR  51          HG22      THR  51   1.934   6.599  -0.067
  389   3HG2  THR  51          HG23      THR  51   1.129   7.040  -1.573
  390    H    TRP  52           HN       TRP  52   1.860   4.896  -1.112
  391    HA   TRP  52           HA       TRP  52   1.466   3.880  -3.906
  392   1HB   TRP  52          HB2       TRP  52   1.621   2.479  -1.244
  393   2HB   TRP  52          HB1       TRP  52   0.722   1.770  -2.580
  394    HD1  TRP  52           HD1      TRP  52   4.219   2.389  -1.339
  395    HE1  TRP  52           HE1      TRP  52   5.901   1.291  -2.963
  396    HE3  TRP  52           HE3      TRP  52   1.068   1.165  -5.114
  397    HZ2  TRP  52           HZ2      TRP  52   5.887   0.040  -5.548
  398    HZ3  TRP  52           HZ3      TRP  52   1.900   0.014  -7.155
  399    HH2  TRP  52           HH2      TRP  52   4.308  -0.549  -7.373
  400    H    THR  53           HN       THR  53  -0.835   2.487  -3.590
  401    HA   THR  53           HA       THR  53  -2.793   3.925  -1.939
  402    HB   THR  53           HB       THR  53  -3.001   4.034  -4.961
  403    HG1  THR  53           HG1      THR  53  -2.050   5.954  -3.107
  404   1HG2  THR  53          HG21      THR  53  -5.149   4.334  -4.099
  405   2HG2  THR  53          HG22      THR  53  -4.560   5.993  -4.198
  406   3HG2  THR  53          HG23      THR  53  -4.560   5.149  -2.650
  407    H    VAL  54           HN       VAL  54  -5.061   3.010  -2.422
  408    HA   VAL  54           HA       VAL  54  -5.312   0.509  -3.878
  409    HB   VAL  54           HB       VAL  54  -3.930  -0.328  -2.076
  410   1HG1  VAL  54          HG11      VAL  54  -4.069   1.386  -0.449
  411   2HG1  VAL  54          HG12      VAL  54  -4.762  -0.040   0.320
  412   3HG1  VAL  54          HG13      VAL  54  -5.816   1.222  -0.311
  413   1HG2  VAL  54          HG21      VAL  54  -6.576  -1.086  -0.929
  414   2HG2  VAL  54          HG22      VAL  54  -5.227  -2.112  -1.424
  415   3HG2  VAL  54          HG23      VAL  54  -6.319  -1.437  -2.638
  416    H    THR  55           HN       THR  55  -7.057   2.178  -4.460
  417    HA   THR  55           HA       THR  55  -9.226   2.621  -2.539
  418    HB   THR  55           HB       THR  55  -9.257   2.985  -5.545
  419    HG1  THR  55           HG1      THR  55  -8.016   4.709  -5.324
  420   1HG2  THR  55          HG21      THR  55 -10.556   4.432  -3.221
  421   2HG2  THR  55          HG22      THR  55 -11.366   3.418  -4.415
  422   3HG2  THR  55          HG23      THR  55 -10.655   4.956  -4.902
  423    H    GLU  56           HN       GLU  56 -10.855   1.172  -2.159
  424    HA   GLU  56           HA       GLU  56 -11.057  -1.392  -3.395
  425   1HB   GLU  56          HB2       GLU  56 -12.033  -0.255  -1.184
  426   2HB   GLU  56          HB1       GLU  56 -13.452  -0.042  -2.209
  427   1HG   GLU  56          HG2       GLU  56 -12.065  -2.713  -2.023
  428   2HG   GLU  56          HG1       GLU  56 -13.272  -2.233  -0.829
  Start of MODEL   35
    1   1H    THR   1          HT1       THR   1  13.826   6.033   5.685
    2   2H    THR   1          HT2       THR   1  12.985   5.134   6.857
    3   3H    THR   1          HT3       THR   1  13.133   6.819   7.019
    4    HA   THR   1           HA       THR   1  10.921   6.345   6.249
    5    HB   THR   1           HB       THR   1  11.222   7.561   3.985
    6    HG1  THR   1           HG1      THR   1  13.232   6.929   3.407
    7   1HG2  THR   1          HG21      THR   1  11.031   8.546   6.393
    8   2HG2  THR   1          HG22      THR   1  11.600   9.593   5.092
    9   3HG2  THR   1          HG23      THR   1  12.754   8.875   6.215
   10    H    THR   2           HN       THR   2  10.828   3.913   6.135
   11    HA   THR   2           HA       THR   2  11.625   2.541   3.692
   12    HB   THR   2           HB       THR   2  11.493   1.454   5.897
   13    HG1  THR   2           HG1      THR   2  11.150  -0.130   4.564
   14   1HG2  THR   2          HG21      THR   2   9.800   2.175   7.220
   15   2HG2  THR   2          HG22      THR   2   8.830   0.964   6.383
   16   3HG2  THR   2          HG23      THR   2   8.800   2.642   5.844
   17    H    PHE   3           HN       PHE   3   9.522   1.039   2.891
   18    HA   PHE   3           HA       PHE   3   7.952   2.844   1.271
   19   1HB   PHE   3          HB2       PHE   3   7.528  -0.100   1.897
   20   2HB   PHE   3          HB1       PHE   3   6.931   0.762   0.482
   21    HD1  PHE   3           HD1      PHE   3   9.204   2.374  -0.391
   22    HD2  PHE   3           HD2      PHE   3   9.150  -1.630   1.181
   23    HE1  PHE   3           HE1      PHE   3  11.326   1.871  -1.576
   24    HE2  PHE   3           HE2      PHE   3  11.270  -2.122  -0.003
   25    HZ   PHE   3           HZ       PHE   3  12.358  -0.372  -1.381
   26    H    LYS   4           HN       LYS   4   5.726   3.378   1.463
   27    HA   LYS   4           HA       LYS   4   4.325   2.539   3.975
   28   1HB   LYS   4          HB2       LYS   4   5.579   4.826   3.994
   29   2HB   LYS   4          HB1       LYS   4   4.293   5.367   2.924
   30   1HG   LYS   4          HG2       LYS   4   2.649   4.489   4.666
   31   2HG   LYS   4          HG1       LYS   4   4.029   4.338   5.748
   32   1HD   LYS   4          HD2       LYS   4   3.729   6.503   6.288
   33   2HD   LYS   4          HD1       LYS   4   4.298   6.902   4.668
   34   1HE   LYS   4          HE2       LYS   4   1.996   6.830   3.809
   35   2HE   LYS   4          HE1       LYS   4   1.399   6.351   5.410
   36   1HZ   LYS   4          HZ1       LYS   4   2.437   8.372   6.318
   37   2HZ   LYS   4          HZ2       LYS   4   1.222   8.730   5.185
   38   3HZ   LYS   4          HZ3       LYS   4   2.859   8.854   4.748
   39    H    LEU   5           HN       LEU   5   2.013   2.570   3.782
   40    HA   LEU   5           HA       LEU   5   0.816   3.380   1.188
   41   1HB   LEU   5          HB2       LEU   5   1.704   0.868   1.362
   42   2HB   LEU   5          HB1       LEU   5   0.205   0.637   2.249
   43    HG   LEU   5           HG       LEU   5  -0.240   2.195  -0.179
   44   1HD1  LEU   5          HD11      LEU   5   0.497  -0.669  -0.726
   45   2HD1  LEU   5          HD12      LEU   5   1.755   0.572  -0.738
   46   3HD1  LEU   5          HD13      LEU   5   0.388   0.691  -1.853
   47   1HD2  LEU   5          HD21      LEU   5  -2.012   1.104   1.136
   48   2HD2  LEU   5          HD22      LEU   5  -1.292  -0.473   0.816
   49   3HD2  LEU   5          HD23      LEU   5  -1.984   0.466  -0.507
   50    H    ILE   6           HN       ILE   6  -1.346   3.994   1.458
   51    HA   ILE   6           HA       ILE   6  -2.438   3.795   4.243
   52    HB   ILE   6           HB       ILE   6  -2.842   5.805   2.007
   53   1HG1  ILE   6          HG12      ILE   6  -0.624   5.889   3.112
   54   2HG1  ILE   6          HG11      ILE   6  -1.583   7.322   3.478
   55   1HG2  ILE   6          HG21      ILE   6  -3.953   7.124   3.920
   56   2HG2  ILE   6          HG22      ILE   6  -4.060   5.578   4.761
   57   3HG2  ILE   6          HG23      ILE   6  -4.882   5.800   3.217
   58   1HD1  ILE   6          HD11      ILE   6  -2.306   6.163   5.615
   59   2HD1  ILE   6          HD12      ILE   6  -0.596   6.587   5.546
   60   3HD1  ILE   6          HD13      ILE   6  -1.104   4.923   5.261
   61    H    ILE   7           HN       ILE   7  -4.372   2.745   4.500
   62    HA   ILE   7           HA       ILE   7  -5.641   1.467   2.172
   63    HB   ILE   7           HB       ILE   7  -6.261   1.457   5.148
   64   1HG1  ILE   7          HG12      ILE   7  -4.853  -0.669   3.516
   65   2HG1  ILE   7          HG11      ILE   7  -3.975   0.599   4.372
   66   1HG2  ILE   7          HG21      ILE   7  -7.174  -0.368   2.902
   67   2HG2  ILE   7          HG22      ILE   7  -8.190   0.754   3.806
   68   3HG2  ILE   7          HG23      ILE   7  -7.482  -0.643   4.617
   69   1HD1  ILE   7          HD11      ILE   7  -5.553  -1.690   5.475
   70   2HD1  ILE   7          HD12      ILE   7  -5.512  -0.187   6.396
   71   3HD1  ILE   7          HD13      ILE   7  -4.010  -1.029   6.016
   72    H    ASN   8           HN       ASN   8  -7.201   2.540   1.038
   73    HA   ASN   8           HA       ASN   8  -8.888   4.563   2.476
   74   1HB   ASN   8          HB2       ASN   8  -7.751   4.326  -0.306
   75   2HB   ASN   8          HB1       ASN   8  -9.156   5.350  -0.007
   76   1HD2  ASN   8          HD21      ASN   8  -7.680   7.210  -0.573
   77   2HD2  ASN   8          HD22      ASN   8  -6.624   7.816   0.622
   78    H    GLY   9           HN       GLY   9  -9.795   2.038   2.819
   79   1HA   GLY   9          HA2       GLY   9 -11.577   1.219   0.639
   80   2HA   GLY   9          HA1       GLY   9 -11.452   0.447   2.224
   81    H    LYS  10           HN       LYS  10 -13.938   1.042   0.980
   82    HA   LYS  10           HA       LYS  10 -15.190   3.455   1.704
   83   1HB   LYS  10          HB2       LYS  10 -16.219   0.608   1.556
   84   2HB   LYS  10          HB1       LYS  10 -17.266   2.026   1.637
   85   1HG   LYS  10          HG2       LYS  10 -16.450   2.860  -0.457
   86   2HG   LYS  10          HG1       LYS  10 -15.136   1.683  -0.486
   87   1HD   LYS  10          HD2       LYS  10 -16.503  -0.035  -1.161
   88   2HD   LYS  10          HD1       LYS  10 -17.901   0.597  -0.290
   89   1HE   LYS  10          HE2       LYS  10 -16.877   2.212  -2.592
   90   2HE   LYS  10          HE1       LYS  10 -17.784   0.730  -2.956
   91   1HZ   LYS  10          HZ1       LYS  10 -18.656   2.925  -1.150
   92   2HZ   LYS  10          HZ2       LYS  10 -19.499   1.469  -1.388
   93   3HZ   LYS  10          HZ3       LYS  10 -19.311   2.566  -2.672
   94    H    THR  11           HN       THR  11 -14.339   0.685   3.685
   95    HA   THR  11           HA       THR  11 -15.449   2.106   6.083
   96    HB   THR  11           HB       THR  11 -15.427  -0.884   5.571
   97    HG1  THR  11           HG1      THR  11 -17.555   0.979   5.359
   98   1HG2  THR  11          HG21      THR  11 -16.644   0.900   7.686
   99   2HG2  THR  11          HG22      THR  11 -15.510  -0.431   7.913
  100   3HG2  THR  11          HG23      THR  11 -17.173  -0.763   7.428
  101    H    LEU  12           HN       LEU  12 -13.146  -0.354   4.897
  102    HA   LEU  12           HA       LEU  12 -11.577  -0.339   7.370
  103   1HB   LEU  12          HB2       LEU  12 -11.095  -1.454   4.586
  104   2HB   LEU  12          HB1       LEU  12 -10.122  -1.840   6.006
  105    HG   LEU  12           HG       LEU  12 -13.063  -2.187   6.283
  106   1HD1  LEU  12          HD11      LEU  12 -13.088  -3.301   4.263
  107   2HD1  LEU  12          HD12      LEU  12 -12.510  -4.610   5.294
  108   3HD1  LEU  12          HD13      LEU  12 -11.367  -3.677   4.329
  109   1HD2  LEU  12          HD21      LEU  12 -12.431  -3.800   7.839
  110   2HD2  LEU  12          HD22      LEU  12 -11.050  -2.706   7.924
  111   3HD2  LEU  12          HD23      LEU  12 -10.941  -4.192   6.980
  112    H    LYS  13           HN       LYS  13  -9.458   0.558   7.592
  113    HA   LYS  13           HA       LYS  13  -8.222   2.116   5.442
  114   1HB   LYS  13          HB2       LYS  13 -10.033   3.282   7.473
  115   2HB   LYS  13          HB1       LYS  13  -8.508   4.140   7.265
  116   1HG   LYS  13          HG2       LYS  13  -9.241   5.052   5.343
  117   2HG   LYS  13          HG1       LYS  13  -9.531   3.452   4.663
  118   1HD   LYS  13          HD2       LYS  13 -11.685   4.299   4.619
  119   2HD   LYS  13          HD1       LYS  13 -11.685   3.559   6.220
  120   1HE   LYS  13          HE2       LYS  13 -10.672   6.001   6.847
  121   2HE   LYS  13          HE1       LYS  13 -11.716   6.434   5.478
  122   1HZ   LYS  13          HZ1       LYS  13 -12.495   4.855   7.871
  123   2HZ   LYS  13          HZ2       LYS  13 -13.486   5.086   6.511
  124   3HZ   LYS  13          HZ3       LYS  13 -13.034   6.412   7.471
  125    H    GLY  14           HN       GLY  14  -6.439   3.621   6.695
  126   1HA   GLY  14          HA2       GLY  14  -5.109   3.550   8.880
  127   2HA   GLY  14          HA1       GLY  14  -5.121   1.799   8.667
  128    H    GLU  15           HN       GLU  15  -2.675   2.941   8.857
  129    HA   GLU  15           HA       GLU  15  -1.677   3.180   6.040
  130   1HB   GLU  15          HB2       GLU  15   0.227   4.372   7.127
  131   2HB   GLU  15          HB1       GLU  15  -1.319   5.139   7.477
  132   1HG   GLU  15          HG2       GLU  15  -1.239   4.601   9.697
  133   2HG   GLU  15          HG1       GLU  15  -0.476   3.040   9.397
  134    H    THR  16           HN       THR  16   0.531   2.198   5.698
  135    HA   THR  16           HA       THR  16   1.397   0.113   7.591
  136    HB   THR  16           HB       THR  16  -0.511  -0.930   6.447
  137    HG1  THR  16           HG1      THR  16   0.616  -2.714   5.635
  138   1HG2  THR  16          HG21      THR  16   0.987  -0.070   3.964
  139   2HG2  THR  16          HG22      THR  16  -0.685   0.276   4.408
  140   3HG2  THR  16          HG23      THR  16  -0.221  -1.356   3.933
  141    H    THR  17           HN       THR  17   3.492  -0.692   7.075
  142    HA   THR  17           HA       THR  17   4.822   0.448   4.647
  143    HB   THR  17           HB       THR  17   6.712   1.107   6.085
  144    HG1  THR  17           HG1      THR  17   6.372   0.960   8.370
  145   1HG2  THR  17          HG21      THR  17   4.235   2.370   5.961
  146   2HG2  THR  17          HG22      THR  17   5.736   3.092   6.539
  147   3HG2  THR  17          HG23      THR  17   4.613   2.360   7.684
  148    H    THR  18           HN       THR  18   6.777  -0.763   4.051
  149    HA   THR  18           HA       THR  18   7.163  -3.362   5.424
  150    HB   THR  18           HB       THR  18   5.832  -2.811   2.854
  151    HG1  THR  18           HG1      THR  18   6.245  -5.162   4.391
  152   1HG2  THR  18          HG21      THR  18   8.051  -3.381   1.939
  153   2HG2  THR  18          HG22      THR  18   6.850  -4.620   1.565
  154   3HG2  THR  18          HG23      THR  18   8.036  -4.895   2.843
  155    H    GLU  19           HN       GLU  19   9.284  -4.260   4.981
  156    HA   GLU  19           HA       GLU  19  11.242  -2.257   3.915
  157   1HB   GLU  19          HB2       GLU  19  11.107  -3.373   6.369
  158   2HB   GLU  19          HB1       GLU  19  12.068  -4.608   5.554
  159   1HG   GLU  19          HG2       GLU  19  13.383  -2.469   4.653
  160   2HG   GLU  19          HG1       GLU  19  12.746  -1.758   6.137
  161    H    ALA  20           HN       ALA  20  12.107  -2.804   1.952
  162    HA   ALA  20           HA       ALA  20  12.757  -5.622   1.336
  163   1HB   ALA  20          HB1       ALA  20  10.613  -5.799   0.511
  164   2HB   ALA  20          HB2       ALA  20  11.361  -5.056  -0.903
  165   3HB   ALA  20          HB3       ALA  20  10.466  -4.060   0.246
  166    H    VAL  21           HN       VAL  21  13.473  -5.578  -1.184
  167    HA   VAL  21           HA       VAL  21  15.803  -3.911  -1.362
  168    HB   VAL  21           HB       VAL  21  15.458  -6.118  -2.466
  169   1HG1  VAL  21          HG11      VAL  21  13.730  -4.691  -4.478
  170   2HG1  VAL  21          HG12      VAL  21  13.047  -5.600  -3.130
  171   3HG1  VAL  21          HG13      VAL  21  14.033  -6.422  -4.340
  172   1HG2  VAL  21          HG21      VAL  21  16.293  -3.679  -3.944
  173   2HG2  VAL  21          HG22      VAL  21  16.120  -5.162  -4.882
  174   3HG2  VAL  21          HG23      VAL  21  17.234  -5.108  -3.516
  175    H    ASP  22           HN       ASP  22  12.584  -3.694  -2.786
  176    HA   ASP  22           HA       ASP  22  12.957  -0.813  -3.350
  177   1HB   ASP  22          HB2       ASP  22  12.412  -3.002  -5.376
  178   2HB   ASP  22          HB1       ASP  22  12.282  -1.275  -5.744
  179    H    ALA  23           HN       ALA  23  10.861   0.214  -3.826
  180    HA   ALA  23           HA       ALA  23   8.670  -0.773  -2.275
  181   1HB   ALA  23          HB1       ALA  23   9.397   1.582  -3.440
  182   2HB   ALA  23          HB2       ALA  23   7.775   1.271  -2.823
  183   3HB   ALA  23          HB3       ALA  23   8.119   1.068  -4.541
  184    H    ALA  24           HN       ALA  24   9.568  -1.258  -5.641
  185    HA   ALA  24           HA       ALA  24   7.085  -2.143  -6.723
  186   1HB   ALA  24          HB1       ALA  24   8.742  -1.889  -8.317
  187   2HB   ALA  24          HB2       ALA  24   8.891  -3.628  -8.062
  188   3HB   ALA  24          HB3       ALA  24  10.000  -2.519  -7.254
  189    H    THR  25           HN       THR  25   9.696  -4.014  -5.151
  190    HA   THR  25           HA       THR  25   8.338  -6.555  -5.240
  191    HB   THR  25           HB       THR  25  10.583  -5.378  -3.570
  192    HG1  THR  25           HG1      THR  25  10.480  -7.207  -5.730
  193   1HG2  THR  25          HG21      THR  25   9.727  -8.285  -3.717
  194   2HG2  THR  25          HG22      THR  25   9.485  -7.232  -2.320
  195   3HG2  THR  25          HG23      THR  25  11.120  -7.652  -2.839
  196    H    ALA  26           HN       ALA  26   8.729  -4.131  -2.615
  197    HA   ALA  26           HA       ALA  26   7.196  -5.492  -0.644
  198   1HB   ALA  26          HB1       ALA  26   8.539  -3.634  -0.001
  199   2HB   ALA  26          HB2       ALA  26   6.881  -3.060   0.200
  200   3HB   ALA  26          HB3       ALA  26   7.817  -2.588  -1.224
  201    H    GLU  27           HN       GLU  27   6.157  -2.779  -2.727
  202    HA   GLU  27           HA       GLU  27   3.491  -2.517  -2.163
  203   1HB   GLU  27          HB2       GLU  27   4.917  -1.341  -3.887
  204   2HB   GLU  27          HB1       GLU  27   4.630  -2.702  -4.970
  205   1HG   GLU  27          HG2       GLU  27   2.307  -1.294  -3.687
  206   2HG   GLU  27          HG1       GLU  27   3.071  -0.604  -5.117
  207    H    LYS  28           HN       LYS  28   4.867  -5.206  -4.059
  208    HA   LYS  28           HA       LYS  28   2.356  -6.333  -4.943
  209   1HB   LYS  28          HB2       LYS  28   5.035  -7.637  -4.302
  210   2HB   LYS  28          HB1       LYS  28   3.763  -8.352  -5.292
  211   1HG   LYS  28          HG2       LYS  28   4.133  -6.896  -7.065
  212   2HG   LYS  28          HG1       LYS  28   4.812  -5.641  -6.029
  213   1HD   LYS  28          HD2       LYS  28   6.771  -6.424  -6.963
  214   2HD   LYS  28          HD1       LYS  28   6.655  -7.534  -5.597
  215   1HE   LYS  28          HE2       LYS  28   5.685  -9.261  -6.983
  216   2HE   LYS  28          HE1       LYS  28   5.518  -8.139  -8.348
  217   1HZ   LYS  28          HZ1       LYS  28   8.093  -8.829  -7.033
  218   2HZ   LYS  28          HZ2       LYS  28   7.889  -7.844  -8.403
  219   3HZ   LYS  28          HZ3       LYS  28   7.551  -9.507  -8.491
  220    H    VAL  29           HN       VAL  29   4.456  -6.955  -2.131
  221    HA   VAL  29           HA       VAL  29   2.774  -8.927  -0.863
  222    HB   VAL  29           HB       VAL  29   4.963  -7.009  -0.009
  223   1HG1  VAL  29          HG11      VAL  29   3.611  -9.060   1.779
  224   2HG1  VAL  29          HG12      VAL  29   3.470  -7.307   1.953
  225   3HG1  VAL  29          HG13      VAL  29   5.030  -8.098   2.196
  226   1HG2  VAL  29          HG21      VAL  29   5.966  -9.403   0.483
  227   2HG2  VAL  29          HG22      VAL  29   5.924  -8.779  -1.166
  228   3HG2  VAL  29          HG23      VAL  29   4.701  -9.930  -0.628
  229    H    LEU  30           HN       LEU  30   2.915  -5.372  -0.757
  230    HA   LEU  30           HA       LEU  30   1.083  -5.031   1.419
  231   1HB   LEU  30          HB2       LEU  30   2.027  -3.366  -0.924
  232   2HB   LEU  30          HB1       LEU  30   0.835  -2.728   0.198
  233    HG   LEU  30           HG       LEU  30   3.390  -2.238   0.581
  234   1HD1  LEU  30          HD11      LEU  30   1.766  -1.472   2.151
  235   2HD1  LEU  30          HD12      LEU  30   3.024  -2.306   3.072
  236   3HD1  LEU  30          HD13      LEU  30   1.481  -3.108   2.749
  237   1HD2  LEU  30          HD21      LEU  30   4.335  -3.877   2.265
  238   2HD2  LEU  30          HD22      LEU  30   4.356  -4.396   0.594
  239   3HD2  LEU  30          HD23      LEU  30   3.147  -5.033   1.703
  240    H    LYS  31           HN       LYS  31   0.681  -5.583  -2.030
  241    HA   LYS  31           HA       LYS  31  -2.138  -4.981  -2.267
  242   1HB   LYS  31          HB2       LYS  31  -0.177  -5.605  -3.996
  243   2HB   LYS  31          HB1       LYS  31  -0.777  -7.225  -3.734
  244   1HG   LYS  31          HG2       LYS  31  -2.640  -4.953  -4.435
  245   2HG   LYS  31          HG1       LYS  31  -1.829  -5.903  -5.679
  246   1HD   LYS  31          HD2       LYS  31  -3.659  -6.997  -3.517
  247   2HD   LYS  31          HD1       LYS  31  -4.061  -6.830  -5.225
  248   1HE   LYS  31          HE2       LYS  31  -1.621  -8.259  -5.167
  249   2HE   LYS  31          HE1       LYS  31  -2.642  -8.990  -3.906
  250   1HZ   LYS  31          HZ1       LYS  31  -3.190  -9.983  -6.017
  251   2HZ   LYS  31          HZ2       LYS  31  -3.419  -8.458  -6.731
  252   3HZ   LYS  31          HZ3       LYS  31  -4.486  -9.006  -5.528
  253    H    GLN  32           HN       GLN  32  -0.282  -7.916  -1.544
  254    HA   GLN  32           HA       GLN  32  -2.384  -9.795  -1.264
  255   1HB   GLN  32          HB2       GLN  32   0.389  -9.408  -0.276
  256   2HB   GLN  32          HB1       GLN  32  -0.593 -10.604   0.570
  257   1HG   GLN  32          HG2       GLN  32  -1.198 -11.349  -1.911
  258   2HG   GLN  32          HG1       GLN  32   0.362 -10.602  -2.260
  259   1HE2  GLN  32          HE21      GLN  32   2.238 -11.396  -0.823
  260   2HE2  GLN  32          HE22      GLN  32   2.217 -13.032  -0.339
  261    H    TYR  33           HN       TYR  33  -1.034  -7.474   1.064
  262    HA   TYR  33           HA       TYR  33  -2.576  -8.248   3.372
  263   1HB   TYR  33          HB2       TYR  33  -0.589  -6.816   3.457
  264   2HB   TYR  33          HB1       TYR  33  -1.385  -5.601   2.456
  265    HD1  TYR  33           HD1      TYR  33  -1.519  -7.353   5.716
  266    HD2  TYR  33           HD2      TYR  33  -2.864  -3.997   3.407
  267    HE1  TYR  33           HE1      TYR  33  -2.509  -6.363   7.747
  268    HE2  TYR  33           HE2      TYR  33  -3.853  -2.993   5.445
  269    HH   TYR  33           HH       TYR  33  -4.521  -4.616   8.156
  270    H    ILE  34           HN       ILE  34  -3.147  -5.984   0.705
  271    HA   ILE  34           HA       ILE  34  -5.658  -4.913   1.642
  272    HB   ILE  34           HB       ILE  34  -4.460  -5.241  -1.127
  273   1HG1  ILE  34          HG12      ILE  34  -3.154  -3.991   0.730
  274   2HG1  ILE  34          HG11      ILE  34  -3.374  -3.168  -0.807
  275   1HG2  ILE  34          HG21      ILE  34  -6.725  -3.493  -0.139
  276   2HG2  ILE  34          HG22      ILE  34  -6.805  -4.755  -1.369
  277   3HG2  ILE  34          HG23      ILE  34  -5.918  -3.265  -1.691
  278   1HD1  ILE  34          HD11      ILE  34  -5.377  -2.765   1.398
  279   2HD1  ILE  34          HD12      ILE  34  -4.946  -1.682   0.074
  280   3HD1  ILE  34          HD13      ILE  34  -3.846  -1.888   1.438
  281    H    ASN  35           HN       ASN  35  -4.731  -7.818  -0.110
  282    HA   ASN  35           HA       ASN  35  -7.213  -8.576  -1.268
  283   1HB   ASN  35          HB2       ASN  35  -4.880  -9.564  -1.544
  284   2HB   ASN  35          HB1       ASN  35  -5.148 -10.406  -0.018
  285   1HD2  ASN  35          HD21      ASN  35  -5.618 -12.550  -0.565
  286   2HD2  ASN  35          HD22      ASN  35  -6.740 -13.021  -1.748
  287    H    ASP  36           HN       ASP  36  -6.059  -8.764   2.051
  288    HA   ASP  36           HA       ASP  36  -8.134 -10.590   2.990
  289   1HB   ASP  36          HB2       ASP  36  -6.101  -8.742   4.258
  290   2HB   ASP  36          HB1       ASP  36  -7.225  -9.692   5.231
  291    H    ASN  37           HN       ASN  37  -7.589  -7.062   3.223
  292    HA   ASN  37           HA       ASN  37 -10.072  -6.511   4.615
  293   1HB   ASN  37          HB2       ASN  37  -8.138  -4.829   2.987
  294   2HB   ASN  37          HB1       ASN  37  -9.464  -4.153   3.939
  295   1HD2  ASN  37          HD21      ASN  37  -8.282  -3.161   5.637
  296   2HD2  ASN  37          HD22      ASN  37  -7.245  -4.018   6.686
  297    H    GLY  38           HN       GLY  38  -9.139  -6.778   1.231
  298   1HA   GLY  38          HA2       GLY  38 -10.564  -7.050  -0.641
  299   2HA   GLY  38          HA1       GLY  38 -11.952  -6.792   0.417
  300    H    ILE  39           HN       ILE  39  -9.182  -4.616   0.154
  301    HA   ILE  39           HA       ILE  39 -11.028  -2.537  -0.978
  302    HB   ILE  39           HB       ILE  39  -8.622  -2.294   0.862
  303   1HG1  ILE  39          HG12      ILE  39 -10.581  -3.306   1.973
  304   2HG1  ILE  39          HG11      ILE  39 -10.299  -1.670   2.575
  305   1HG2  ILE  39          HG21      ILE  39  -8.800  -0.295  -0.466
  306   2HG2  ILE  39          HG22      ILE  39  -9.484   0.074   1.117
  307   3HG2  ILE  39          HG23      ILE  39 -10.550  -0.241  -0.252
  308   1HD1  ILE  39          HD11      ILE  39 -12.602  -2.748   1.107
  309   2HD1  ILE  39          HD12      ILE  39 -11.989  -1.244   0.420
  310   3HD1  ILE  39          HD13      ILE  39 -12.487  -1.302   2.110
  311    H    ASP  40           HN       ASP  40 -10.242  -3.520  -3.114
  312    HA   ASP  40           HA       ASP  40  -7.555  -2.411  -3.866
  313   1HB   ASP  40          HB2       ASP  40  -7.540  -4.259  -5.543
  314   2HB   ASP  40          HB1       ASP  40  -7.674  -4.867  -3.890
  315    H    GLY  41           HN       GLY  41  -7.872  -0.569  -5.055
  316   1HA   GLY  41          HA2       GLY  41  -9.834  -0.654  -7.281
  317   2HA   GLY  41          HA1       GLY  41  -9.982   0.660  -6.110
  318    H    GLU  42           HN       GLU  42  -8.192   2.182  -5.935
  319    HA   GLU  42           HA       GLU  42  -6.332   2.163  -8.287
  320   1HB   GLU  42          HB2       GLU  42  -8.496   3.987  -7.533
  321   2HB   GLU  42          HB1       GLU  42  -6.964   4.833  -7.744
  322   1HG   GLU  42          HG2       GLU  42  -6.856   4.377  -9.986
  323   2HG   GLU  42          HG1       GLU  42  -7.648   2.809  -9.813
  324    H    TRP  43           HN       TRP  43  -4.271   2.185  -7.510
  325    HA   TRP  43           HA       TRP  43  -3.719   3.326  -4.810
  326   1HB   TRP  43          HB2       TRP  43  -2.143   1.628  -6.773
  327   2HB   TRP  43          HB1       TRP  43  -1.483   2.212  -5.257
  328    HD1  TRP  43           HD1      TRP  43  -5.112   0.948  -5.438
  329    HE1  TRP  43           HE1      TRP  43  -5.269  -1.234  -4.101
  330    HE3  TRP  43           HE3      TRP  43  -0.191   0.238  -4.363
  331    HZ2  TRP  43           HZ2      TRP  43  -3.544  -3.027  -2.712
  332    HZ3  TRP  43           HZ3      TRP  43   0.525  -1.712  -3.000
  333    HH2  TRP  43           HH2      TRP  43  -1.136  -3.337  -2.177
  334    H    THR  44           HN       THR  44  -1.653   4.640  -4.662
  335    HA   THR  44           HA       THR  44  -0.825   6.029  -7.144
  336    HB   THR  44           HB       THR  44  -1.321   8.233  -6.169
  337    HG1  THR  44           HG1      THR  44  -2.629   8.222  -4.237
  338   1HG2  THR  44          HG21      THR  44  -3.063   6.891  -7.487
  339   2HG2  THR  44          HG22      THR  44  -3.676   8.215  -6.496
  340   3HG2  THR  44          HG23      THR  44  -3.818   6.551  -5.930
  341    H    TYR  45           HN       TYR  45   1.345   6.378  -7.038
  342    HA   TYR  45           HA       TYR  45   2.761   5.792  -4.506
  343   1HB   TYR  45          HB2       TYR  45   3.436   4.750  -6.631
  344   2HB   TYR  45          HB1       TYR  45   3.670   6.339  -7.356
  345    HD1  TYR  45           HD1      TYR  45   4.670   4.677  -4.134
  346    HD2  TYR  45           HD2      TYR  45   5.899   6.948  -7.565
  347    HE1  TYR  45           HE1      TYR  45   6.990   4.737  -3.263
  348    HE2  TYR  45           HE2      TYR  45   8.219   7.010  -6.694
  349    HH   TYR  45           HH       TYR  45   9.499   5.121  -4.743
  350    H    ASP  46           HN       ASP  46   4.502   7.308  -3.780
  351    HA   ASP  46           HA       ASP  46   4.157  10.141  -4.675
  352   1HB   ASP  46          HB2       ASP  46   4.215   9.190  -1.787
  353   2HB   ASP  46          HB1       ASP  46   4.005  10.849  -2.337
  354    H    ASP  47           HN       ASP  47   6.130  11.104  -4.961
  355    HA   ASP  47           HA       ASP  47   8.591   9.638  -4.421
  356   1HB   ASP  47          HB2       ASP  47   8.176  11.095  -6.390
  357   2HB   ASP  47          HB1       ASP  47   8.086  12.493  -5.319
  358    H    ALA  48           HN       ALA  48   6.636  11.512  -2.397
  359    HA   ALA  48           HA       ALA  48   8.441  13.161  -0.953
  360   1HB   ALA  48          HB1       ALA  48   5.847  11.744  -0.467
  361   2HB   ALA  48          HB2       ALA  48   6.203  13.473  -0.420
  362   3HB   ALA  48          HB3       ALA  48   6.675  12.440   0.929
  363    H    THR  49           HN       THR  49   7.170  10.097   0.347
  364    HA   THR  49           HA       THR  49   9.927   9.367   1.268
  365    HB   THR  49           HB       THR  49   8.620  10.480   3.064
  366    HG1  THR  49           HG1      THR  49   9.448   9.080   4.367
  367   1HG2  THR  49          HG21      THR  49   6.559   9.339   3.900
  368   2HG2  THR  49          HG22      THR  49   6.641   8.254   2.509
  369   3HG2  THR  49          HG23      THR  49   6.370   9.980   2.266
  370    H    LYS  50           HN       LYS  50   8.472   8.366  -1.015
  371    HA   LYS  50           HA       LYS  50   7.863   6.334  -2.014
  372   1HB   LYS  50          HB2       LYS  50   9.106   5.197   0.513
  373   2HB   LYS  50          HB1       LYS  50   8.864   4.335  -1.003
  374   1HG   LYS  50          HG2       LYS  50  10.247   6.407  -1.971
  375   2HG   LYS  50          HG1       LYS  50  10.871   6.437  -0.321
  376   1HD   LYS  50          HD2       LYS  50  12.004   4.474  -0.573
  377   2HD   LYS  50          HD1       LYS  50  10.731   3.753  -1.558
  378   1HE   LYS  50          HE2       LYS  50  11.714   4.406  -3.509
  379   2HE   LYS  50          HE1       LYS  50  12.147   6.001  -2.861
  380   1HZ   LYS  50          HZ1       LYS  50  14.145   4.723  -3.150
  381   2HZ   LYS  50          HZ2       LYS  50  13.498   3.419  -2.274
  382   3HZ   LYS  50          HZ3       LYS  50  13.847   4.884  -1.488
  383    H    THR  51           HN       THR  51   5.766   7.591  -0.750
  384    HA   THR  51           HA       THR  51   4.393   5.616   0.984
  385    HB   THR  51           HB       THR  51   3.548   8.332  -0.083
  386    HG1  THR  51           HG1      THR  51   4.789   9.096   1.402
  387   1HG2  THR  51          HG21      THR  51   2.376   6.377   1.867
  388   2HG2  THR  51          HG22      THR  51   1.566   7.362   0.648
  389   3HG2  THR  51          HG23      THR  51   2.143   8.105   2.139
  390    H    TRP  52           HN       TRP  52   2.062   5.110   0.380
  391    HA   TRP  52           HA       TRP  52   1.626   4.974  -2.575
  392   1HB   TRP  52          HB2       TRP  52   1.744   2.801  -0.493
  393   2HB   TRP  52          HB1       TRP  52   0.804   2.589  -1.966
  394    HD1  TRP  52           HD1      TRP  52   4.343   2.657  -0.675
  395    HE1  TRP  52           HE1      TRP  52   5.957   2.073  -2.603
  396    HE3  TRP  52           HE3      TRP  52   1.094   2.792  -4.559
  397    HZ2  TRP  52           HZ2      TRP  52   5.860   1.707  -5.450
  398    HZ3  TRP  52           HZ3      TRP  52   1.853   2.322  -6.882
  399    HH2  TRP  52           HH2      TRP  52   4.234   1.778  -7.327
  400    H    THR  53           HN       THR  53  -0.730   3.667  -2.666
  401    HA   THR  53           HA       THR  53  -2.602   4.581  -0.594
  402    HB   THR  53           HB       THR  53  -2.819   5.667  -3.416
  403    HG1  THR  53           HG1      THR  53  -1.184   6.825  -2.712
  404   1HG2  THR  53          HG21      THR  53  -4.307   6.068  -0.835
  405   2HG2  THR  53          HG22      THR  53  -4.949   5.749  -2.446
  406   3HG2  THR  53          HG23      THR  53  -4.289   7.338  -2.059
  407    H    VAL  54           HN       VAL  54  -4.918   3.979  -1.306
  408    HA   VAL  54           HA       VAL  54  -5.303   2.080  -3.468
  409    HB   VAL  54           HB       VAL  54  -3.962   0.646  -2.053
  410   1HG1  VAL  54          HG11      VAL  54  -5.487   1.991   0.086
  411   2HG1  VAL  54          HG12      VAL  54  -3.829   1.397   0.082
  412   3HG1  VAL  54          HG13      VAL  54  -5.162   0.280   0.360
  413   1HG2  VAL  54          HG21      VAL  54  -6.665  -0.266  -1.157
  414   2HG2  VAL  54          HG22      VAL  54  -5.362  -1.188  -1.912
  415   3HG2  VAL  54          HG23      VAL  54  -6.383  -0.129  -2.893
  416    H    THR  55           HN       THR  55  -7.109   3.549  -3.750
  417    HA   THR  55           HA       THR  55  -9.180   3.652  -1.630
  418    HB   THR  55           HB       THR  55  -9.245   4.840  -4.412
  419    HG1  THR  55           HG1      THR  55  -7.940   6.409  -3.750
  420   1HG2  THR  55          HG21      THR  55 -11.307   5.076  -3.196
  421   2HG2  THR  55          HG22      THR  55 -10.489   6.638  -3.135
  422   3HG2  THR  55          HG23      THR  55 -10.453   5.567  -1.733
  423    H    GLU  56           HN       GLU  56 -11.044   2.433  -1.720
  424    HA   GLU  56           HA       GLU  56 -11.317   0.187  -3.463
  425   1HB   GLU  56          HB2       GLU  56 -12.391   0.889  -1.147
  426   2HB   GLU  56          HB1       GLU  56 -13.675   1.530  -2.173
  427   1HG   GLU  56          HG2       GLU  56 -12.632  -1.284  -2.513
  428   2HG   GLU  56          HG1       GLU  56 -13.929  -0.906  -1.378
  Start of MODEL   36
    1   1H    THR   1          HT1       THR   1  14.891   4.640   5.845
    2   2H    THR   1          HT2       THR   1  14.066   3.311   6.510
    3   3H    THR   1          HT3       THR   1  13.197   4.652   5.932
    4    HA   THR   1           HA       THR   1  13.781   4.174   3.678
    5    HB   THR   1           HB       THR   1  16.095   3.548   4.219
    6    HG1  THR   1           HG1      THR   1  16.213   1.721   2.835
    7   1HG2  THR   1          HG21      THR   1  16.305   2.210   6.041
    8   2HG2  THR   1          HG22      THR   1  16.093   0.889   4.892
    9   3HG2  THR   1          HG23      THR   1  14.712   1.488   5.811
   10    H    THR   2           HN       THR   2  11.485   3.676   4.996
   11    HA   THR   2           HA       THR   2  10.865   0.791   4.435
   12    HB   THR   2           HB       THR   2   9.448   2.622   6.385
   13    HG1  THR   2           HG1      THR   2  11.494   2.547   7.146
   14   1HG2  THR   2          HG21      THR   2   9.739  -0.388   6.374
   15   2HG2  THR   2          HG22      THR   2   8.404   0.448   5.581
   16   3HG2  THR   2          HG23      THR   2   8.617   0.583   7.327
   17    H    PHE   3           HN       PHE   3   9.432   0.542   2.778
   18    HA   PHE   3           HA       PHE   3   8.258   2.652   1.283
   19   1HB   PHE   3          HB2       PHE   3   7.391  -0.241   1.641
   20   2HB   PHE   3          HB1       PHE   3   6.918   0.801   0.298
   21    HD1  PHE   3           HD1      PHE   3   9.207   2.187  -0.583
   22    HD2  PHE   3           HD2      PHE   3   9.013  -1.803   1.007
   23    HE1  PHE   3           HE1      PHE   3  11.307   1.610  -1.769
   24    HE2  PHE   3           HE2      PHE   3  11.112  -2.375  -0.180
   25    HZ   PHE   3           HZ       PHE   3  12.259  -0.670  -1.567
   26    H    LYS   4           HN       LYS   4   5.858   3.091   1.074
   27    HA   LYS   4           HA       LYS   4   4.332   2.683   3.617
   28   1HB   LYS   4          HB2       LYS   4   5.624   4.888   3.489
   29   2HB   LYS   4          HB1       LYS   4   4.562   5.324   2.159
   30   1HG   LYS   4          HG2       LYS   4   2.594   5.012   3.610
   31   2HG   LYS   4          HG1       LYS   4   3.653   4.586   4.952
   32   1HD   LYS   4          HD2       LYS   4   4.259   6.746   5.333
   33   2HD   LYS   4          HD1       LYS   4   4.333   7.131   3.614
   34   1HE   LYS   4          HE2       LYS   4   2.195   7.927   3.592
   35   2HE   LYS   4          HE1       LYS   4   1.597   6.593   4.599
   36   1HZ   LYS   4          HZ1       LYS   4   2.781   7.637   6.494
   37   2HZ   LYS   4          HZ2       LYS   4   1.510   8.589   5.890
   38   3HZ   LYS   4          HZ3       LYS   4   3.119   8.977   5.510
   39    H    LEU   5           HN       LEU   5   2.032   2.843   3.333
   40    HA   LEU   5           HA       LEU   5   0.943   3.309   0.622
   41   1HB   LEU   5          HB2       LEU   5   1.741   0.812   1.137
   42   2HB   LEU   5          HB1       LEU   5   0.196   0.743   1.974
   43    HG   LEU   5           HG       LEU   5  -0.069   2.028  -0.637
   44   1HD1  LEU   5          HD11      LEU   5   0.565  -0.907  -0.801
   45   2HD1  LEU   5          HD12      LEU   5   1.863   0.286  -0.927
   46   3HD1  LEU   5          HD13      LEU   5   0.532   0.303  -2.091
   47   1HD2  LEU   5          HD21      LEU   5  -1.301  -0.436   0.639
   48   2HD2  LEU   5          HD22      LEU   5  -1.874   0.327  -0.845
   49   3HD2  LEU   5          HD23      LEU   5  -1.957   1.202   0.685
   50    H    ILE   6           HN       ILE   6  -1.085   4.207   0.802
   51    HA   ILE   6           HA       ILE   6  -2.309   4.306   3.530
   52    HB   ILE   6           HB       ILE   6  -2.525   6.048   1.059
   53   1HG1  ILE   6          HG12      ILE   6  -0.370   6.172   2.275
   54   2HG1  ILE   6          HG11      ILE   6  -1.277   7.677   2.415
   55   1HG2  ILE   6          HG21      ILE   6  -3.918   6.178   3.733
   56   2HG2  ILE   6          HG22      ILE   6  -4.622   6.304   2.121
   57   3HG2  ILE   6          HG23      ILE   6  -3.658   7.632   2.767
   58   1HD1  ILE   6          HD11      ILE   6  -0.410   5.850   4.506
   59   2HD1  ILE   6          HD12      ILE   6  -2.151   6.121   4.579
   60   3HD1  ILE   6          HD13      ILE   6  -1.042   7.489   4.652
   61    H    ILE   7           HN       ILE   7  -4.295   3.363   3.835
   62    HA   ILE   7           HA       ILE   7  -5.558   1.917   1.596
   63    HB   ILE   7           HB       ILE   7  -6.231   2.164   4.549
   64   1HG1  ILE   7          HG12      ILE   7  -4.847  -0.122   3.123
   65   2HG1  ILE   7          HG11      ILE   7  -3.956   1.184   3.906
   66   1HG2  ILE   7          HG21      ILE   7  -8.187   1.326   3.581
   67   2HG2  ILE   7          HG22      ILE   7  -7.299  -0.158   3.931
   68   3HG2  ILE   7          HG23      ILE   7  -7.312   0.497   2.293
   69   1HD1  ILE   7          HD11      ILE   7  -5.562  -1.009   5.122
   70   2HD1  ILE   7          HD12      ILE   7  -5.631   0.564   5.915
   71   3HD1  ILE   7          HD13      ILE   7  -4.080  -0.247   5.700
   72    H    ASN   8           HN       ASN   8  -6.877   3.149   0.297
   73    HA   ASN   8           HA       ASN   8  -8.521   5.316   1.525
   74   1HB   ASN   8          HB2       ASN   8  -7.479   4.613  -1.206
   75   2HB   ASN   8          HB1       ASN   8  -8.889   5.663  -1.075
   76   1HD2  ASN   8          HD21      ASN   8  -6.892   7.027  -2.154
   77   2HD2  ASN   8          HD22      ASN   8  -6.056   8.003  -1.032
   78    H    GLY   9           HN       GLY   9  -9.472   2.874   2.262
   79   1HA   GLY   9          HA2       GLY   9 -11.456   1.905   0.323
   80   2HA   GLY   9          HA1       GLY   9 -11.202   1.270   1.954
   81    H    LYS  10           HN       LYS  10 -13.662   2.272   0.439
   82    HA   LYS  10           HA       LYS  10 -14.658   4.686   1.491
   83   1HB   LYS  10          HB2       LYS  10 -16.076   2.090   0.823
   84   2HB   LYS  10          HB1       LYS  10 -16.864   3.662   0.963
   85   1HG   LYS  10          HG2       LYS  10 -15.113   4.445  -0.796
   86   2HG   LYS  10          HG1       LYS  10 -14.893   2.723  -1.115
   87   1HD   LYS  10          HD2       LYS  10 -17.176   2.448  -1.753
   88   2HD   LYS  10          HD1       LYS  10 -17.621   4.028  -1.107
   89   1HE   LYS  10          HE2       LYS  10 -15.679   4.752  -2.888
   90   2HE   LYS  10          HE1       LYS  10 -16.389   3.349  -3.712
   91   1HZ   LYS  10          HZ1       LYS  10 -18.605   4.308  -3.183
   92   2HZ   LYS  10          HZ2       LYS  10 -17.697   5.248  -4.268
   93   3HZ   LYS  10          HZ3       LYS  10 -17.830   5.715  -2.640
   94    H    THR  11           HN       THR  11 -14.517   1.467   2.948
   95    HA   THR  11           HA       THR  11 -15.807   2.558   5.427
   96    HB   THR  11           HB       THR  11 -15.446  -0.340   4.642
   97    HG1  THR  11           HG1      THR  11 -16.681   0.252   3.024
   98   1HG2  THR  11          HG21      THR  11 -17.540  -0.518   6.061
   99   2HG2  THR  11          HG22      THR  11 -17.292   1.172   6.501
  100   3HG2  THR  11          HG23      THR  11 -16.085  -0.039   6.935
  101    H    LEU  12           HN       LEU  12 -12.990   0.908   4.107
  102    HA   LEU  12           HA       LEU  12 -11.770   0.801   6.845
  103   1HB   LEU  12          HB2       LEU  12 -11.258  -0.715   4.267
  104   2HB   LEU  12          HB1       LEU  12 -10.276  -0.897   5.721
  105    HG   LEU  12           HG       LEU  12 -13.263  -1.204   5.881
  106   1HD1  LEU  12          HD11      LEU  12 -13.153  -3.501   5.288
  107   2HD1  LEU  12          HD12      LEU  12 -11.390  -3.510   5.329
  108   3HD1  LEU  12          HD13      LEU  12 -12.238  -2.672   4.029
  109   1HD2  LEU  12          HD21      LEU  12 -10.841  -2.107   7.441
  110   2HD2  LEU  12          HD22      LEU  12 -12.407  -2.889   7.658
  111   3HD2  LEU  12          HD23      LEU  12 -12.224  -1.169   8.007
  112    H    LYS  13           HN       LYS  13  -9.953   2.036   7.216
  113    HA   LYS  13           HA       LYS  13  -8.442   3.150   4.900
  114   1HB   LYS  13          HB2       LYS  13  -9.907   4.644   7.082
  115   2HB   LYS  13          HB1       LYS  13  -8.590   5.391   6.177
  116   1HG   LYS  13          HG2       LYS  13  -9.773   5.007   4.071
  117   2HG   LYS  13          HG1       LYS  13 -11.067   4.167   4.927
  118   1HD   LYS  13          HD2       LYS  13 -11.058   6.470   6.325
  119   2HD   LYS  13          HD1       LYS  13 -10.478   7.079   4.775
  120   1HE   LYS  13          HE2       LYS  13 -12.499   6.750   3.754
  121   2HE   LYS  13          HE1       LYS  13 -12.779   5.214   4.600
  122   1HZ   LYS  13          HZ1       LYS  13 -12.948   7.917   5.827
  123   2HZ   LYS  13          HZ2       LYS  13 -13.206   6.444   6.633
  124   3HZ   LYS  13          HZ3       LYS  13 -14.275   6.946   5.412
  125    H    GLY  14           HN       GLY  14  -6.508   4.517   5.931
  126   1HA   GLY  14          HA2       GLY  14  -5.223   4.581   8.175
  127   2HA   GLY  14          HA1       GLY  14  -5.333   2.823   8.088
  128    H    GLU  15           HN       GLU  15  -2.828   3.797   8.217
  129    HA   GLU  15           HA       GLU  15  -1.806   3.739   5.395
  130   1HB   GLU  15          HB2       GLU  15   0.118   5.004   6.345
  131   2HB   GLU  15          HB1       GLU  15  -1.410   5.842   6.615
  132   1HG   GLU  15          HG2       GLU  15  -1.501   5.118   8.905
  133   2HG   GLU  15          HG1       GLU  15  -0.158   3.999   8.667
  134    H    THR  16           HN       THR  16   0.460   2.727   5.274
  135    HA   THR  16           HA       THR  16   1.195   0.820   7.384
  136    HB   THR  16           HB       THR  16  -0.717  -0.294   6.317
  137    HG1  THR  16           HG1      THR  16   1.704  -1.451   5.414
  138   1HG2  THR  16          HG21      THR  16  -0.446  -0.987   3.885
  139   2HG2  THR  16          HG22      THR  16   0.868   0.186   3.779
  140   3HG2  THR  16          HG23      THR  16  -0.771   0.725   4.150
  141    H    THR  17           HN       THR  17   3.314   0.052   7.094
  142    HA   THR  17           HA       THR  17   4.709   0.811   4.551
  143    HB   THR  17           HB       THR  17   6.629   1.461   6.072
  144    HG1  THR  17           HG1      THR  17   6.392   1.191   8.130
  145   1HG2  THR  17          HG21      THR  17   5.492   3.316   5.232
  146   2HG2  THR  17          HG22      THR  17   5.323   3.553   6.971
  147   3HG2  THR  17          HG23      THR  17   3.985   2.883   6.038
  148    H    THR  18           HN       THR  18   6.645  -0.510   4.144
  149    HA   THR  18           HA       THR  18   6.902  -2.952   5.818
  150    HB   THR  18           HB       THR  18   5.688  -2.657   3.160
  151    HG1  THR  18           HG1      THR  18   4.740  -3.823   4.784
  152   1HG2  THR  18          HG21      THR  18   6.745  -4.603   2.094
  153   2HG2  THR  18          HG22      THR  18   7.913  -4.708   3.412
  154   3HG2  THR  18          HG23      THR  18   7.914  -3.305   2.342
  155    H    GLU  19           HN       GLU  19   8.939  -4.175   5.118
  156    HA   GLU  19           HA       GLU  19  11.057  -2.279   4.150
  157   1HB   GLU  19          HB2       GLU  19  11.099  -2.719   6.596
  158   2HB   GLU  19          HB1       GLU  19  11.194  -4.451   6.272
  159   1HG   GLU  19          HG2       GLU  19  13.392  -4.350   5.637
  160   2HG   GLU  19          HG1       GLU  19  13.212  -2.758   4.899
  161    H    ALA  20           HN       ALA  20  11.823  -3.033   2.208
  162    HA   ALA  20           HA       ALA  20  12.445  -5.915   1.900
  163   1HB   ALA  20          HB1       ALA  20  11.096  -5.687  -0.359
  164   2HB   ALA  20          HB2       ALA  20  10.277  -4.380   0.498
  165   3HB   ALA  20          HB3       ALA  20  10.236  -6.021   1.145
  166    H    VAL  21           HN       VAL  21  13.231  -6.165  -0.563
  167    HA   VAL  21           HA       VAL  21  15.589  -4.573  -0.891
  168    HB   VAL  21           HB       VAL  21  15.206  -6.873  -1.763
  169   1HG1  VAL  21          HG11      VAL  21  12.811  -6.365  -2.500
  170   2HG1  VAL  21          HG12      VAL  21  13.782  -7.347  -3.598
  171   3HG1  VAL  21          HG13      VAL  21  13.530  -5.635  -3.936
  172   1HG2  VAL  21          HG21      VAL  21  17.018  -5.767  -2.802
  173   2HG2  VAL  21          HG22      VAL  21  15.947  -4.683  -3.690
  174   3HG2  VAL  21          HG23      VAL  21  16.057  -6.383  -4.147
  175    H    ASP  22           HN       ASP  22  12.391  -4.425  -2.364
  176    HA   ASP  22           HA       ASP  22  12.854  -1.634  -3.239
  177   1HB   ASP  22          HB2       ASP  22  12.243  -4.019  -5.009
  178   2HB   ASP  22          HB1       ASP  22  12.169  -2.341  -5.569
  179    H    ALA  23           HN       ALA  23  10.782  -0.625  -3.899
  180    HA   ALA  23           HA       ALA  23   8.567  -1.340  -2.228
  181   1HB   ALA  23          HB1       ALA  23   8.164   0.805  -2.836
  182   2HB   ALA  23          HB2       ALA  23   7.647   0.215  -4.415
  183   3HB   ALA  23          HB3       ALA  23   9.325   0.687  -4.157
  184    H    ALA  24           HN       ALA  24   9.433  -2.230  -5.523
  185    HA   ALA  24           HA       ALA  24   6.938  -3.203  -6.482
  186   1HB   ALA  24          HB1       ALA  24   9.755  -4.262  -6.907
  187   2HB   ALA  24          HB2       ALA  24   9.019  -2.933  -7.803
  188   3HB   ALA  24          HB3       ALA  24   8.378  -4.568  -7.965
  189    H    THR  25           HN       THR  25   9.505  -4.908  -4.669
  190    HA   THR  25           HA       THR  25   8.106  -7.419  -4.456
  191    HB   THR  25           HB       THR  25  10.353  -6.085  -2.913
  192    HG1  THR  25           HG1      THR  25  11.209  -6.647  -4.754
  193   1HG2  THR  25          HG21      THR  25   9.211  -7.771  -1.477
  194   2HG2  THR  25          HG22      THR  25  10.847  -8.268  -1.922
  195   3HG2  THR  25          HG23      THR  25   9.457  -8.979  -2.743
  196    H    ALA  26           HN       ALA  26   8.538  -4.715  -2.122
  197    HA   ALA  26           HA       ALA  26   6.944  -5.807  -0.034
  198   1HB   ALA  26          HB1       ALA  26   7.649  -2.997  -0.914
  199   2HB   ALA  26          HB2       ALA  26   8.344  -3.928   0.412
  200   3HB   ALA  26          HB3       ALA  26   6.700  -3.296   0.547
  201    H    GLU  27           HN       GLU  27   6.015  -3.322  -2.432
  202    HA   GLU  27           HA       GLU  27   3.356  -2.905  -1.939
  203   1HB   GLU  27          HB2       GLU  27   4.833  -1.998  -3.778
  204   2HB   GLU  27          HB1       GLU  27   4.514  -3.475  -4.687
  205   1HG   GLU  27          HG2       GLU  27   2.229  -1.837  -3.627
  206   2HG   GLU  27          HG1       GLU  27   3.028  -1.367  -5.124
  207    H    LYS  28           HN       LYS  28   4.651  -5.853  -3.470
  208    HA   LYS  28           HA       LYS  28   2.103  -6.996  -4.226
  209   1HB   LYS  28          HB2       LYS  28   4.737  -8.303  -3.424
  210   2HB   LYS  28          HB1       LYS  28   3.443  -9.084  -4.331
  211   1HG   LYS  28          HG2       LYS  28   3.878  -7.873  -6.262
  212   2HG   LYS  28          HG1       LYS  28   4.579  -6.516  -5.380
  213   1HD   LYS  28          HD2       LYS  28   6.515  -7.471  -6.217
  214   2HD   LYS  28          HD1       LYS  28   6.382  -8.352  -4.695
  215   1HE   LYS  28          HE2       LYS  28   4.923 -10.029  -6.121
  216   2HE   LYS  28          HE1       LYS  28   5.799  -9.306  -7.485
  217   1HZ   LYS  28          HZ1       LYS  28   7.007 -10.480  -5.035
  218   2HZ   LYS  28          HZ2       LYS  28   7.877  -9.673  -6.251
  219   3HZ   LYS  28          HZ3       LYS  28   7.079 -11.131  -6.600
  220    H    VAL  29           HN       VAL  29   4.195  -7.353  -1.363
  221    HA   VAL  29           HA       VAL  29   2.460  -9.101   0.137
  222    HB   VAL  29           HB       VAL  29   4.708  -7.158   0.749
  223   1HG1  VAL  29          HG11      VAL  29   3.306  -8.935   2.776
  224   2HG1  VAL  29          HG12      VAL  29   3.220  -7.171   2.737
  225   3HG1  VAL  29          HG13      VAL  29   4.757  -7.975   3.070
  226   1HG2  VAL  29          HG21      VAL  29   4.575 -10.148   1.165
  227   2HG2  VAL  29          HG22      VAL  29   6.008  -9.127   1.047
  228   3HG2  VAL  29          HG23      VAL  29   5.025  -9.435  -0.384
  229    H    LEU  30           HN       LEU  30   2.709  -5.555  -0.158
  230    HA   LEU  30           HA       LEU  30   0.884  -4.924   1.958
  231   1HB   LEU  30          HB2       LEU  30   1.877  -3.558  -0.552
  232   2HB   LEU  30          HB1       LEU  30   0.699  -2.767   0.484
  233    HG   LEU  30           HG       LEU  30   3.249  -2.286   0.834
  234   1HD1  LEU  30          HD11      LEU  30   1.628  -1.366   2.330
  235   2HD1  LEU  30          HD12      LEU  30   2.893  -2.110   3.317
  236   3HD1  LEU  30          HD13      LEU  30   1.347  -2.938   3.085
  237   1HD2  LEU  30          HD21      LEU  30   4.201  -3.770   2.635
  238   2HD2  LEU  30          HD22      LEU  30   4.167  -4.462   1.028
  239   3HD2  LEU  30          HD23      LEU  30   2.975  -4.953   2.229
  240    H    LYS  31           HN       LYS  31   0.473  -5.814  -1.423
  241    HA   LYS  31           HA       LYS  31  -2.325  -5.175  -1.741
  242   1HB   LYS  31          HB2       LYS  31  -0.383  -6.041  -3.377
  243   2HB   LYS  31          HB1       LYS  31  -1.016  -7.608  -2.930
  244   1HG   LYS  31          HG2       LYS  31  -2.839  -5.402  -3.891
  245   2HG   LYS  31          HG1       LYS  31  -2.034  -6.488  -5.022
  246   1HD   LYS  31          HD2       LYS  31  -3.890  -7.323  -2.769
  247   2HD   LYS  31          HD1       LYS  31  -4.278  -7.335  -4.487
  248   1HE   LYS  31          HE2       LYS  31  -1.858  -8.780  -4.257
  249   2HE   LYS  31          HE1       LYS  31  -2.898  -9.360  -2.935
  250   1HZ   LYS  31          HZ1       LYS  31  -3.611  -9.151  -5.816
  251   2HZ   LYS  31          HZ2       LYS  31  -4.735  -9.483  -4.586
  252   3HZ   LYS  31          HZ3       LYS  31  -3.471 -10.573  -4.903
  253    H    GLN  32           HN       GLN  32  -0.564  -8.065  -0.680
  254    HA   GLN  32           HA       GLN  32  -2.728  -9.833  -0.206
  255   1HB   GLN  32          HB2       GLN  32   0.057  -9.434   0.749
  256   2HB   GLN  32          HB1       GLN  32  -0.968 -10.503   1.707
  257   1HG   GLN  32          HG2       GLN  32  -1.591 -11.520  -0.644
  258   2HG   GLN  32          HG1       GLN  32  -0.053 -10.807  -1.129
  259   1HE2  GLN  32          HE21      GLN  32   1.807 -11.323   0.588
  260   2HE2  GLN  32          HE22      GLN  32   1.851 -12.938   1.136
  261    H    TYR  33           HN       TYR  33  -1.294  -7.321   1.866
  262    HA   TYR  33           HA       TYR  33  -2.873  -7.786   4.233
  263   1HB   TYR  33          HB2       TYR  33  -0.833  -6.426   4.177
  264   2HB   TYR  33          HB1       TYR  33  -1.585  -5.295   3.051
  265    HD1  TYR  33           HD1      TYR  33  -1.751  -6.673   6.481
  266    HD2  TYR  33           HD2      TYR  33  -3.049  -3.570   3.815
  267    HE1  TYR  33           HE1      TYR  33  -2.712  -5.444   8.391
  268    HE2  TYR  33           HE2      TYR  33  -4.008  -2.328   5.732
  269    HH   TYR  33           HH       TYR  33  -4.903  -3.023   8.113
  270    H    ILE  34           HN       ILE  34  -3.341  -5.789   1.340
  271    HA   ILE  34           HA       ILE  34  -5.814  -4.533   2.134
  272    HB   ILE  34           HB       ILE  34  -4.619  -5.204  -0.574
  273   1HG1  ILE  34          HG12      ILE  34  -3.272  -3.811   1.148
  274   2HG1  ILE  34          HG11      ILE  34  -3.453  -3.153  -0.472
  275   1HG2  ILE  34          HG21      ILE  34  -6.781  -3.221   0.182
  276   2HG2  ILE  34          HG22      ILE  34  -6.972  -4.655  -0.827
  277   3HG2  ILE  34          HG23      ILE  34  -6.002  -3.298  -1.399
  278   1HD1  ILE  34          HD11      ILE  34  -5.424  -2.433   1.687
  279   2HD1  ILE  34          HD12      ILE  34  -4.996  -1.534   0.231
  280   3HD1  ILE  34          HD13      ILE  34  -3.871  -1.601   1.589
  281    H    ASN  35           HN       ASN  35  -4.996  -7.648   0.721
  282    HA   ASN  35           HA       ASN  35  -7.501  -8.425  -0.375
  283   1HB   ASN  35          HB2       ASN  35  -5.210  -9.531  -0.522
  284   2HB   ASN  35          HB1       ASN  35  -5.519 -10.192   1.083
  285   1HD2  ASN  35          HD21      ASN  35  -5.893 -10.858  -2.210
  286   2HD2  ASN  35          HD22      ASN  35  -7.105 -12.041  -2.093
  287    H    ASP  36           HN       ASP  36  -6.376  -8.296   2.956
  288    HA   ASP  36           HA       ASP  36  -8.542  -9.920   4.056
  289   1HB   ASP  36          HB2       ASP  36  -6.217  -8.313   4.984
  290   2HB   ASP  36          HB1       ASP  36  -7.530  -8.516   6.146
  291    H    ASN  37           HN       ASN  37  -7.855  -6.435   3.755
  292    HA   ASN  37           HA       ASN  37 -10.269  -5.594   5.157
  293   1HB   ASN  37          HB2       ASN  37  -8.332  -4.182   3.289
  294   2HB   ASN  37          HB1       ASN  37  -9.552  -3.367   4.274
  295   1HD2  ASN  37          HD21      ASN  37  -8.411  -2.388   5.963
  296   2HD2  ASN  37          HD22      ASN  37  -7.252  -3.179   6.933
  297    H    GLY  38           HN       GLY  38  -9.359  -6.163   1.786
  298   1HA   GLY  38          HA2       GLY  38 -10.864  -6.667   0.004
  299   2HA   GLY  38          HA1       GLY  38 -12.207  -6.145   1.022
  300    H    ILE  39           HN       ILE  39  -9.223  -4.379   0.205
  301    HA   ILE  39           HA       ILE  39 -10.928  -2.314  -1.154
  302    HB   ILE  39           HB       ILE  39  -8.536  -1.960   0.687
  303   1HG1  ILE  39          HG12      ILE  39 -10.564  -2.639   1.904
  304   2HG1  ILE  39          HG11      ILE  39 -10.194  -0.944   2.233
  305   1HG2  ILE  39          HG21      ILE  39  -8.506   0.257   0.171
  306   2HG2  ILE  39          HG22      ILE  39 -10.258   0.347   0.005
  307   3HG2  ILE  39          HG23      ILE  39  -9.279  -0.268  -1.324
  308   1HD1  ILE  39          HD11      ILE  39 -12.382  -0.603   1.701
  309   2HD1  ILE  39          HD12      ILE  39 -12.507  -2.128   0.824
  310   3HD1  ILE  39          HD13      ILE  39 -11.810  -0.714   0.036
  311    H    ASP  40           HN       ASP  40 -10.133  -3.792  -3.037
  312    HA   ASP  40           HA       ASP  40  -7.380  -2.975  -3.909
  313   1HB   ASP  40          HB2       ASP  40  -8.226  -5.454  -3.503
  314   2HB   ASP  40          HB1       ASP  40  -8.952  -5.241  -5.100
  315    H    GLY  41           HN       GLY  41  -8.036  -0.996  -4.930
  316   1HA   GLY  41          HA2       GLY  41  -9.796  -1.371  -7.323
  317   2HA   GLY  41          HA1       GLY  41  -9.847   0.097  -6.342
  318    H    GLU  42           HN       GLU  42  -8.097   1.591  -6.490
  319    HA   GLU  42           HA       GLU  42  -6.186   1.083  -8.748
  320   1HB   GLU  42          HB2       GLU  42  -8.267   3.094  -8.329
  321   2HB   GLU  42          HB1       GLU  42  -6.696   3.840  -8.617
  322   1HG   GLU  42          HG2       GLU  42  -6.567   3.075 -10.768
  323   2HG   GLU  42          HG1       GLU  42  -7.394   1.562 -10.390
  324    H    TRP  43           HN       TRP  43  -4.123   1.145  -7.979
  325    HA   TRP  43           HA       TRP  43  -3.520   2.667  -5.484
  326   1HB   TRP  43          HB2       TRP  43  -2.026   0.604  -7.139
  327   2HB   TRP  43          HB1       TRP  43  -1.336   1.395  -5.734
  328    HD1  TRP  43           HD1      TRP  43  -5.017   0.276  -5.743
  329    HE1  TRP  43           HE1      TRP  43  -5.277  -1.642  -4.063
  330    HE3  TRP  43           HE3      TRP  43  -0.139  -0.451  -4.505
  331    HZ2  TRP  43           HZ2      TRP  43  -3.642  -3.249  -2.374
  332    HZ3  TRP  43           HZ3      TRP  43   0.484  -2.175  -2.827
  333    HH2  TRP  43           HH2      TRP  43  -1.252  -3.567  -1.764
  334    H    THR  44           HN       THR  44  -1.350   3.853  -5.551
  335    HA   THR  44           HA       THR  44  -0.530   4.827  -8.230
  336    HB   THR  44           HB       THR  44  -0.853   7.171  -7.540
  337    HG1  THR  44           HG1      THR  44  -1.828   7.627  -5.599
  338   1HG2  THR  44          HG21      THR  44  -3.202   7.257  -7.834
  339   2HG2  THR  44          HG22      THR  44  -3.443   5.715  -7.013
  340   3HG2  THR  44          HG23      THR  44  -2.714   5.754  -8.618
  341    H    TYR  45           HN       TYR  45   1.662   5.060  -8.243
  342    HA   TYR  45           HA       TYR  45   3.118   4.821  -5.660
  343   1HB   TYR  45          HB2       TYR  45   3.571   3.280  -7.553
  344   2HB   TYR  45          HB1       TYR  45   4.019   4.656  -8.558
  345    HD1  TYR  45           HD1      TYR  45   4.789   3.716  -4.999
  346    HD2  TYR  45           HD2      TYR  45   6.320   4.699  -8.890
  347    HE1  TYR  45           HE1      TYR  45   7.103   3.619  -4.113
  348    HE2  TYR  45           HE2      TYR  45   8.632   4.604  -8.003
  349    HH   TYR  45           HH       TYR  45   9.732   3.275  -5.876
  350    H    ASP  46           HN       ASP  46   4.958   6.281  -5.258
  351    HA   ASP  46           HA       ASP  46   5.209   8.727  -6.885
  352   1HB   ASP  46          HB2       ASP  46   4.593  10.178  -4.950
  353   2HB   ASP  46          HB1       ASP  46   3.245   9.177  -5.485
  354    H    ASP  47           HN       ASP  47   7.410   8.796  -7.022
  355    HA   ASP  47           HA       ASP  47   9.178   7.720  -4.981
  356   1HB   ASP  47          HB2       ASP  47  10.919   8.615  -6.515
  357   2HB   ASP  47          HB1       ASP  47   9.685   7.707  -7.387
  358    H    ALA  48           HN       ALA  48   7.637  10.792  -5.406
  359    HA   ALA  48           HA       ALA  48   9.514  12.620  -4.336
  360   1HB   ALA  48          HB1       ALA  48   7.624  14.011  -4.058
  361   2HB   ALA  48          HB2       ALA  48   6.571  12.650  -3.670
  362   3HB   ALA  48          HB3       ALA  48   7.122  12.895  -5.328
  363    H    THR  49           HN       THR  49   7.600  10.154  -2.720
  364    HA   THR  49           HA       THR  49   9.073  10.672  -0.202
  365    HB   THR  49           HB       THR  49   7.096  12.132  -0.115
  366    HG1  THR  49           HG1      THR  49   7.746  11.041   1.788
  367   1HG2  THR  49          HG21      THR  49   5.626   9.565  -0.738
  368   2HG2  THR  49          HG22      THR  49   5.590  11.078  -1.643
  369   3HG2  THR  49          HG23      THR  49   4.822  10.979  -0.059
  370    H    LYS  50           HN       LYS  50   8.821   8.491  -2.261
  371    HA   LYS  50           HA       LYS  50   8.386   6.168  -2.441
  372   1HB   LYS  50          HB2       LYS  50   9.613   4.998  -0.639
  373   2HB   LYS  50          HB1       LYS  50  10.491   6.409  -1.223
  374   1HG   LYS  50          HG2       LYS  50   9.848   7.704   0.700
  375   2HG   LYS  50          HG1       LYS  50   8.703   6.469   1.223
  376   1HD   LYS  50          HD2       LYS  50  11.705   6.083   1.021
  377   2HD   LYS  50          HD1       LYS  50  10.830   6.403   2.517
  378   1HE   LYS  50          HE2       LYS  50  10.617   4.145   2.703
  379   2HE   LYS  50          HE1       LYS  50   9.445   4.250   1.376
  380   1HZ   LYS  50          HZ1       LYS  50  12.379   3.848   1.164
  381   2HZ   LYS  50          HZ2       LYS  50  11.393   4.233  -0.165
  382   3HZ   LYS  50          HZ3       LYS  50  11.158   2.777   0.678
  383    H    THR  51           HN       THR  51   5.924   7.122  -1.940
  384    HA   THR  51           HA       THR  51   4.837   5.347   0.226
  385    HB   THR  51           HB       THR  51   3.691   7.944  -0.851
  386    HG1  THR  51           HG1      THR  51   4.616   8.899   0.937
  387   1HG2  THR  51          HG21      THR  51   2.735   7.672   1.659
  388   2HG2  THR  51          HG22      THR  51   2.922   5.972   1.232
  389   3HG2  THR  51          HG23      THR  51   1.906   7.022   0.245
  390    H    TRP  52           HN       TRP  52   2.425   4.801  -0.304
  391    HA   TRP  52           HA       TRP  52   2.034   4.429  -3.256
  392   1HB   TRP  52          HB2       TRP  52   1.961   2.479  -0.962
  393   2HB   TRP  52          HB1       TRP  52   1.045   2.168  -2.429
  394    HD1  TRP  52           HD1      TRP  52   4.566   2.242  -1.067
  395    HE1  TRP  52           HE1      TRP  52   6.181   1.330  -2.864
  396    HE3  TRP  52           HE3      TRP  52   1.380   1.965  -5.005
  397    HZ2  TRP  52           HZ2      TRP  52   6.107   0.572  -5.632
  398    HZ3  TRP  52           HZ3      TRP  52   2.154   1.142  -7.219
  399    HH2  TRP  52           HH2      TRP  52   4.515   0.445  -7.534
  400    H    THR  53           HN       THR  53  -0.385   3.232  -3.293
  401    HA   THR  53           HA       THR  53  -2.257   4.512  -1.415
  402    HB   THR  53           HB       THR  53  -2.431   5.137  -4.370
  403    HG1  THR  53           HG1      THR  53  -0.656   6.220  -3.880
  404   1HG2  THR  53          HG21      THR  53  -3.679   7.153  -3.203
  405   2HG2  THR  53          HG22      THR  53  -3.823   6.010  -1.867
  406   3HG2  THR  53          HG23      THR  53  -4.504   5.613  -3.445
  407    H    VAL  54           HN       VAL  54  -4.588   3.935  -2.116
  408    HA   VAL  54           HA       VAL  54  -5.068   1.760  -3.959
  409    HB   VAL  54           HB       VAL  54  -3.805   0.426  -2.404
  410   1HG1  VAL  54          HG11      VAL  54  -3.536   1.621  -0.459
  411   2HG1  VAL  54          HG12      VAL  54  -4.729   0.439   0.077
  412   3HG1  VAL  54          HG13      VAL  54  -5.236   2.067  -0.367
  413   1HG2  VAL  54          HG21      VAL  54  -6.527  -0.113  -1.276
  414   2HG2  VAL  54          HG22      VAL  54  -5.319  -1.251  -1.880
  415   3HG2  VAL  54          HG23      VAL  54  -6.292  -0.305  -3.014
  416    H    THR  55           HN       THR  55  -6.852   3.139  -4.474
  417    HA   THR  55           HA       THR  55  -8.859   3.731  -2.371
  418    HB   THR  55           HB       THR  55  -8.960   4.369  -5.327
  419    HG1  THR  55           HG1      THR  55  -7.121   5.324  -4.923
  420   1HG2  THR  55          HG21      THR  55 -10.429   6.080  -4.704
  421   2HG2  THR  55          HG22      THR  55  -9.843   6.110  -3.041
  422   3HG2  THR  55          HG23      THR  55 -10.871   4.787  -3.589
  423    H    GLU  56           HN       GLU  56 -10.792   2.623  -2.209
  424    HA   GLU  56           HA       GLU  56 -11.168   0.134  -3.664
  425   1HB   GLU  56          HB2       GLU  56 -11.848   0.786  -1.272
  426   2HB   GLU  56          HB1       GLU  56 -13.200   1.649  -2.006
  427   1HG   GLU  56          HG2       GLU  56 -13.503  -0.678  -3.284
  428   2HG   GLU  56          HG1       GLU  56 -12.687  -1.289  -1.844
  Start of MODEL   37
    1   1H    THR   1          HT1       THR   1  15.532   2.322   4.042
    2   2H    THR   1          HT2       THR   1  14.768   3.444   5.062
    3   3H    THR   1          HT3       THR   1  16.007   3.950   4.016
    4    HA   THR   1           HA       THR   1  13.992   4.639   3.002
    5    HB   THR   1           HB       THR   1  14.915   2.016   1.789
    6    HG1  THR   1           HG1      THR   1  16.751   3.095   2.099
    7   1HG2  THR   1          HG21      THR   1  14.605   3.749  -0.263
    8   2HG2  THR   1          HG22      THR   1  13.381   4.374   0.842
    9   3HG2  THR   1          HG23      THR   1  13.312   2.695   0.307
   10    H    THR   2           HN       THR   2  12.229   4.237   4.558
   11    HA   THR   2           HA       THR   2  10.863   1.601   4.380
   12    HB   THR   2           HB       THR   2  10.068   4.025   6.002
   13    HG1  THR   2           HG1      THR   2  11.451   3.054   7.623
   14   1HG2  THR   2          HG21      THR   2   8.629   1.921   5.824
   15   2HG2  THR   2          HG22      THR   2   9.064   2.426   7.456
   16   3HG2  THR   2          HG23      THR   2   9.918   1.087   6.691
   17    H    PHE   3           HN       PHE   3   9.132   1.337   3.034
   18    HA   PHE   3           HA       PHE   3   8.108   3.586   1.455
   19   1HB   PHE   3          HB2       PHE   3   7.426   0.636   1.662
   20   2HB   PHE   3          HB1       PHE   3   6.741   1.722   0.452
   21    HD1  PHE   3           HD1      PHE   3   8.771   3.351  -0.566
   22    HD2  PHE   3           HD2      PHE   3   9.141  -0.702   0.819
   23    HE1  PHE   3           HE1      PHE   3  10.785   3.050  -1.980
   24    HE2  PHE   3           HE2      PHE   3  11.155  -1.000  -0.596
   25    HZ   PHE   3           HZ       PHE   3  11.977   0.875  -1.995
   26    H    LYS   4           HN       LYS   4   5.499   3.427   1.204
   27    HA   LYS   4           HA       LYS   4   4.149   3.078   3.821
   28   1HB   LYS   4          HB2       LYS   4   5.342   5.417   3.440
   29   2HB   LYS   4          HB1       LYS   4   3.920   5.738   2.450
   30   1HG   LYS   4          HG2       LYS   4   2.534   4.953   4.459
   31   2HG   LYS   4          HG1       LYS   4   4.025   5.069   5.392
   32   1HD   LYS   4          HD2       LYS   4   3.424   7.233   5.709
   33   2HD   LYS   4          HD1       LYS   4   4.031   7.470   4.070
   34   1HE   LYS   4          HE2       LYS   4   1.920   7.690   3.186
   35   2HE   LYS   4          HE1       LYS   4   1.223   6.494   4.298
   36   1HZ   LYS   4          HZ1       LYS   4   0.508   8.739   4.876
   37   2HZ   LYS   4          HZ2       LYS   4   2.126   9.228   5.042
   38   3HZ   LYS   4          HZ3       LYS   4   1.470   8.078   6.106
   39    H    LEU   5           HN       LEU   5   1.869   2.912   3.587
   40    HA   LEU   5           HA       LEU   5   0.651   3.380   0.920
   41   1HB   LEU   5          HB2       LEU   5   1.690   0.962   1.343
   42   2HB   LEU   5          HB1       LEU   5   0.205   0.728   2.253
   43    HG   LEU   5           HG       LEU   5  -0.323   2.007  -0.319
   44   1HD1  LEU   5          HD11      LEU   5   1.761   0.445  -0.707
   45   2HD1  LEU   5          HD12      LEU   5   0.399   0.389  -1.832
   46   3HD1  LEU   5          HD13      LEU   5   0.567  -0.851  -0.578
   47   1HD2  LEU   5          HD21      LEU   5  -2.076   0.998   1.021
   48   2HD2  LEU   5          HD22      LEU   5  -1.233  -0.551   1.036
   49   3HD2  LEU   5          HD23      LEU   5  -1.918   0.066  -0.468
   50    H    ILE   6           HN       ILE   6  -1.485   4.010   1.147
   51    HA   ILE   6           HA       ILE   6  -2.624   3.968   3.916
   52    HB   ILE   6           HB       ILE   6  -3.106   5.721   1.486
   53   1HG1  ILE   6          HG12      ILE   6  -0.924   6.048   2.614
   54   2HG1  ILE   6          HG11      ILE   6  -1.975   7.448   2.824
   55   1HG2  ILE   6          HG21      ILE   6  -4.291   7.144   3.331
   56   2HG2  ILE   6          HG22      ILE   6  -4.420   5.609   4.191
   57   3HG2  ILE   6          HG23      ILE   6  -5.165   5.795   2.603
   58   1HD1  ILE   6          HD11      ILE   6  -2.591   5.781   4.990
   59   2HD1  ILE   6          HD12      ILE   6  -1.612   7.246   5.043
   60   3HD1  ILE   6          HD13      ILE   6  -0.838   5.676   4.836
   61    H    ILE   7           HN       ILE   7  -4.494   2.826   4.258
   62    HA   ILE   7           HA       ILE   7  -5.667   1.295   2.022
   63    HB   ILE   7           HB       ILE   7  -6.239   1.395   5.006
   64   1HG1  ILE   7          HG12      ILE   7  -4.683  -0.684   3.444
   65   2HG1  ILE   7          HG11      ILE   7  -3.907   0.677   4.255
   66   1HG2  ILE   7          HG21      ILE   7  -8.146   0.421   3.990
   67   2HG2  ILE   7          HG22      ILE   7  -7.151  -0.959   4.454
   68   3HG2  ILE   7          HG23      ILE   7  -7.176  -0.415   2.777
   69   1HD1  ILE   7          HD11      ILE   7  -3.810  -1.004   5.888
   70   2HD1  ILE   7          HD12      ILE   7  -5.401  -1.637   5.466
   71   3HD1  ILE   7          HD13      ILE   7  -5.262  -0.114   6.344
   72    H    ASN   8           HN       ASN   8  -7.279   2.239   0.844
   73    HA   ASN   8           HA       ASN   8  -9.069   4.234   2.179
   74   1HB   ASN   8          HB2       ASN   8  -8.017   3.761  -0.593
   75   2HB   ASN   8          HB1       ASN   8  -9.552   4.608  -0.407
   76   1HD2  ASN   8          HD21      ASN   8  -7.429   6.061  -1.472
   77   2HD2  ASN   8          HD22      ASN   8  -6.857   7.189  -0.327
   78    H    GLY   9           HN       GLY   9  -9.721   1.675   2.847
   79   1HA   GLY   9          HA2       GLY   9 -11.613   0.526   0.924
   80   2HA   GLY   9          HA1       GLY   9 -11.290  -0.081   2.553
   81    H    LYS  10           HN       LYS  10 -13.873   0.562   1.128
   82    HA   LYS  10           HA       LYS  10 -15.139   2.880   2.093
   83   1HB   LYS  10          HB2       LYS  10 -16.188   0.076   1.612
   84   2HB   LYS  10          HB1       LYS  10 -17.215   1.500   1.787
   85   1HG   LYS  10          HG2       LYS  10 -15.965   2.551  -0.128
   86   2HG   LYS  10          HG1       LYS  10 -15.130   1.014  -0.359
   87   1HD   LYS  10          HD2       LYS  10 -16.888   0.675  -1.807
   88   2HD   LYS  10          HD1       LYS  10 -17.646   0.092  -0.325
   89   1HE   LYS  10          HE2       LYS  10 -18.948   2.017  -0.074
   90   2HE   LYS  10          HE1       LYS  10 -17.828   3.017  -1.020
   91   1HZ   LYS  10          HZ1       LYS  10 -19.519   0.808  -2.067
   92   2HZ   LYS  10          HZ2       LYS  10 -18.378   1.676  -2.978
   93   3HZ   LYS  10          HZ3       LYS  10 -19.750   2.463  -2.356
   94    H    THR  11           HN       THR  11 -14.501  -0.186   3.730
   95    HA   THR  11           HA       THR  11 -15.775   0.910   6.217
   96    HB   THR  11           HB       THR  11 -15.245  -1.964   5.397
   97    HG1  THR  11           HG1      THR  11 -16.832  -1.451   4.087
   98   1HG2  THR  11          HG21      THR  11 -15.497  -1.284   7.880
   99   2HG2  THR  11          HG22      THR  11 -16.522  -2.587   7.279
  100   3HG2  THR  11          HG23      THR  11 -17.184  -0.964   7.476
  101    H    LEU  12           HN       LEU  12 -12.936  -0.706   4.848
  102    HA   LEU  12           HA       LEU  12 -11.543  -0.520   7.490
  103   1HB   LEU  12          HB2       LEU  12 -10.999  -2.060   4.932
  104   2HB   LEU  12          HB1       LEU  12  -9.970  -2.124   6.363
  105    HG   LEU  12           HG       LEU  12 -12.906  -2.655   6.663
  106   1HD1  LEU  12          HD11      LEU  12 -11.802  -4.026   4.722
  107   2HD1  LEU  12          HD12      LEU  12 -12.756  -4.876   5.937
  108   3HD1  LEU  12          HD13      LEU  12 -10.995  -4.890   6.030
  109   1HD2  LEU  12          HD21      LEU  12 -11.931  -4.241   8.398
  110   2HD2  LEU  12          HD22      LEU  12 -11.619  -2.530   8.692
  111   3HD2  LEU  12          HD23      LEU  12 -10.350  -3.555   8.020
  112    H    LYS  13           HN       LYS  13  -9.762   0.819   7.701
  113    HA   LYS  13           HA       LYS  13  -8.468   1.976   5.292
  114   1HB   LYS  13          HB2       LYS  13 -10.367   3.314   7.122
  115   2HB   LYS  13          HB1       LYS  13  -8.883   4.219   6.823
  116   1HG   LYS  13          HG2       LYS  13  -9.369   4.552   4.607
  117   2HG   LYS  13          HG1       LYS  13 -10.183   2.996   4.445
  118   1HD   LYS  13          HD2       LYS  13 -12.187   3.813   5.409
  119   2HD   LYS  13          HD1       LYS  13 -11.384   5.239   6.069
  120   1HE   LYS  13          HE2       LYS  13 -10.852   5.569   3.413
  121   2HE   LYS  13          HE1       LYS  13 -12.438   4.776   3.339
  122   1HZ   LYS  13          HZ1       LYS  13 -12.766   7.127   3.618
  123   2HZ   LYS  13          HZ2       LYS  13 -11.723   7.163   4.959
  124   3HZ   LYS  13          HZ3       LYS  13 -13.209   6.347   5.057
  125    H    GLY  14           HN       GLY  14  -6.765   3.728   6.302
  126   1HA   GLY  14          HA2       GLY  14  -5.487   4.013   8.526
  127   2HA   GLY  14          HA1       GLY  14  -5.338   2.257   8.473
  128    H    GLU  15           HN       GLU  15  -2.965   3.253   8.571
  129    HA   GLU  15           HA       GLU  15  -1.974   3.460   5.744
  130   1HB   GLU  15          HB2       GLU  15  -0.201   4.923   6.706
  131   2HB   GLU  15          HB1       GLU  15  -1.813   5.575   6.992
  132   1HG   GLU  15          HG2       GLU  15  -1.812   4.790   9.271
  133   2HG   GLU  15          HG1       GLU  15  -0.330   3.870   9.010
  134    H    THR  16           HN       THR  16   0.346   2.671   5.544
  135    HA   THR  16           HA       THR  16   1.348   0.858   7.633
  136    HB   THR  16           HB       THR  16  -0.445  -0.459   6.589
  137    HG1  THR  16           HG1      THR  16   0.780  -2.182   6.433
  138   1HG2  THR  16          HG21      THR  16   1.019   0.251   4.035
  139   2HG2  THR  16          HG22      THR  16  -0.674   0.542   4.436
  140   3HG2  THR  16          HG23      THR  16  -0.110  -1.101   4.138
  141    H    THR  17           HN       THR  17   3.483   0.026   7.101
  142    HA   THR  17           HA       THR  17   4.755   1.172   4.645
  143    HB   THR  17           HB       THR  17   6.618   1.949   6.072
  144    HG1  THR  17           HG1      THR  17   6.498   1.722   8.262
  145   1HG2  THR  17          HG21      THR  17   4.145   3.134   5.820
  146   2HG2  THR  17          HG22      THR  17   5.569   3.910   6.511
  147   3HG2  THR  17          HG23      THR  17   4.384   3.142   7.567
  148    H    THR  18           HN       THR  18   6.786   0.049   4.096
  149    HA   THR  18           HA       THR  18   7.306  -2.483   5.545
  150    HB   THR  18           HB       THR  18   5.808  -2.164   3.067
  151    HG1  THR  18           HG1      THR  18   6.667  -4.412   4.575
  152   1HG2  THR  18          HG21      THR  18   8.056  -2.447   1.998
  153   2HG2  THR  18          HG22      THR  18   6.934  -3.760   1.637
  154   3HG2  THR  18          HG23      THR  18   8.216  -3.998   2.824
  155    H    GLU  19           HN       GLU  19   9.401  -3.446   4.831
  156    HA   GLU  19           HA       GLU  19  11.286  -1.369   3.761
  157   1HB   GLU  19          HB2       GLU  19  11.477  -2.039   6.188
  158   2HB   GLU  19          HB1       GLU  19  11.825  -3.684   5.651
  159   1HG   GLU  19          HG2       GLU  19  13.610  -2.317   4.136
  160   2HG   GLU  19          HG1       GLU  19  13.534  -1.258   5.545
  161    H    ALA  20           HN       ALA  20  11.875  -1.937   1.698
  162    HA   ALA  20           HA       ALA  20  12.672  -4.750   1.152
  163   1HB   ALA  20          HB1       ALA  20  11.186  -4.318  -1.037
  164   2HB   ALA  20          HB2       ALA  20  10.319  -3.256   0.074
  165   3HB   ALA  20          HB3       ALA  20  10.482  -4.975   0.441
  166    H    VAL  21           HN       VAL  21  13.526  -4.851  -1.212
  167    HA   VAL  21           HA       VAL  21  15.699  -3.059  -1.564
  168    HB   VAL  21           HB       VAL  21  15.833  -4.128  -3.803
  169   1HG1  VAL  21          HG11      VAL  21  16.330  -6.243  -2.980
  170   2HG1  VAL  21          HG12      VAL  21  14.900  -6.291  -1.948
  171   3HG1  VAL  21          HG13      VAL  21  16.289  -5.309  -1.485
  172   1HG2  VAL  21          HG21      VAL  21  13.624  -4.240  -4.610
  173   2HG2  VAL  21          HG22      VAL  21  13.003  -4.917  -3.105
  174   3HG2  VAL  21          HG23      VAL  21  13.967  -5.917  -4.190
  175    H    ASP  22           HN       ASP  22  12.441  -3.017  -2.993
  176    HA   ASP  22           HA       ASP  22  12.778  -0.141  -3.648
  177   1HB   ASP  22          HB2       ASP  22  12.046  -2.313  -5.644
  178   2HB   ASP  22          HB1       ASP  22  12.049  -0.582  -5.984
  179    H    ALA  23           HN       ALA  23  10.618   0.792  -4.324
  180    HA   ALA  23           HA       ALA  23   8.520   0.029  -2.525
  181   1HB   ALA  23          HB1       ALA  23   7.215   1.601  -4.144
  182   2HB   ALA  23          HB2       ALA  23   8.765   1.794  -4.961
  183   3HB   ALA  23          HB3       ALA  23   8.593   2.271  -3.272
  184    H    ALA  24           HN       ALA  24   9.287  -0.952  -5.811
  185    HA   ALA  24           HA       ALA  24   6.756  -1.991  -6.629
  186   1HB   ALA  24          HB1       ALA  24   9.046  -1.631  -7.854
  187   2HB   ALA  24          HB2       ALA  24   8.016  -2.971  -8.359
  188   3HB   ALA  24          HB3       ALA  24   9.399  -3.270  -7.306
  189    H    THR  25           HN       THR  25   9.463  -3.556  -4.892
  190    HA   THR  25           HA       THR  25   8.137  -6.130  -4.657
  191    HB   THR  25           HB       THR  25  10.514  -4.784  -3.342
  192    HG1  THR  25           HG1      THR  25  11.621  -6.249  -4.663
  193   1HG2  THR  25          HG21      THR  25   9.553  -6.436  -1.756
  194   2HG2  THR  25          HG22      THR  25  11.119  -6.963  -2.384
  195   3HG2  THR  25          HG23      THR  25   9.633  -7.669  -3.019
  196    H    ALA  26           HN       ALA  26   8.492  -3.295  -2.510
  197    HA   ALA  26           HA       ALA  26   7.337  -4.461  -0.182
  198   1HB   ALA  26          HB1       ALA  26   6.873  -2.026   0.393
  199   2HB   ALA  26          HB2       ALA  26   7.429  -1.617  -1.236
  200   3HB   ALA  26          HB3       ALA  26   8.540  -2.367  -0.090
  201    H    GLU  27           HN       GLU  27   5.716  -2.069  -2.308
  202    HA   GLU  27           HA       GLU  27   3.099  -2.303  -1.469
  203   1HB   GLU  27          HB2       GLU  27   2.515  -1.624  -3.788
  204   2HB   GLU  27          HB1       GLU  27   3.930  -0.759  -3.192
  205   1HG   GLU  27          HG2       GLU  27   4.778  -1.416  -5.226
  206   2HG   GLU  27          HG1       GLU  27   5.176  -2.867  -4.306
  207    H    LYS  28           HN       LYS  28   4.858  -4.628  -3.416
  208    HA   LYS  28           HA       LYS  28   2.654  -6.246  -4.312
  209   1HB   LYS  28          HB2       LYS  28   4.577  -6.807  -5.438
  210   2HB   LYS  28          HB1       LYS  28   5.609  -6.297  -4.118
  211   1HG   LYS  28          HG2       LYS  28   4.883  -8.522  -2.973
  212   2HG   LYS  28          HG1       LYS  28   4.344  -8.990  -4.586
  213   1HD   LYS  28          HD2       LYS  28   6.529  -8.829  -5.481
  214   2HD   LYS  28          HD1       LYS  28   7.111  -7.871  -4.115
  215   1HE   LYS  28          HE2       LYS  28   6.874  -9.826  -2.625
  216   2HE   LYS  28          HE1       LYS  28   6.269 -10.795  -3.985
  217   1HZ   LYS  28          HZ1       LYS  28   8.710 -10.993  -3.619
  218   2HZ   LYS  28          HZ2       LYS  28   8.862  -9.346  -4.008
  219   3HZ   LYS  28          HZ3       LYS  28   8.292 -10.448  -5.169
  220    H    VAL  29           HN       VAL  29   4.748  -6.431  -1.423
  221    HA   VAL  29           HA       VAL  29   3.326  -8.652  -0.188
  222    HB   VAL  29           HB       VAL  29   5.328  -6.531   0.640
  223   1HG1  VAL  29          HG11      VAL  29   3.874  -6.907   2.619
  224   2HG1  VAL  29          HG12      VAL  29   5.498  -7.557   2.871
  225   3HG1  VAL  29          HG13      VAL  29   4.163  -8.645   2.486
  226   1HG2  VAL  29          HG21      VAL  29   5.359  -9.544   0.352
  227   2HG2  VAL  29          HG22      VAL  29   6.689  -8.630   1.064
  228   3HG2  VAL  29          HG23      VAL  29   6.236  -8.362  -0.619
  229    H    LEU  30           HN       LEU  30   3.046  -5.123  -0.151
  230    HA   LEU  30           HA       LEU  30   1.213  -4.940   2.054
  231   1HB   LEU  30          HB2       LEU  30   1.829  -3.233  -0.369
  232   2HB   LEU  30          HB1       LEU  30   0.663  -2.725   0.834
  233    HG   LEU  30           HG       LEU  30   3.237  -1.978   0.943
  234   1HD1  LEU  30          HD11      LEU  30   1.456  -2.675   3.273
  235   2HD1  LEU  30          HD12      LEU  30   1.635  -1.112   2.470
  236   3HD1  LEU  30          HD13      LEU  30   2.966  -1.768   3.436
  237   1HD2  LEU  30          HD21      LEU  30   3.211  -4.648   2.359
  238   2HD2  LEU  30          HD22      LEU  30   4.287  -3.354   2.835
  239   3HD2  LEU  30          HD23      LEU  30   4.388  -4.014   1.215
  240    H    LYS  31           HN       LYS  31   0.876  -5.563  -1.400
  241    HA   LYS  31           HA       LYS  31  -1.973  -5.348  -1.680
  242   1HB   LYS  31          HB2       LYS  31   0.067  -5.837  -3.350
  243   2HB   LYS  31          HB1       LYS  31  -0.347  -7.500  -3.007
  244   1HG   LYS  31          HG2       LYS  31  -2.450  -5.503  -3.845
  245   2HG   LYS  31          HG1       LYS  31  -1.510  -6.405  -5.032
  246   1HD   LYS  31          HD2       LYS  31  -3.238  -7.609  -2.844
  247   2HD   LYS  31          HD1       LYS  31  -3.622  -7.572  -4.564
  248   1HE   LYS  31          HE2       LYS  31  -1.032  -8.694  -4.402
  249   2HE   LYS  31          HE1       LYS  31  -1.982  -9.481  -3.121
  250   1HZ   LYS  31          HZ1       LYS  31  -2.404 -10.651  -5.145
  251   2HZ   LYS  31          HZ2       LYS  31  -2.712  -9.211  -5.992
  252   3HZ   LYS  31          HZ3       LYS  31  -3.793  -9.743  -4.794
  253    H    GLN  32           HN       GLN  32   0.172  -8.028  -0.782
  254    HA   GLN  32           HA       GLN  32  -1.730 -10.099  -0.430
  255   1HB   GLN  32          HB2       GLN  32   0.992  -9.400   0.488
  256   2HB   GLN  32          HB1       GLN  32   0.131 -10.580   1.479
  257   1HG   GLN  32          HG2       GLN  32  -0.434 -11.726  -0.791
  258   2HG   GLN  32          HG1       GLN  32   0.908 -10.770  -1.419
  259   1HE2  GLN  32          HE21      GLN  32   2.781 -12.009  -1.441
  260   2HE2  GLN  32          HE22      GLN  32   3.235 -13.121  -0.230
  261    H    TYR  33           HN       TYR  33  -0.666  -7.529   1.780
  262    HA   TYR  33           HA       TYR  33  -2.206  -8.359   4.089
  263   1HB   TYR  33          HB2       TYR  33  -0.321  -6.808   4.225
  264   2HB   TYR  33          HB1       TYR  33  -1.119  -5.682   3.130
  265    HD1  TYR  33           HD1      TYR  33  -1.374  -7.317   6.442
  266    HD2  TYR  33           HD2      TYR  33  -2.699  -4.097   3.934
  267    HE1  TYR  33           HE1      TYR  33  -2.523  -6.297   8.372
  268    HE2  TYR  33           HE2      TYR  33  -3.848  -3.064   5.872
  269    HH   TYR  33           HH       TYR  33  -3.709  -3.096   8.327
  270    H    ILE  34           HN       ILE  34  -2.793  -6.185   1.347
  271    HA   ILE  34           HA       ILE  34  -5.405  -5.254   2.123
  272    HB   ILE  34           HB       ILE  34  -4.053  -5.630  -0.569
  273   1HG1  ILE  34          HG12      ILE  34  -2.939  -4.200   1.264
  274   2HG1  ILE  34          HG11      ILE  34  -3.166  -3.448  -0.309
  275   1HG2  ILE  34          HG21      ILE  34  -5.618  -3.842  -1.348
  276   2HG2  ILE  34          HG22      ILE  34  -6.469  -3.969   0.191
  277   3HG2  ILE  34          HG23      ILE  34  -6.437  -5.343  -0.914
  278   1HD1  ILE  34          HD11      ILE  34  -5.215  -2.347   0.536
  279   2HD1  ILE  34          HD12      ILE  34  -3.807  -1.914   1.506
  280   3HD1  ILE  34          HD13      ILE  34  -4.964  -3.100   2.111
  281    H    ASN  35           HN       ASN  35  -4.226  -8.159   0.522
  282    HA   ASN  35           HA       ASN  35  -6.612  -9.132  -0.675
  283   1HB   ASN  35          HB2       ASN  35  -4.214  -9.969  -0.849
  284   2HB   ASN  35          HB1       ASN  35  -4.460 -10.759   0.708
  285   1HD2  ASN  35          HD21      ASN  35  -5.002 -12.922   0.431
  286   2HD2  ASN  35          HD22      ASN  35  -5.958 -13.538  -0.829
  287    H    ASP  36           HN       ASP  36  -5.581  -9.084   2.687
  288    HA   ASP  36           HA       ASP  36  -7.609 -11.001   3.597
  289   1HB   ASP  36          HB2       ASP  36  -5.373 -10.676   4.649
  290   2HB   ASP  36          HB1       ASP  36  -5.842  -9.033   5.090
  291    H    ASN  37           HN       ASN  37  -7.072  -7.483   4.051
  292    HA   ASN  37           HA       ASN  37  -9.532  -6.923   5.387
  293   1HB   ASN  37          HB2       ASN  37  -7.803  -5.223   3.554
  294   2HB   ASN  37          HB1       ASN  37  -9.018  -4.591   4.671
  295   1HD2  ASN  37          HD21      ASN  37  -8.177  -3.972   6.658
  296   2HD2  ASN  37          HD22      ASN  37  -6.769  -4.620   7.372
  297    H    GLY  38           HN       GLY  38  -8.764  -7.315   1.974
  298   1HA   GLY  38          HA2       GLY  38 -10.289  -7.730   0.203
  299   2HA   GLY  38          HA1       GLY  38 -11.621  -7.410   1.315
  300    H    ILE  39           HN       ILE  39  -8.932  -5.186   0.928
  301    HA   ILE  39           HA       ILE  39 -10.820  -3.231  -0.346
  302    HB   ILE  39           HB       ILE  39  -8.418  -2.821   1.471
  303   1HG1  ILE  39          HG12      ILE  39 -10.345  -3.813   2.649
  304   2HG1  ILE  39          HG11      ILE  39 -10.110  -2.136   3.147
  305   1HG2  ILE  39          HG21      ILE  39  -8.637  -0.899   0.049
  306   2HG2  ILE  39          HG22      ILE  39  -9.364  -0.466   1.595
  307   3HG2  ILE  39          HG23      ILE  39 -10.392  -0.890   0.227
  308   1HD1  ILE  39          HD11      ILE  39 -11.813  -1.898   0.971
  309   2HD1  ILE  39          HD12      ILE  39 -12.305  -1.853   2.664
  310   3HD1  ILE  39          HD13      ILE  39 -12.385  -3.367   1.763
  311    H    ASP  40           HN       ASP  40  -9.960  -4.420  -2.385
  312    HA   ASP  40           HA       ASP  40  -7.369  -3.175  -3.251
  313   1HB   ASP  40          HB2       ASP  40  -7.132  -5.215  -4.671
  314   2HB   ASP  40          HB1       ASP  40  -7.231  -5.612  -2.953
  315    H    GLY  41           HN       GLY  41  -7.845  -1.556  -4.683
  316   1HA   GLY  41          HA2       GLY  41  -9.779  -2.130  -6.864
  317   2HA   GLY  41          HA1       GLY  41 -10.028  -0.673  -5.897
  318    H    GLU  42           HN       GLU  42  -8.412   1.014  -6.005
  319    HA   GLU  42           HA       GLU  42  -6.573   0.794  -8.367
  320   1HB   GLU  42          HB2       GLU  42  -8.806   2.586  -7.740
  321   2HB   GLU  42          HB1       GLU  42  -7.328   3.473  -8.111
  322   1HG   GLU  42          HG2       GLU  42  -7.250   2.720 -10.285
  323   2HG   GLU  42          HG1       GLU  42  -8.030   1.186  -9.894
  324    H    TRP  43           HN       TRP  43  -4.498   0.991  -7.662
  325    HA   TRP  43           HA       TRP  43  -3.926   2.470  -5.138
  326   1HB   TRP  43          HB2       TRP  43  -2.347   0.593  -6.925
  327   2HB   TRP  43          HB1       TRP  43  -1.655   1.395  -5.528
  328    HD1  TRP  43           HD1      TRP  43  -5.234  -0.014  -5.416
  329    HE1  TRP  43           HE1      TRP  43  -5.266  -1.988  -3.781
  330    HE3  TRP  43           HE3      TRP  43  -0.264  -0.374  -4.406
  331    HZ2  TRP  43           HZ2      TRP  43  -3.434  -3.497  -2.204
  332    HZ3  TRP  43           HZ3      TRP  43   0.574  -2.081  -2.807
  333    HH2  TRP  43           HH2      TRP  43  -1.002  -3.636  -1.708
  334    H    THR  44           HN       THR  44  -1.822   3.783  -5.240
  335    HA   THR  44           HA       THR  44  -1.035   4.880  -7.842
  336    HB   THR  44           HB       THR  44  -1.662   7.247  -6.840
  337    HG1  THR  44           HG1      THR  44  -3.679   5.611  -5.719
  338   1HG2  THR  44          HG21      THR  44  -3.983   5.628  -7.851
  339   2HG2  THR  44          HG22      THR  44  -2.587   5.914  -8.890
  340   3HG2  THR  44          HG23      THR  44  -3.514   7.277  -8.265
  341    H    TYR  45           HN       TYR  45   1.077   5.483  -7.679
  342    HA   TYR  45           HA       TYR  45   2.393   5.381  -5.042
  343   1HB   TYR  45          HB2       TYR  45   3.350   4.237  -6.980
  344   2HB   TYR  45          HB1       TYR  45   3.352   5.734  -7.908
  345    HD1  TYR  45           HD1      TYR  45   5.213   7.172  -7.847
  346    HD2  TYR  45           HD2      TYR  45   4.741   4.190  -4.794
  347    HE1  TYR  45           HE1      TYR  45   7.461   7.729  -6.958
  348    HE2  TYR  45           HE2      TYR  45   6.989   4.743  -3.905
  349    HH   TYR  45           HH       TYR  45   9.274   6.274  -5.513
  350    H    ASP  46           HN       ASP  46   4.051   7.182  -4.574
  351    HA   ASP  46           HA       ASP  46   3.272   9.847  -5.670
  352   1HB   ASP  46          HB2       ASP  46   3.482   9.200  -2.707
  353   2HB   ASP  46          HB1       ASP  46   3.009  10.741  -3.415
  354    H    ASP  47           HN       ASP  47   5.145  10.830  -6.276
  355    HA   ASP  47           HA       ASP  47   7.764   9.860  -5.543
  356   1HB   ASP  47          HB2       ASP  47   6.816  12.463  -6.785
  357   2HB   ASP  47          HB1       ASP  47   8.483  11.888  -6.796
  358    H    ALA  48           HN       ALA  48   5.555  11.885  -3.863
  359    HA   ALA  48           HA       ALA  48   7.130  13.826  -2.579
  360   1HB   ALA  48          HB1       ALA  48   4.831  13.892  -2.167
  361   2HB   ALA  48          HB2       ALA  48   5.422  13.220  -0.647
  362   3HB   ALA  48          HB3       ALA  48   4.733  12.153  -1.875
  363    H    THR  49           HN       THR  49   6.236  10.741  -1.020
  364    HA   THR  49           HA       THR  49   9.008  10.513   0.086
  365    HB   THR  49           HB       THR  49   7.562  11.658   1.720
  366    HG1  THR  49           HG1      THR  49   8.818  10.422   2.886
  367   1HG2  THR  49          HG21      THR  49   5.373  11.165   1.879
  368   2HG2  THR  49          HG22      THR  49   5.762   9.519   2.380
  369   3HG2  THR  49          HG23      THR  49   5.585   9.900   0.666
  370    H    LYS  50           HN       LYS  50   7.712   9.062  -2.074
  371    HA   LYS  50           HA       LYS  50   7.373   6.861  -2.813
  372   1HB   LYS  50          HB2       LYS  50   8.850   6.282  -0.223
  373   2HB   LYS  50          HB1       LYS  50   8.685   5.171  -1.581
  374   1HG   LYS  50          HG2       LYS  50   9.893   6.738  -3.037
  375   2HG   LYS  50          HG1       LYS  50  10.030   7.887  -1.706
  376   1HD   LYS  50          HD2       LYS  50  11.155   5.071  -1.658
  377   2HD   LYS  50          HD1       LYS  50  12.098   6.516  -2.022
  378   1HE   LYS  50          HE2       LYS  50  10.831   7.222   0.340
  379   2HE   LYS  50          HE1       LYS  50  11.194   5.502   0.583
  380   1HZ   LYS  50          HZ1       LYS  50  13.455   5.994  -0.324
  381   2HZ   LYS  50          HZ2       LYS  50  13.134   6.707   1.184
  382   3HZ   LYS  50          HZ3       LYS  50  13.079   7.645  -0.231
  383    H    THR  51           HN       THR  51   5.151   7.962  -1.494
  384    HA   THR  51           HA       THR  51   4.150   5.915   0.408
  385    HB   THR  51           HB       THR  51   3.016   8.506  -0.709
  386    HG1  THR  51           HG1      THR  51   3.499   9.224   1.404
  387   1HG2  THR  51          HG21      THR  51   1.933   6.526   1.299
  388   2HG2  THR  51          HG22      THR  51   1.115   7.233  -0.094
  389   3HG2  THR  51          HG23      THR  51   1.452   8.223   1.326
  390    H    TRP  52           HN       TRP  52   1.893   5.054  -0.053
  391    HA   TRP  52           HA       TRP  52   1.433   4.626  -2.988
  392   1HB   TRP  52          HB2       TRP  52   1.645   2.718  -0.668
  393   2HB   TRP  52          HB1       TRP  52   0.715   2.293  -2.100
  394    HD1  TRP  52           HD1      TRP  52   4.242   2.637  -0.838
  395    HE1  TRP  52           HE1      TRP  52   5.879   1.911  -2.698
  396    HE3  TRP  52           HE3      TRP  52   0.997   2.258  -4.713
  397    HZ2  TRP  52           HZ2      TRP  52   5.798   1.249  -5.496
  398    HZ3  TRP  52           HZ3      TRP  52   1.776   1.578  -6.975
  399    HH2  TRP  52           HH2      TRP  52   4.174   1.072  -7.367
  400    H    THR  53           HN       THR  53  -0.847   3.216  -2.961
  401    HA   THR  53           HA       THR  53  -2.778   4.280  -1.012
  402    HB   THR  53           HB       THR  53  -3.214   4.894  -3.929
  403    HG1  THR  53           HG1      THR  53  -1.500   6.117  -3.700
  404   1HG2  THR  53          HG21      THR  53  -5.189   5.258  -2.758
  405   2HG2  THR  53          HG22      THR  53  -4.441   6.853  -2.677
  406   3HG2  THR  53          HG23      THR  53  -4.346   5.763  -1.294
  407    H    VAL  54           HN       VAL  54  -5.072   3.519  -1.708
  408    HA   VAL  54           HA       VAL  54  -5.407   1.339  -3.558
  409    HB   VAL  54           HB       VAL  54  -3.964   0.086  -2.096
  410   1HG1  VAL  54          HG11      VAL  54  -4.824  -0.050   0.422
  411   2HG1  VAL  54          HG12      VAL  54  -5.431   1.558   0.033
  412   3HG1  VAL  54          HG13      VAL  54  -3.712   1.206  -0.116
  413   1HG2  VAL  54          HG21      VAL  54  -6.407  -0.847  -2.632
  414   2HG2  VAL  54          HG22      VAL  54  -6.567  -0.750  -0.878
  415   3HG2  VAL  54          HG23      VAL  54  -5.291  -1.741  -1.592
  416    H    THR  55           HN       THR  55  -7.346   2.483  -3.989
  417    HA   THR  55           HA       THR  55  -9.322   2.809  -1.786
  418    HB   THR  55           HB       THR  55  -9.564   3.646  -4.682
  419    HG1  THR  55           HG1      THR  55  -8.177   5.191  -4.349
  420   1HG2  THR  55          HG21      THR  55 -11.229   5.051  -3.943
  421   2HG2  THR  55          HG22      THR  55 -10.486   5.269  -2.358
  422   3HG2  THR  55          HG23      THR  55 -11.381   3.792  -2.718
  423    H    GLU  56           HN       GLU  56 -10.991   1.366  -1.578
  424    HA   GLU  56           HA       GLU  56 -11.239  -0.998  -3.172
  425   1HB   GLU  56          HB2       GLU  56 -12.049  -0.406  -0.778
  426   2HB   GLU  56          HB1       GLU  56 -13.468   0.272  -1.576
  427   1HG   GLU  56          HG2       GLU  56 -13.354  -2.107  -2.842
  428   2HG   GLU  56          HG1       GLU  56 -12.623  -2.567  -1.303
  Start of MODEL   38
    1   1H    THR   1          HT1       THR   1  15.473   0.580   4.622
    2   2H    THR   1          HT2       THR   1  15.612   2.045   5.471
    3   3H    THR   1          HT3       THR   1  16.515   1.791   4.054
    4    HA   THR   1           HA       THR   1  14.541   3.260   3.734
    5    HB   THR   1           HB       THR   1  15.677   2.051   1.926
    6    HG1  THR   1           HG1      THR   1  13.854   1.823   0.557
    7   1HG2  THR   1          HG21      THR   1  14.220  -0.210   1.395
    8   2HG2  THR   1          HG22      THR   1  14.284  -0.238   3.156
    9   3HG2  THR   1          HG23      THR   1  15.777  -0.199   2.221
   10    H    THR   2           HN       THR   2  12.233   3.357   3.640
   11    HA   THR   2           HA       THR   2  10.712   1.020   4.703
   12    HB   THR   2           HB       THR   2  10.645   3.851   5.798
   13    HG1  THR   2           HG1      THR   2  11.712   1.429   6.810
   14   1HG2  THR   2          HG21      THR   2   8.500   2.474   5.849
   15   2HG2  THR   2          HG22      THR   2   9.088   3.032   7.415
   16   3HG2  THR   2          HG23      THR   2   9.351   1.360   6.920
   17    H    PHE   3           HN       PHE   3   8.898   0.753   3.471
   18    HA   PHE   3           HA       PHE   3   8.033   2.954   1.664
   19   1HB   PHE   3          HB2       PHE   3   7.343   0.001   1.866
   20   2HB   PHE   3          HB1       PHE   3   6.784   1.078   0.586
   21    HD1  PHE   3           HD1      PHE   3   8.831   2.592  -0.418
   22    HD2  PHE   3           HD2      PHE   3   9.189  -1.323   1.327
   23    HE1  PHE   3           HE1      PHE   3  10.957   2.238  -1.643
   24    HE2  PHE   3           HE2      PHE   3  11.314  -1.672   0.098
   25    HZ   PHE   3           HZ       PHE   3  12.198   0.109  -1.384
   26    H    LYS   4           HN       LYS   4   5.642   3.332   1.463
   27    HA   LYS   4           HA       LYS   4   4.089   2.673   3.934
   28   1HB   LYS   4          HB2       LYS   4   5.237   4.904   4.096
   29   2HB   LYS   4          HB1       LYS   4   4.337   5.420   2.681
   30   1HG   LYS   4          HG2       LYS   4   2.220   5.065   3.823
   31   2HG   LYS   4          HG1       LYS   4   3.054   4.415   5.231
   32   1HD   LYS   4          HD2       LYS   4   3.757   6.482   5.945
   33   2HD   LYS   4          HD1       LYS   4   3.888   7.118   4.306
   34   1HE   LYS   4          HE2       LYS   4   1.835   8.062   4.480
   35   2HE   LYS   4          HE1       LYS   4   1.115   6.487   4.870
   36   1HZ   LYS   4          HZ1       LYS   4   0.906   8.093   6.708
   37   2HZ   LYS   4          HZ2       LYS   4   2.599   8.200   6.796
   38   3HZ   LYS   4          HZ3       LYS   4   1.819   6.732   7.145
   39    H    LEU   5           HN       LEU   5   1.820   2.647   3.606
   40    HA   LEU   5           HA       LEU   5   0.778   3.257   0.888
   41   1HB   LEU   5          HB2       LEU   5   1.582   0.751   1.430
   42   2HB   LEU   5          HB1       LEU   5  -0.016   0.670   2.161
   43    HG   LEU   5           HG       LEU   5  -0.178   1.984  -0.422
   44   1HD1  LEU   5          HD11      LEU   5   0.621   0.355  -1.905
   45   2HD1  LEU   5          HD12      LEU   5   0.691  -0.891  -0.648
   46   3HD1  LEU   5          HD13      LEU   5   1.889   0.408  -0.674
   47   1HD2  LEU   5          HD21      LEU   5  -1.881   0.257  -0.803
   48   2HD2  LEU   5          HD22      LEU   5  -2.045   0.918   0.824
   49   3HD2  LEU   5          HD23      LEU   5  -1.289  -0.657   0.585
   50    H    ILE   6           HN       ILE   6  -1.408   3.866   0.945
   51    HA   ILE   6           HA       ILE   6  -2.629   4.064   3.675
   52    HB   ILE   6           HB       ILE   6  -2.832   5.757   1.170
   53   1HG1  ILE   6          HG12      ILE   6  -0.727   5.956   2.468
   54   2HG1  ILE   6          HG11      ILE   6  -1.675   7.441   2.532
   55   1HG2  ILE   6          HG21      ILE   6  -4.106   6.302   3.865
   56   2HG2  ILE   6          HG22      ILE   6  -4.984   5.633   2.489
   57   3HG2  ILE   6          HG23      ILE   6  -4.287   7.250   2.389
   58   1HD1  ILE   6          HD11      ILE   6  -2.635   6.604   4.727
   59   2HD1  ILE   6          HD12      ILE   6  -0.916   6.995   4.770
   60   3HD1  ILE   6          HD13      ILE   6  -1.436   5.313   4.672
   61    H    ILE   7           HN       ILE   7  -4.529   2.978   3.969
   62    HA   ILE   7           HA       ILE   7  -5.720   1.452   1.766
   63    HB   ILE   7           HB       ILE   7  -6.479   1.834   4.684
   64   1HG1  ILE   7          HG12      ILE   7  -5.062  -0.525   3.428
   65   2HG1  ILE   7          HG11      ILE   7  -4.173   0.848   4.088
   66   1HG2  ILE   7          HG21      ILE   7  -7.621  -0.409   4.294
   67   2HG2  ILE   7          HG22      ILE   7  -7.385  -0.135   2.568
   68   3HG2  ILE   7          HG23      ILE   7  -8.387   0.971   3.507
   69   1HD1  ILE   7          HD11      ILE   7  -5.789  -1.221   5.507
   70   2HD1  ILE   7          HD12      ILE   7  -5.792   0.413   6.169
   71   3HD1  ILE   7          HD13      ILE   7  -4.271  -0.460   5.983
   72    H    ASN   8           HN       ASN   8  -7.089   2.501   0.378
   73    HA   ASN   8           HA       ASN   8  -8.844   4.677   1.448
   74   1HB   ASN   8          HB2       ASN   8  -7.692   3.974  -1.258
   75   2HB   ASN   8          HB1       ASN   8  -9.009   5.136  -1.094
   76   1HD2  ASN   8          HD21      ASN   8  -7.637   6.944  -1.745
   77   2HD2  ASN   8          HD22      ASN   8  -6.424   7.550  -0.711
   78    H    GLY   9           HN       GLY   9  -9.739   2.178   2.102
   79   1HA   GLY   9          HA2       GLY   9 -11.499   1.089   0.035
   80   2HA   GLY   9          HA1       GLY   9 -11.423   0.557   1.719
   81    H    LYS  10           HN       LYS  10 -13.848   1.079   0.221
   82    HA   LYS  10           HA       LYS  10 -15.056   3.580   0.649
   83   1HB   LYS  10          HB2       LYS  10 -16.191   0.769   0.739
   84   2HB   LYS  10          HB1       LYS  10 -17.170   2.228   0.577
   85   1HG   LYS  10          HG2       LYS  10 -15.814   2.809  -1.473
   86   2HG   LYS  10          HG1       LYS  10 -15.068   1.214  -1.355
   87   1HD   LYS  10          HD2       LYS  10 -16.849   0.836  -2.837
   88   2HD   LYS  10          HD1       LYS  10 -17.525   0.337  -1.286
   89   1HE   LYS  10          HE2       LYS  10 -19.022   2.067  -1.247
   90   2HE   LYS  10          HE1       LYS  10 -17.850   3.217  -1.921
   91   1HZ   LYS  10          HZ1       LYS  10 -19.145   1.024  -3.452
   92   2HZ   LYS  10          HZ2       LYS  10 -18.084   2.197  -4.073
   93   3HZ   LYS  10          HZ3       LYS  10 -19.623   2.650  -3.513
   94    H    THR  11           HN       THR  11 -14.901   0.775   2.851
   95    HA   THR  11           HA       THR  11 -15.892   2.544   5.066
   96    HB   THR  11           HB       THR  11 -15.969  -0.476   4.962
   97    HG1  THR  11           HG1      THR  11 -17.078   0.174   3.166
   98   1HG2  THR  11          HG21      THR  11 -17.549  -0.292   6.684
   99   2HG2  THR  11          HG22      THR  11 -17.930   1.383   6.284
  100   3HG2  THR  11          HG23      THR  11 -16.402   0.991   7.073
  101    H    LEU  12           HN       LEU  12 -13.361   0.345   4.009
  102    HA   LEU  12           HA       LEU  12 -12.081   0.397   6.702
  103   1HB   LEU  12          HB2       LEU  12 -11.600  -1.159   4.142
  104   2HB   LEU  12          HB1       LEU  12 -10.623  -1.345   5.599
  105    HG   LEU  12           HG       LEU  12 -13.591  -1.543   5.879
  106   1HD1  LEU  12          HD11      LEU  12 -13.501  -3.948   5.296
  107   2HD1  LEU  12          HD12      LEU  12 -11.826  -3.753   4.781
  108   3HD1  LEU  12          HD13      LEU  12 -13.118  -2.935   3.904
  109   1HD2  LEU  12          HD21      LEU  12 -11.160  -2.844   7.135
  110   2HD2  LEU  12          HD22      LEU  12 -12.813  -3.329   7.513
  111   3HD2  LEU  12          HD23      LEU  12 -12.267  -1.693   7.883
  112    H    LYS  13           HN       LYS  13 -10.197   1.534   7.054
  113    HA   LYS  13           HA       LYS  13  -8.545   2.500   4.802
  114   1HB   LYS  13          HB2       LYS  13 -10.304   4.211   6.560
  115   2HB   LYS  13          HB1       LYS  13  -8.850   4.883   5.821
  116   1HG   LYS  13          HG2       LYS  13  -9.807   3.825   3.618
  117   2HG   LYS  13          HG1       LYS  13 -11.339   3.850   4.492
  118   1HD   LYS  13          HD2       LYS  13 -10.919   6.296   4.977
  119   2HD   LYS  13          HD1       LYS  13  -9.548   6.211   3.870
  120   1HE   LYS  13          HE2       LYS  13 -10.950   5.735   1.998
  121   2HE   LYS  13          HE1       LYS  13 -12.339   5.367   3.041
  122   1HZ   LYS  13          HZ1       LYS  13 -10.976   8.001   2.835
  123   2HZ   LYS  13          HZ2       LYS  13 -12.285   7.643   3.857
  124   3HZ   LYS  13          HZ3       LYS  13 -12.490   7.623   2.171
  125    H    GLY  14           HN       GLY  14  -6.802   4.115   5.953
  126   1HA   GLY  14          HA2       GLY  14  -5.934   4.296   8.442
  127   2HA   GLY  14          HA1       GLY  14  -5.733   2.557   8.238
  128    H    GLU  15           HN       GLU  15  -3.413   2.976   8.580
  129    HA   GLU  15           HA       GLU  15  -2.061   3.789   6.031
  130   1HB   GLU  15          HB2       GLU  15  -1.256   4.536   8.867
  131   2HB   GLU  15          HB1       GLU  15  -0.416   5.019   7.394
  132   1HG   GLU  15          HG2       GLU  15  -2.602   6.109   6.657
  133   2HG   GLU  15          HG1       GLU  15  -3.183   5.844   8.300
  134    H    THR  16           HN       THR  16   0.057   2.741   5.760
  135    HA   THR  16           HA       THR  16   0.886   0.709   7.734
  136    HB   THR  16           HB       THR  16  -0.958  -0.379   6.530
  137    HG1  THR  16           HG1      THR  16   0.510  -1.870   6.964
  138   1HG2  THR  16          HG21      THR  16   0.646   0.426   4.092
  139   2HG2  THR  16          HG22      THR  16  -1.038   0.806   4.462
  140   3HG2  THR  16          HG23      THR  16  -0.578  -0.844   4.045
  141    H    THR  17           HN       THR  17   3.031   0.024   7.399
  142    HA   THR  17           HA       THR  17   4.445   1.019   4.958
  143    HB   THR  17           HB       THR  17   6.269   1.776   6.520
  144    HG1  THR  17           HG1      THR  17   5.725   1.930   8.704
  145   1HG2  THR  17          HG21      THR  17   5.008   3.780   7.367
  146   2HG2  THR  17          HG22      THR  17   3.517   2.996   6.844
  147   3HG2  THR  17          HG23      THR  17   4.744   3.440   5.657
  148    H    THR  18           HN       THR  18   6.479  -0.152   4.566
  149    HA   THR  18           HA       THR  18   6.887  -2.606   6.182
  150    HB   THR  18           HB       THR  18   5.638  -2.354   3.538
  151    HG1  THR  18           HG1      THR  18   4.940  -3.596   5.358
  152   1HG2  THR  18          HG21      THR  18   7.964  -4.295   3.734
  153   2HG2  THR  18          HG22      THR  18   7.929  -2.842   2.733
  154   3HG2  THR  18          HG23      THR  18   6.810  -4.167   2.404
  155    H    GLU  19           HN       GLU  19   9.020  -3.600   5.681
  156    HA   GLU  19           HA       GLU  19  10.989  -1.625   4.569
  157   1HB   GLU  19          HB2       GLU  19  10.949  -2.010   7.078
  158   2HB   GLU  19          HB1       GLU  19  11.402  -3.685   6.758
  159   1HG   GLU  19          HG2       GLU  19  13.280  -2.458   5.275
  160   2HG   GLU  19          HG1       GLU  19  13.019  -1.199   6.485
  161    H    ALA  20           HN       ALA  20  11.775  -2.447   2.657
  162    HA   ALA  20           HA       ALA  20  12.603  -5.298   2.544
  163   1HB   ALA  20          HB1       ALA  20  10.361  -3.981   1.054
  164   2HB   ALA  20          HB2       ALA  20  10.434  -5.598   1.755
  165   3HB   ALA  20          HB3       ALA  20  11.279  -5.252   0.246
  166    H    VAL  21           HN       VAL  21  13.524  -5.687   0.199
  167    HA   VAL  21           HA       VAL  21  15.772  -4.005  -0.226
  168    HB   VAL  21           HB       VAL  21  15.964  -5.298  -2.340
  169   1HG1  VAL  21          HG11      VAL  21  15.332  -6.548   0.284
  170   2HG1  VAL  21          HG12      VAL  21  16.802  -6.642  -0.685
  171   3HG1  VAL  21          HG13      VAL  21  15.403  -7.629  -1.107
  172   1HG2  VAL  21          HG21      VAL  21  14.052  -7.068  -2.616
  173   2HG2  VAL  21          HG22      VAL  21  13.795  -5.439  -3.237
  174   3HG2  VAL  21          HG23      VAL  21  13.080  -5.917  -1.699
  175    H    ASP  22           HN       ASP  22  12.574  -4.000  -1.783
  176    HA   ASP  22           HA       ASP  22  12.977  -1.207  -2.651
  177   1HB   ASP  22          HB2       ASP  22  14.040  -2.592  -4.402
  178   2HB   ASP  22          HB1       ASP  22  12.547  -3.514  -4.580
  179    H    ALA  23           HN       ALA  23  10.907  -0.345  -3.601
  180    HA   ALA  23           HA       ALA  23   8.608  -1.038  -2.059
  181   1HB   ALA  23          HB1       ALA  23   8.628   1.124  -2.938
  182   2HB   ALA  23          HB2       ALA  23   7.519   0.325  -4.053
  183   3HB   ALA  23          HB3       ALA  23   9.201   0.583  -4.517
  184    H    ALA  24           HN       ALA  24   9.841  -2.345  -5.066
  185    HA   ALA  24           HA       ALA  24   7.468  -3.467  -6.179
  186   1HB   ALA  24          HB1       ALA  24   9.989  -3.285  -6.966
  187   2HB   ALA  24          HB2       ALA  24   8.977  -4.602  -7.558
  188   3HB   ALA  24          HB3       ALA  24  10.115  -4.888  -6.241
  189    H    THR  25           HN       THR  25   9.790  -4.824  -3.821
  190    HA   THR  25           HA       THR  25   8.287  -7.308  -3.489
  191    HB   THR  25           HB       THR  25  10.605  -5.958  -2.079
  192    HG1  THR  25           HG1      THR  25  11.590  -6.893  -3.650
  193   1HG2  THR  25          HG21      THR  25   9.364  -7.359  -0.444
  194   2HG2  THR  25          HG22      THR  25  10.952  -8.036  -0.823
  195   3HG2  THR  25          HG23      THR  25   9.502  -8.733  -1.547
  196    H    ALA  26           HN       ALA  26   8.728  -4.313  -1.569
  197    HA   ALA  26           HA       ALA  26   7.167  -5.095   0.679
  198   1HB   ALA  26          HB1       ALA  26   7.708  -2.397  -0.606
  199   2HB   ALA  26          HB2       ALA  26   8.597  -3.138   0.725
  200   3HB   ALA  26          HB3       ALA  26   6.938  -2.582   0.975
  201    H    GLU  27           HN       GLU  27   6.119  -2.754  -1.816
  202    HA   GLU  27           HA       GLU  27   3.405  -2.619  -1.342
  203   1HB   GLU  27          HB2       GLU  27   4.687  -1.371  -3.053
  204   2HB   GLU  27          HB1       GLU  27   4.814  -2.835  -4.026
  205   1HG   GLU  27          HG2       GLU  27   2.165  -2.812  -3.789
  206   2HG   GLU  27          HG1       GLU  27   2.435  -1.089  -3.529
  207    H    LYS  28           HN       LYS  28   5.113  -5.286  -2.860
  208    HA   LYS  28           HA       LYS  28   2.827  -6.735  -3.873
  209   1HB   LYS  28          HB2       LYS  28   4.806  -7.515  -4.778
  210   2HB   LYS  28          HB1       LYS  28   5.738  -7.085  -3.358
  211   1HG   LYS  28          HG2       LYS  28   4.581  -9.178  -2.271
  212   2HG   LYS  28          HG1       LYS  28   4.250  -9.634  -3.942
  213   1HD   LYS  28          HD2       LYS  28   6.543  -9.757  -4.482
  214   2HD   LYS  28          HD1       LYS  28   7.018  -8.793  -3.079
  215   1HE   LYS  28          HE2       LYS  28   6.513 -10.605  -1.565
  216   2HE   LYS  28          HE1       LYS  28   5.750 -11.549  -2.861
  217   1HZ   LYS  28          HZ1       LYS  28   8.067 -12.220  -2.489
  218   2HZ   LYS  28          HZ2       LYS  28   8.582 -10.641  -2.847
  219   3HZ   LYS  28          HZ3       LYS  28   7.838 -11.589  -4.046
  220    H    VAL  29           HN       VAL  29   4.692  -6.956  -0.833
  221    HA   VAL  29           HA       VAL  29   2.976  -8.902   0.453
  222    HB   VAL  29           HB       VAL  29   5.065  -6.871   1.289
  223   1HG1  VAL  29          HG11      VAL  29   3.434  -6.982   3.156
  224   2HG1  VAL  29          HG12      VAL  29   4.974  -7.729   3.594
  225   3HG1  VAL  29          HG13      VAL  29   3.592  -8.742   3.174
  226   1HG2  VAL  29          HG21      VAL  29   6.273  -8.968   1.927
  227   2HG2  VAL  29          HG22      VAL  29   5.857  -8.902   0.214
  228   3HG2  VAL  29          HG23      VAL  29   4.904  -9.897   1.315
  229    H    LEU  30           HN       LEU  30   2.998  -5.360   0.217
  230    HA   LEU  30           HA       LEU  30   1.015  -4.860   2.228
  231   1HB   LEU  30          HB2       LEU  30   2.002  -3.422  -0.243
  232   2HB   LEU  30          HB1       LEU  30   0.747  -2.723   0.763
  233    HG   LEU  30           HG       LEU  30   3.311  -2.119   1.135
  234   1HD1  LEU  30          HD11      LEU  30   1.276  -2.610   3.305
  235   2HD1  LEU  30          HD12      LEU  30   1.617  -1.101   2.455
  236   3HD1  LEU  30          HD13      LEU  30   2.809  -1.770   3.579
  237   1HD2  LEU  30          HD21      LEU  30   4.080  -3.446   3.198
  238   2HD2  LEU  30          HD22      LEU  30   4.344  -4.161   1.622
  239   3HD2  LEU  30          HD23      LEU  30   3.021  -4.720   2.638
  240    H    LYS  31           HN       LYS  31   0.881  -5.753  -1.175
  241    HA   LYS  31           HA       LYS  31  -1.922  -5.330  -1.681
  242   1HB   LYS  31          HB2       LYS  31   0.189  -6.074  -3.167
  243   2HB   LYS  31          HB1       LYS  31  -0.379  -7.676  -2.759
  244   1HG   LYS  31          HG2       LYS  31  -2.252  -5.582  -3.866
  245   2HG   LYS  31          HG1       LYS  31  -1.311  -6.631  -4.924
  246   1HD   LYS  31          HD2       LYS  31  -3.273  -7.550  -2.797
  247   2HD   LYS  31          HD1       LYS  31  -3.539  -7.596  -4.538
  248   1HE   LYS  31          HE2       LYS  31  -1.065  -8.902  -4.124
  249   2HE   LYS  31          HE1       LYS  31  -2.162  -9.530  -2.872
  250   1HZ   LYS  31          HZ1       LYS  31  -3.841  -9.908  -4.563
  251   2HZ   LYS  31          HZ2       LYS  31  -2.417 -10.738  -4.977
  252   3HZ   LYS  31          HZ3       LYS  31  -2.819  -9.288  -5.767
  253    H    GLN  32           HN       GLN  32  -0.048  -8.092  -0.478
  254    HA   GLN  32           HA       GLN  32  -2.119  -9.999  -0.139
  255   1HB   GLN  32          HB2       GLN  32   0.571  -9.420   0.971
  256   2HB   GLN  32          HB1       GLN  32  -0.439 -10.534   1.894
  257   1HG   GLN  32          HG2       GLN  32  -0.858 -11.542  -0.559
  258   2HG   GLN  32          HG1       GLN  32   0.750 -10.862  -0.813
  259   1HE2  GLN  32          HE21      GLN  32  -1.058 -13.022   1.428
  260   2HE2  GLN  32          HE22      GLN  32   0.301 -13.960   1.857
  261    H    TYR  33           HN       TYR  33  -0.986  -7.405   2.011
  262    HA   TYR  33           HA       TYR  33  -2.686  -7.972   4.271
  263   1HB   TYR  33          HB2       TYR  33  -0.731  -6.500   4.361
  264   2HB   TYR  33          HB1       TYR  33  -1.455  -5.413   3.175
  265    HD1  TYR  33           HD1      TYR  33  -1.861  -6.828   6.575
  266    HD2  TYR  33           HD2      TYR  33  -2.992  -3.725   3.836
  267    HE1  TYR  33           HE1      TYR  33  -3.019  -5.645   8.405
  268    HE2  TYR  33           HE2      TYR  33  -4.149  -2.529   5.671
  269    HH   TYR  33           HH       TYR  33  -3.695  -2.700   8.556
  270    H    ILE  34           HN       ILE  34  -3.076  -6.009   1.347
  271    HA   ILE  34           HA       ILE  34  -5.666  -4.896   1.971
  272    HB   ILE  34           HB       ILE  34  -4.252  -5.494  -0.647
  273   1HG1  ILE  34          HG12      ILE  34  -3.119  -4.022   1.169
  274   2HG1  ILE  34          HG11      ILE  34  -3.203  -3.392  -0.469
  275   1HG2  ILE  34          HG21      ILE  34  -5.683  -3.636  -1.545
  276   2HG2  ILE  34          HG22      ILE  34  -6.595  -3.678  -0.036
  277   3HG2  ILE  34          HG23      ILE  34  -6.587  -5.084  -1.101
  278   1HD1  ILE  34          HD11      ILE  34  -3.900  -1.902   1.616
  279   2HD1  ILE  34          HD12      ILE  34  -5.435  -2.750   1.421
  280   3HD1  ILE  34          HD13      ILE  34  -4.780  -1.793   0.092
  281    H    ASN  35           HN       ASN  35  -4.570  -7.950   0.612
  282    HA   ASN  35           HA       ASN  35  -6.943  -8.877  -0.646
  283   1HB   ASN  35          HB2       ASN  35  -4.587  -9.843  -0.639
  284   2HB   ASN  35          HB1       ASN  35  -4.956 -10.519   0.948
  285   1HD2  ASN  35          HD21      ASN  35  -4.581 -11.780  -1.885
  286   2HD2  ASN  35          HD22      ASN  35  -5.931 -12.798  -2.037
  287    H    ASP  36           HN       ASP  36  -6.066  -8.681   2.755
  288    HA   ASP  36           HA       ASP  36  -8.210 -10.437   3.695
  289   1HB   ASP  36          HB2       ASP  36  -6.169  -8.569   4.888
  290   2HB   ASP  36          HB1       ASP  36  -7.443  -9.247   5.902
  291    H    ASN  37           HN       ASN  37  -7.612  -6.905   3.900
  292    HA   ASN  37           HA       ASN  37 -10.146  -6.197   5.014
  293   1HB   ASN  37          HB2       ASN  37  -8.245  -4.671   3.199
  294   2HB   ASN  37          HB1       ASN  37  -9.519  -3.934   4.178
  295   1HD2  ASN  37          HD21      ASN  37  -8.778  -3.167   6.151
  296   2HD2  ASN  37          HD22      ASN  37  -7.454  -3.803   7.019
  297    H    GLY  38           HN       GLY  38  -9.107  -6.732   1.677
  298   1HA   GLY  38          HA2       GLY  38 -10.515  -7.283  -0.163
  299   2HA   GLY  38          HA1       GLY  38 -11.920  -6.871   0.821
  300    H    ILE  39           HN       ILE  39  -9.083  -4.820   0.280
  301    HA   ILE  39           HA       ILE  39 -10.863  -2.882  -1.168
  302    HB   ILE  39           HB       ILE  39  -8.582  -2.390   0.779
  303   1HG1  ILE  39          HG12      ILE  39 -10.609  -3.264   1.884
  304   2HG1  ILE  39          HG11      ILE  39 -10.365  -1.562   2.287
  305   1HG2  ILE  39          HG21      ILE  39  -8.670  -0.577  -0.800
  306   2HG2  ILE  39          HG22      ILE  39  -9.459  -0.015   0.673
  307   3HG2  ILE  39          HG23      ILE  39 -10.430  -0.510  -0.713
  308   1HD1  ILE  39          HD11      ILE  39 -12.570  -2.837   0.825
  309   2HD1  ILE  39          HD12      ILE  39 -11.912  -1.430  -0.009
  310   3HD1  ILE  39          HD13      ILE  39 -12.519  -1.274   1.639
  311    H    ASP  40           HN       ASP  40  -9.915  -4.179  -3.081
  312    HA   ASP  40           HA       ASP  40  -7.189  -3.141  -3.798
  313   1HB   ASP  40          HB2       ASP  40  -7.392  -5.598  -3.446
  314   2HB   ASP  40          HB1       ASP  40  -8.644  -5.654  -4.692
  315    H    GLY  41           HN       GLY  41  -7.485  -1.457  -5.221
  316   1HA   GLY  41          HA2       GLY  41  -9.247  -1.919  -7.568
  317   2HA   GLY  41          HA1       GLY  41  -9.509  -0.457  -6.613
  318    H    GLU  42           HN       GLU  42  -7.815   1.151  -6.566
  319    HA   GLU  42           HA       GLU  42  -5.747   0.839  -8.720
  320   1HB   GLU  42          HB2       GLU  42  -7.994   2.696  -8.398
  321   2HB   GLU  42          HB1       GLU  42  -6.462   3.538  -8.625
  322   1HG   GLU  42          HG2       GLU  42  -6.193   2.767 -10.764
  323   2HG   GLU  42          HG1       GLU  42  -6.956   1.215 -10.412
  324    H    TRP  43           HN       TRP  43  -3.752   1.050  -7.804
  325    HA   TRP  43           HA       TRP  43  -3.448   2.548  -5.245
  326   1HB   TRP  43          HB2       TRP  43  -1.662   0.695  -6.857
  327   2HB   TRP  43          HB1       TRP  43  -1.151   1.484  -5.376
  328    HD1  TRP  43           HD1      TRP  43  -4.712   0.064  -5.665
  329    HE1  TRP  43           HE1      TRP  43  -4.905  -1.954  -4.096
  330    HE3  TRP  43           HE3      TRP  43   0.136  -0.338  -4.172
  331    HZ2  TRP  43           HZ2      TRP  43  -3.241  -3.513  -2.392
  332    HZ3  TRP  43           HZ3      TRP  43   0.804  -2.091  -2.542
  333    HH2  TRP  43           HH2      TRP  43  -0.872  -3.673  -1.655
  334    H    THR  44           HN       THR  44  -1.465   3.978  -5.113
  335    HA   THR  44           HA       THR  44  -0.486   5.078  -7.684
  336    HB   THR  44           HB       THR  44  -1.155   7.368  -7.015
  337    HG1  THR  44           HG1      THR  44  -2.518   7.607  -5.238
  338   1HG2  THR  44          HG21      THR  44  -3.593   5.595  -6.872
  339   2HG2  THR  44          HG22      THR  44  -2.661   5.773  -8.359
  340   3HG2  THR  44          HG23      THR  44  -3.435   7.180  -7.630
  341    H    TYR  45           HN       TYR  45   1.646   5.582  -7.456
  342    HA   TYR  45           HA       TYR  45   2.921   5.290  -4.822
  343   1HB   TYR  45          HB2       TYR  45   3.839   4.308  -6.893
  344   2HB   TYR  45          HB1       TYR  45   3.977   5.914  -7.605
  345    HD1  TYR  45           HD1      TYR  45   6.114   6.816  -7.592
  346    HD2  TYR  45           HD2      TYR  45   4.905   4.266  -4.355
  347    HE1  TYR  45           HE1      TYR  45   8.341   7.096  -6.540
  348    HE2  TYR  45           HE2      TYR  45   7.133   4.543  -3.304
  349    HH   TYR  45           HH       TYR  45   9.785   5.941  -4.960
  350    H    ASP  46           HN       ASP  46   4.535   6.993  -4.109
  351    HA   ASP  46           HA       ASP  46   3.867   9.763  -5.015
  352   1HB   ASP  46          HB2       ASP  46   3.994   8.834  -2.122
  353   2HB   ASP  46          HB1       ASP  46   3.603  10.457  -2.682
  354    H    ASP  47           HN       ASP  47   5.740  10.874  -5.371
  355    HA   ASP  47           HA       ASP  47   8.338   9.734  -4.771
  356   1HB   ASP  47          HB2       ASP  47   7.771  11.149  -6.736
  357   2HB   ASP  47          HB1       ASP  47   7.524  12.521  -5.655
  358    H    ALA  48           HN       ALA  48   6.157  11.481  -2.814
  359    HA   ALA  48           HA       ALA  48   7.766  13.265  -1.325
  360   1HB   ALA  48          HB1       ALA  48   5.332  11.573  -0.845
  361   2HB   ALA  48          HB2       ALA  48   5.479  13.333  -0.874
  362   3HB   ALA  48          HB3       ALA  48   6.050  12.424   0.526
  363    H    THR  49           HN       THR  49   6.795  10.065  -0.089
  364    HA   THR  49           HA       THR  49   9.581   9.630   0.924
  365    HB   THR  49           HB       THR  49   8.139  10.607   2.687
  366    HG1  THR  49           HG1      THR  49   9.506   9.213   3.582
  367   1HG2  THR  49          HG21      THR  49   6.173   9.255   3.475
  368   2HG2  THR  49          HG22      THR  49   6.368   8.232   2.049
  369   3HG2  THR  49          HG23      THR  49   5.957   9.938   1.862
  370    H    LYS  50           HN       LYS  50   8.298   8.472  -1.390
  371    HA   LYS  50           HA       LYS  50   7.896   6.384  -2.382
  372   1HB   LYS  50          HB2       LYS  50   9.278   5.455   0.158
  373   2HB   LYS  50          HB1       LYS  50   9.092   4.502  -1.312
  374   1HG   LYS  50          HG2       LYS  50  10.752   5.614  -2.403
  375   2HG   LYS  50          HG1       LYS  50  10.291   7.174  -1.722
  376   1HD   LYS  50          HD2       LYS  50  12.474   6.566  -0.847
  377   2HD   LYS  50          HD1       LYS  50  11.294   6.456   0.461
  378   1HE   LYS  50          HE2       LYS  50  11.082   3.969  -0.112
  379   2HE   LYS  50          HE1       LYS  50  12.531   4.183  -1.116
  380   1HZ   LYS  50          HZ1       LYS  50  13.005   3.562   1.240
  381   2HZ   LYS  50          HZ2       LYS  50  12.350   5.056   1.716
  382   3HZ   LYS  50          HZ3       LYS  50  13.740   5.006   0.740
  383    H    THR  51           HN       THR  51   5.730   7.473  -0.950
  384    HA   THR  51           HA       THR  51   4.549   5.395   0.769
  385    HB   THR  51           HB       THR  51   2.996   7.675  -0.409
  386    HG1  THR  51           HG1      THR  51   4.654   8.910   0.042
  387   1HG2  THR  51          HG21      THR  51   3.116   7.404   2.488
  388   2HG2  THR  51          HG22      THR  51   2.657   5.888   1.710
  389   3HG2  THR  51          HG23      THR  51   1.717   7.351   1.417
  390    H    TRP  52           HN       TRP  52   1.948   5.246  -0.027
  391    HA   TRP  52           HA       TRP  52   1.776   4.615  -2.910
  392   1HB   TRP  52          HB2       TRP  52   1.834   2.614  -0.657
  393   2HB   TRP  52          HB1       TRP  52   0.984   2.262  -2.156
  394    HD1  TRP  52           HD1      TRP  52   4.442   2.551  -0.687
  395    HE1  TRP  52           HE1      TRP  52   6.177   1.862  -2.473
  396    HE3  TRP  52           HE3      TRP  52   1.405   2.239  -4.731
  397    HZ2  TRP  52           HZ2      TRP  52   6.243   1.252  -5.280
  398    HZ3  TRP  52           HZ3      TRP  52   2.302   1.602  -6.961
  399    HH2  TRP  52           HH2      TRP  52   4.719   1.106  -7.236
  400    H    THR  53           HN       THR  53  -0.534   3.259  -3.033
  401    HA   THR  53           HA       THR  53  -2.524   4.293  -1.128
  402    HB   THR  53           HB       THR  53  -2.753   5.060  -4.044
  403    HG1  THR  53           HG1      THR  53  -1.996   7.137  -3.281
  404   1HG2  THR  53          HG21      THR  53  -4.829   5.375  -3.062
  405   2HG2  THR  53          HG22      THR  53  -4.086   6.946  -2.762
  406   3HG2  THR  53          HG23      THR  53  -4.141   5.737  -1.479
  407    H    VAL  54           HN       VAL  54  -4.803   3.603  -1.952
  408    HA   VAL  54           HA       VAL  54  -5.027   1.449  -3.879
  409    HB   VAL  54           HB       VAL  54  -3.762   0.218  -2.220
  410   1HG1  VAL  54          HG11      VAL  54  -5.188   0.150   0.134
  411   2HG1  VAL  54          HG12      VAL  54  -5.369   1.829  -0.369
  412   3HG1  VAL  54          HG13      VAL  54  -3.762   1.141  -0.163
  413   1HG2  VAL  54          HG21      VAL  54  -5.154  -1.611  -1.927
  414   2HG2  VAL  54          HG22      VAL  54  -6.097  -0.709  -3.120
  415   3HG2  VAL  54          HG23      VAL  54  -6.519  -0.617  -1.410
  416    H    THR  55           HN       THR  55  -6.865   2.712  -4.491
  417    HA   THR  55           HA       THR  55  -9.032   3.140  -2.509
  418    HB   THR  55           HB       THR  55  -9.039   3.828  -5.451
  419    HG1  THR  55           HG1      THR  55  -7.340   4.981  -5.069
  420   1HG2  THR  55          HG21      THR  55 -10.084   5.386  -3.082
  421   2HG2  THR  55          HG22      THR  55 -11.048   4.156  -3.899
  422   3HG2  THR  55          HG23      THR  55 -10.506   5.582  -4.783
  423    H    GLU  56           HN       GLU  56 -10.882   1.893  -2.477
  424    HA   GLU  56           HA       GLU  56 -11.034  -0.632  -3.804
  425   1HB   GLU  56          HB2       GLU  56 -12.245   0.486  -1.710
  426   2HB   GLU  56          HB1       GLU  56 -13.491   0.831  -2.909
  427   1HG   GLU  56          HG2       GLU  56 -12.317  -1.933  -2.675
  428   2HG   GLU  56          HG1       GLU  56 -13.624  -1.419  -1.606
  Start of MODEL   39
    1   1H    THR   1          HT1       THR   1  15.844   3.284   3.013
    2   2H    THR   1          HT2       THR   1  14.714   2.206   2.343
    3   3H    THR   1          HT3       THR   1  15.359   1.914   3.888
    4    HA   THR   1           HA       THR   1  14.257   3.886   4.760
    5    HB   THR   1           HB       THR   1  13.122   4.075   1.955
    6    HG1  THR   1           HG1      THR   1  14.921   4.995   1.456
    7   1HG2  THR   1          HG21      THR   1  11.650   5.216   3.348
    8   2HG2  THR   1          HG22      THR   1  12.785   6.499   2.930
    9   3HG2  THR   1          HG23      THR   1  12.919   5.675   4.483
   10    H    THR   2           HN       THR   2  11.798   3.938   5.132
   11    HA   THR   2           HA       THR   2  10.734   1.156   4.924
   12    HB   THR   2           HB       THR   2   9.694   3.459   6.587
   13    HG1  THR   2           HG1      THR   2  11.436   3.341   7.719
   14   1HG2  THR   2          HG21      THR   2   9.770   0.547   7.327
   15   2HG2  THR   2          HG22      THR   2   8.515   1.151   6.246
   16   3HG2  THR   2          HG23      THR   2   8.662   1.804   7.877
   17    H    PHE   3           HN       PHE   3   9.282   0.833   3.297
   18    HA   PHE   3           HA       PHE   3   8.027   2.962   1.801
   19   1HB   PHE   3          HB2       PHE   3   7.455  -0.013   2.033
   20   2HB   PHE   3          HB1       PHE   3   6.817   1.035   0.765
   21    HD1  PHE   3           HD1      PHE   3   8.897   2.704  -0.132
   22    HD2  PHE   3           HD2      PHE   3   9.210  -1.350   1.271
   23    HE1  PHE   3           HE1      PHE   3  10.991   2.414  -1.426
   24    HE2  PHE   3           HE2      PHE   3  11.304  -1.633  -0.024
   25    HZ   PHE   3           HZ       PHE   3  12.195   0.248  -1.371
   26    H    LYS   4           HN       LYS   4   5.612   3.213   1.630
   27    HA   LYS   4           HA       LYS   4   4.115   2.504   4.115
   28   1HB   LYS   4          HB2       LYS   4   5.253   4.763   4.284
   29   2HB   LYS   4          HB1       LYS   4   4.264   5.289   2.933
   30   1HG   LYS   4          HG2       LYS   4   2.220   4.778   4.200
   31   2HG   LYS   4          HG1       LYS   4   3.196   4.233   5.563
   32   1HD   LYS   4          HD2       LYS   4   3.788   6.362   6.171
   33   2HD   LYS   4          HD1       LYS   4   3.797   6.945   4.507
   34   1HE   LYS   4          HE2       LYS   4   1.815   7.945   5.052
   35   2HE   LYS   4          HE1       LYS   4   1.118   6.317   4.919
   36   1HZ   LYS   4          HZ1       LYS   4   1.713   5.923   7.238
   37   2HZ   LYS   4          HZ2       LYS   4   0.667   7.255   7.100
   38   3HZ   LYS   4          HZ3       LYS   4   2.327   7.499   7.366
   39    H    LEU   5           HN       LEU   5   1.808   2.578   3.818
   40    HA   LEU   5           HA       LEU   5   0.736   3.226   1.134
   41   1HB   LEU   5          HB2       LEU   5   1.630   0.730   1.481
   42   2HB   LEU   5          HB1       LEU   5   0.075   0.535   2.279
   43    HG   LEU   5           HG       LEU   5  -0.231   1.991  -0.226
   44   1HD1  LEU   5          HD11      LEU   5   1.830   0.408  -0.611
   45   2HD1  LEU   5          HD12      LEU   5   0.534   0.461  -1.812
   46   3HD1  LEU   5          HD13      LEU   5   0.606  -0.866  -0.641
   47   1HD2  LEU   5          HD21      LEU   5  -1.912   0.210  -0.613
   48   2HD2  LEU   5          HD22      LEU   5  -2.062   0.900   1.003
   49   3HD2  LEU   5          HD23      LEU   5  -1.290  -0.671   0.783
   50    H    ILE   6           HN       ILE   6  -1.408   3.891   1.297
   51    HA   ILE   6           HA       ILE   6  -2.625   3.808   4.032
   52    HB   ILE   6           HB       ILE   6  -2.925   5.673   1.660
   53   1HG1  ILE   6          HG12      ILE   6  -0.792   5.837   2.920
   54   2HG1  ILE   6          HG11      ILE   6  -1.778   7.285   3.116
   55   1HG2  ILE   6          HG21      ILE   6  -4.166   7.086   3.441
   56   2HG2  ILE   6          HG22      ILE   6  -4.349   5.567   4.319
   57   3HG2  ILE   6          HG23      ILE   6  -5.045   5.743   2.708
   58   1HD1  ILE   6          HD11      ILE   6  -1.624   7.001   5.347
   59   2HD1  ILE   6          HD12      ILE   6  -0.823   5.445   5.136
   60   3HD1  ILE   6          HD13      ILE   6  -2.584   5.531   5.176
   61    H    ILE   7           HN       ILE   7  -4.521   2.696   4.271
   62    HA   ILE   7           HA       ILE   7  -5.694   1.307   1.957
   63    HB   ILE   7           HB       ILE   7  -6.399   1.372   4.912
   64   1HG1  ILE   7          HG12      ILE   7  -4.889  -0.778   3.410
   65   2HG1  ILE   7          HG11      ILE   7  -4.061   0.558   4.211
   66   1HG2  ILE   7          HG21      ILE   7  -8.294   0.487   3.833
   67   2HG2  ILE   7          HG22      ILE   7  -7.352  -0.953   4.218
   68   3HG2  ILE   7          HG23      ILE   7  -7.330  -0.296   2.581
   69   1HD1  ILE   7          HD11      ILE   7  -5.539  -0.130   6.272
   70   2HD1  ILE   7          HD12      ILE   7  -4.083  -1.053   5.900
   71   3HD1  ILE   7          HD13      ILE   7  -5.665  -1.672   5.425
   72    H    ASN   8           HN       ASN   8  -7.071   2.520   0.704
   73    HA   ASN   8           HA       ASN   8  -8.864   4.513   2.017
   74   1HB   ASN   8          HB2       ASN   8  -7.802   4.013  -0.763
   75   2HB   ASN   8          HB1       ASN   8  -9.194   5.066  -0.516
   76   1HD2  ASN   8          HD21      ASN   8  -7.451   6.668  -1.452
   77   2HD2  ASN   8          HD22      ASN   8  -6.472   7.462  -0.302
   78    H    GLY   9           HN       GLY   9  -9.681   1.974   2.583
   79   1HA   GLY   9          HA2       GLY   9 -11.555   0.992   0.547
   80   2HA   GLY   9          HA1       GLY   9 -11.322   0.309   2.161
   81    H    LYS  10           HN       LYS  10 -13.798   1.210   0.627
   82    HA   LYS  10           HA       LYS  10 -14.953   3.536   1.710
   83   1HB   LYS  10          HB2       LYS  10 -16.199   0.874   0.963
   84   2HB   LYS  10          HB1       LYS  10 -17.089   2.387   1.137
   85   1HG   LYS  10          HG2       LYS  10 -15.309   3.303  -0.568
   86   2HG   LYS  10          HG1       LYS  10 -15.094   1.598  -0.966
   87   1HD   LYS  10          HD2       LYS  10 -17.167   1.418  -1.920
   88   2HD   LYS  10          HD1       LYS  10 -17.903   2.546  -0.781
   89   1HE   LYS  10          HE2       LYS  10 -17.377   4.396  -2.065
   90   2HE   LYS  10          HE1       LYS  10 -15.904   3.650  -2.718
   91   1HZ   LYS  10          HZ1       LYS  10 -17.518   3.619  -4.444
   92   2HZ   LYS  10          HZ2       LYS  10 -18.717   2.999  -3.412
   93   3HZ   LYS  10          HZ3       LYS  10 -17.397   2.030  -3.864
   94    H    THR  11           HN       THR  11 -14.648   0.302   3.110
   95    HA   THR  11           HA       THR  11 -16.000   1.289   5.601
   96    HB   THR  11           HB       THR  11 -15.589  -1.568   4.688
   97    HG1  THR  11           HG1      THR  11 -17.373  -1.409   3.540
   98   1HG2  THR  11          HG21      THR  11 -16.239  -1.710   6.897
   99   2HG2  THR  11          HG22      THR  11 -17.827  -1.608   6.136
  100   3HG2  THR  11          HG23      THR  11 -17.098  -0.170   6.852
  101    H    LEU  12           HN       LEU  12 -13.111  -0.199   4.258
  102    HA   LEU  12           HA       LEU  12 -11.942  -0.414   7.012
  103   1HB   LEU  12          HB2       LEU  12 -11.254  -1.762   4.379
  104   2HB   LEU  12          HB1       LEU  12 -10.410  -2.043   5.902
  105    HG   LEU  12           HG       LEU  12 -13.389  -2.347   5.850
  106   1HD1  LEU  12          HD11      LEU  12 -13.313  -4.533   4.941
  107   2HD1  LEU  12          HD12      LEU  12 -11.555  -4.612   5.059
  108   3HD1  LEU  12          HD13      LEU  12 -12.312  -3.576   3.849
  109   1HD2  LEU  12          HD21      LEU  12 -11.180  -3.907   7.226
  110   2HD2  LEU  12          HD22      LEU  12 -12.905  -3.986   7.580
  111   3HD2  LEU  12          HD23      LEU  12 -11.998  -2.517   7.938
  112    H    LYS  13           HN       LYS  13  -9.933   0.585   7.403
  113    HA   LYS  13           HA       LYS  13  -8.482   1.939   5.213
  114   1HB   LYS  13          HB2       LYS  13 -10.127   3.298   7.344
  115   2HB   LYS  13          HB1       LYS  13  -8.728   4.116   6.647
  116   1HG   LYS  13          HG2       LYS  13  -9.775   3.486   4.354
  117   2HG   LYS  13          HG1       LYS  13 -11.255   3.217   5.274
  118   1HD   LYS  13          HD2       LYS  13 -10.657   5.596   6.290
  119   2HD   LYS  13          HD1       LYS  13  -9.773   5.769   4.773
  120   1HE   LYS  13          HE2       LYS  13 -11.902   5.056   3.571
  121   2HE   LYS  13          HE1       LYS  13 -12.737   5.232   5.127
  122   1HZ   LYS  13          HZ1       LYS  13 -11.717   7.485   5.276
  123   2HZ   LYS  13          HZ2       LYS  13 -12.853   7.323   4.023
  124   3HZ   LYS  13          HZ3       LYS  13 -11.191   7.309   3.674
  125    H    GLY  14           HN       GLY  14  -6.751   3.484   6.563
  126   1HA   GLY  14          HA2       GLY  14  -5.569   3.365   8.848
  127   2HA   GLY  14          HA1       GLY  14  -5.511   1.628   8.548
  128    H    GLU  15           HN       GLU  15  -3.141   2.997   8.939
  129    HA   GLU  15           HA       GLU  15  -1.979   3.343   6.198
  130   1HB   GLU  15          HB2       GLU  15  -0.959   4.157   8.944
  131   2HB   GLU  15          HB1       GLU  15  -0.228   4.594   7.402
  132   1HG   GLU  15          HG2       GLU  15  -1.531   6.438   7.418
  133   2HG   GLU  15          HG1       GLU  15  -2.905   5.373   7.131
  134    H    THR  16           HN       THR  16   0.213   2.381   5.879
  135    HA   THR  16           HA       THR  16   1.101   0.312   7.785
  136    HB   THR  16           HB       THR  16  -0.751  -0.775   6.591
  137    HG1  THR  16           HG1      THR  16   0.448  -2.521   5.784
  138   1HG2  THR  16          HG21      THR  16  -0.367  -1.186   4.077
  139   2HG2  THR  16          HG22      THR  16   0.776   0.157   4.152
  140   3HG2  THR  16          HG23      THR  16  -0.924   0.418   4.551
  141    H    THR  17           HN       THR  17   3.242  -0.375   7.360
  142    HA   THR  17           HA       THR  17   4.590   0.749   4.936
  143    HB   THR  17           HB       THR  17   6.472   1.367   6.530
  144    HG1  THR  17           HG1      THR  17   4.428   1.029   8.463
  145   1HG2  THR  17          HG21      THR  17   3.752   2.666   6.740
  146   2HG2  THR  17          HG22      THR  17   5.110   3.149   5.724
  147   3HG2  THR  17          HG23      THR  17   5.194   3.369   7.471
  148    H    THR  18           HN       THR  18   6.611  -0.405   4.427
  149    HA   THR  18           HA       THR  18   7.040  -2.951   5.890
  150    HB   THR  18           HB       THR  18   5.724  -2.549   3.307
  151    HG1  THR  18           HG1      THR  18   4.946  -3.928   4.853
  152   1HG2  THR  18          HG21      THR  18   8.070  -4.477   3.278
  153   2HG2  THR  18          HG22      THR  18   8.010  -2.944   2.406
  154   3HG2  THR  18          HG23      THR  18   6.882  -4.237   1.994
  155    H    GLU  19           HN       GLU  19   9.150  -3.951   5.215
  156    HA   GLU  19           HA       GLU  19  11.116  -1.893   4.258
  157   1HB   GLU  19          HB2       GLU  19  11.212  -2.405   6.691
  158   2HB   GLU  19          HB1       GLU  19  11.441  -4.112   6.308
  159   1HG   GLU  19          HG2       GLU  19  13.411  -3.054   4.793
  160   2HG   GLU  19          HG1       GLU  19  13.354  -1.848   6.078
  161    H    ALA  20           HN       ALA  20  11.844  -2.537   2.262
  162    HA   ALA  20           HA       ALA  20  12.673  -5.363   1.869
  163   1HB   ALA  20          HB1       ALA  20  11.297  -5.018  -0.413
  164   2HB   ALA  20          HB2       ALA  20  10.360  -3.945   0.627
  165   3HB   ALA  20          HB3       ALA  20  10.535  -5.650   1.046
  166    H    VAL  21           HN       VAL  21  13.563  -5.523  -0.519
  167    HA   VAL  21           HA       VAL  21  15.795  -3.795  -0.817
  168    HB   VAL  21           HB       VAL  21  15.952  -4.868  -3.053
  169   1HG1  VAL  21          HG11      VAL  21  16.231  -7.078  -2.253
  170   2HG1  VAL  21          HG12      VAL  21  14.914  -6.914  -1.091
  171   3HG1  VAL  21          HG13      VAL  21  16.439  -6.070  -0.822
  172   1HG2  VAL  21          HG21      VAL  21  14.041  -6.598  -3.487
  173   2HG2  VAL  21          HG22      VAL  21  13.761  -4.911  -3.914
  174   3HG2  VAL  21          HG23      VAL  21  13.082  -5.567  -2.425
  175    H    ASP  22           HN       ASP  22  12.570  -3.649  -2.307
  176    HA   ASP  22           HA       ASP  22  12.950  -0.779  -2.896
  177   1HB   ASP  22          HB2       ASP  22  13.956  -1.983  -4.809
  178   2HB   ASP  22          HB1       ASP  22  12.456  -2.883  -5.032
  179    H    ALA  23           HN       ALA  23  10.854   0.175  -3.680
  180    HA   ALA  23           HA       ALA  23   8.604  -0.675  -2.147
  181   1HB   ALA  23          HB1       ALA  23   7.484   0.861  -4.043
  182   2HB   ALA  23          HB2       ALA  23   9.177   1.222  -4.384
  183   3HB   ALA  23          HB3       ALA  23   8.511   1.547  -2.783
  184    H    ALA  24           HN       ALA  24   9.730  -1.664  -5.315
  185    HA   ALA  24           HA       ALA  24   7.314  -2.676  -6.445
  186   1HB   ALA  24          HB1       ALA  24  10.255  -3.277  -6.669
  187   2HB   ALA  24          HB2       ALA  24   9.178  -2.554  -7.865
  188   3HB   ALA  24          HB3       ALA  24   9.093  -4.285  -7.534
  189    H    THR  25           HN       THR  25   9.739  -4.266  -4.352
  190    HA   THR  25           HA       THR  25   8.276  -6.786  -4.219
  191    HB   THR  25           HB       THR  25  10.603  -5.537  -2.729
  192    HG1  THR  25           HG1      THR  25  10.786  -6.256  -4.950
  193   1HG2  THR  25          HG21      THR  25   9.562  -8.374  -2.460
  194   2HG2  THR  25          HG22      THR  25   9.427  -7.123  -1.220
  195   3HG2  THR  25          HG23      THR  25  11.017  -7.726  -1.700
  196    H    ALA  26           HN       ALA  26   8.713  -3.990  -2.023
  197    HA   ALA  26           HA       ALA  26   7.239  -5.009   0.183
  198   1HB   ALA  26          HB1       ALA  26   8.615  -3.024   0.362
  199   2HB   ALA  26          HB2       ALA  26   6.951  -2.539   0.706
  200   3HB   ALA  26          HB3       ALA  26   7.668  -2.195  -0.874
  201    H    GLU  27           HN       GLU  27   6.042  -2.504  -2.081
  202    HA   GLU  27           HA       GLU  27   3.343  -2.485  -1.504
  203   1HB   GLU  27          HB2       GLU  27   4.522  -1.069  -3.155
  204   2HB   GLU  27          HB1       GLU  27   4.664  -2.449  -4.241
  205   1HG   GLU  27          HG2       GLU  27   2.012  -2.521  -3.889
  206   2HG   GLU  27          HG1       GLU  27   2.263  -0.806  -3.564
  207    H    LYS  28           HN       LYS  28   5.063  -4.976  -3.281
  208    HA   LYS  28           HA       LYS  28   2.789  -6.405  -4.339
  209   1HB   LYS  28          HB2       LYS  28   4.712  -7.135  -5.358
  210   2HB   LYS  28          HB1       LYS  28   5.714  -6.674  -3.997
  211   1HG   LYS  28          HG2       LYS  28   4.806  -8.818  -2.853
  212   2HG   LYS  28          HG1       LYS  28   4.272  -9.278  -4.471
  213   1HD   LYS  28          HD2       LYS  28   6.512  -9.201  -5.322
  214   2HD   LYS  28          HD1       LYS  28   7.109  -8.401  -3.864
  215   1HE   LYS  28          HE2       LYS  28   6.732 -10.401  -2.537
  216   2HE   LYS  28          HE1       LYS  28   5.925 -11.204  -3.899
  217   1HZ   LYS  28          HZ1       LYS  28   7.915 -11.089  -5.182
  218   2HZ   LYS  28          HZ2       LYS  28   8.322 -11.774  -3.682
  219   3HZ   LYS  28          HZ3       LYS  28   8.699 -10.150  -4.007
  220    H    VAL  29           HN       VAL  29   4.691  -6.757  -1.340
  221    HA   VAL  29           HA       VAL  29   3.047  -8.863  -0.197
  222    HB   VAL  29           HB       VAL  29   5.127  -6.876   0.758
  223   1HG1  VAL  29          HG11      VAL  29   3.536  -7.156   2.643
  224   2HG1  VAL  29          HG12      VAL  29   5.094  -7.914   2.990
  225   3HG1  VAL  29          HG13      VAL  29   3.715  -8.909   2.520
  226   1HG2  VAL  29          HG21      VAL  29   6.031  -8.737  -0.425
  227   2HG2  VAL  29          HG22      VAL  29   4.971  -9.874   0.407
  228   3HG2  VAL  29          HG23      VAL  29   6.288  -9.094   1.282
  229    H    LEU  30           HN       LEU  30   3.008  -5.315  -0.147
  230    HA   LEU  30           HA       LEU  30   1.057  -5.019   1.939
  231   1HB   LEU  30          HB2       LEU  30   1.969  -3.350  -0.417
  232   2HB   LEU  30          HB1       LEU  30   0.740  -2.763   0.687
  233    HG   LEU  30           HG       LEU  30   3.312  -2.167   1.030
  234   1HD1  LEU  30          HD11      LEU  30   1.353  -2.867   3.214
  235   2HD1  LEU  30          HD12      LEU  30   1.646  -1.286   2.483
  236   3HD1  LEU  30          HD13      LEU  30   2.884  -2.030   3.506
  237   1HD2  LEU  30          HD21      LEU  30   3.077  -4.880   2.337
  238   2HD2  LEU  30          HD22      LEU  30   4.176  -3.655   2.927
  239   3HD2  LEU  30          HD23      LEU  30   4.349  -4.259   1.292
  240    H    LYS  31           HN       LYS  31   0.881  -5.573  -1.536
  241    HA   LYS  31           HA       LYS  31  -1.935  -5.163  -1.961
  242   1HB   LYS  31          HB2       LYS  31   0.172  -5.738  -3.533
  243   2HB   LYS  31          HB1       LYS  31  -0.381  -7.375  -3.274
  244   1HG   LYS  31          HG2       LYS  31  -2.278  -5.197  -4.158
  245   2HG   LYS  31          HG1       LYS  31  -1.346  -6.141  -5.319
  246   1HD   LYS  31          HD2       LYS  31  -3.277  -7.260  -3.261
  247   2HD   LYS  31          HD1       LYS  31  -3.566  -7.148  -4.996
  248   1HE   LYS  31          HE2       LYS  31  -1.082  -8.475  -4.736
  249   2HE   LYS  31          HE1       LYS  31  -2.158  -9.218  -3.530
  250   1HZ   LYS  31          HZ1       LYS  31  -3.874  -9.399  -5.247
  251   2HZ   LYS  31          HZ2       LYS  31  -2.476 -10.257  -5.691
  252   3HZ   LYS  31          HZ3       LYS  31  -2.811  -8.748  -6.398
  253    H    GLN  32           HN       GLN  32  -0.005  -7.993  -1.040
  254    HA   GLN  32           HA       GLN  32  -2.047  -9.954  -0.857
  255   1HB   GLN  32          HB2       GLN  32   0.649  -9.443   0.288
  256   2HB   GLN  32          HB1       GLN  32  -0.335 -10.678   1.076
  257   1HG   GLN  32          HG2       GLN  32  -0.710 -11.725  -1.179
  258   2HG   GLN  32          HG1       GLN  32   0.454 -10.578  -1.844
  259   1HE2  GLN  32          HE21      GLN  32   2.596 -11.272  -1.833
  260   2HE2  GLN  32          HE22      GLN  32   3.215 -12.508  -0.833
  261    H    TYR  33           HN       TYR  33  -0.899  -7.575   1.527
  262    HA   TYR  33           HA       TYR  33  -2.553  -8.370   3.745
  263   1HB   TYR  33          HB2       TYR  33  -0.626  -6.884   3.951
  264   2HB   TYR  33          HB1       TYR  33  -1.369  -5.708   2.868
  265    HD1  TYR  33           HD1      TYR  33  -1.751  -7.421   6.131
  266    HD2  TYR  33           HD2      TYR  33  -2.897  -4.083   3.689
  267    HE1  TYR  33           HE1      TYR  33  -2.904  -6.411   8.065
  268    HE2  TYR  33           HE2      TYR  33  -4.048  -3.061   5.630
  269    HH   TYR  33           HH       TYR  33  -3.531  -3.680   8.614
  270    H    ILE  34           HN       ILE  34  -3.039  -6.159   1.020
  271    HA   ILE  34           HA       ILE  34  -5.628  -5.148   1.803
  272    HB   ILE  34           HB       ILE  34  -4.272  -5.480  -0.892
  273   1HG1  ILE  34          HG12      ILE  34  -3.100  -4.170   1.012
  274   2HG1  ILE  34          HG11      ILE  34  -3.258  -3.376  -0.547
  275   1HG2  ILE  34          HG21      ILE  34  -5.789  -3.333  -1.282
  276   2HG2  ILE  34          HG22      ILE  34  -6.785  -4.104  -0.048
  277   3HG2  ILE  34          HG23      ILE  34  -6.418  -4.958  -1.547
  278   1HD1  ILE  34          HD11      ILE  34  -5.023  -1.991   0.229
  279   2HD1  ILE  34          HD12      ILE  34  -3.845  -1.996   1.543
  280   3HD1  ILE  34          HD13      ILE  34  -5.294  -2.997   1.653
  281    H    ASN  35           HN       ASN  35  -4.521  -8.043   0.141
  282    HA   ASN  35           HA       ASN  35  -6.907  -8.890  -1.145
  283   1HB   ASN  35          HB2       ASN  35  -4.529  -9.809  -1.262
  284   2HB   ASN  35          HB1       ASN  35  -4.873 -10.648   0.251
  285   1HD2  ASN  35          HD21      ASN  35  -5.272 -12.805  -0.289
  286   2HD2  ASN  35          HD22      ASN  35  -6.291 -13.316  -1.547
  287    H    ASP  36           HN       ASP  36  -5.961  -8.985   2.241
  288    HA   ASP  36           HA       ASP  36  -8.049 -10.861   3.064
  289   1HB   ASP  36          HB2       ASP  36  -5.722 -10.219   4.108
  290   2HB   ASP  36          HB1       ASP  36  -6.631  -8.909   4.863
  291    H    ASN  37           HN       ASN  37  -7.526  -7.353   3.622
  292    HA   ASN  37           HA       ASN  37 -10.068  -6.814   4.805
  293   1HB   ASN  37          HB2       ASN  37  -8.178  -5.097   3.158
  294   2HB   ASN  37          HB1       ASN  37  -9.502  -4.460   4.141
  295   1HD2  ASN  37          HD21      ASN  37  -8.080  -3.365   5.651
  296   2HD2  ASN  37          HD22      ASN  37  -7.096  -4.228   6.744
  297    H    GLY  38           HN       GLY  38  -9.030  -6.935   1.421
  298   1HA   GLY  38          HA2       GLY  38 -10.444  -7.359  -0.455
  299   2HA   GLY  38          HA1       GLY  38 -11.850  -7.066   0.569
  300    H    ILE  39           HN       ILE  39  -9.082  -4.889   0.327
  301    HA   ILE  39           HA       ILE  39 -10.893  -2.858  -0.944
  302    HB   ILE  39           HB       ILE  39  -8.567  -2.532   0.985
  303   1HG1  ILE  39          HG12      ILE  39 -10.549  -3.533   2.058
  304   2HG1  ILE  39          HG11      ILE  39 -10.320  -1.871   2.610
  305   1HG2  ILE  39          HG21      ILE  39 -10.490  -0.530  -0.232
  306   2HG2  ILE  39          HG22      ILE  39  -8.739  -0.583  -0.436
  307   3HG2  ILE  39          HG23      ILE  39  -9.431  -0.172   1.132
  308   1HD1  ILE  39          HD11      ILE  39 -11.928  -1.540   0.386
  309   2HD1  ILE  39          HD12      ILE  39 -12.500  -1.576   2.054
  310   3HD1  ILE  39          HD13      ILE  39 -12.539  -3.043   1.077
  311    H    ASP  40           HN       ASP  40  -9.983  -3.948  -2.997
  312    HA   ASP  40           HA       ASP  40  -7.302  -2.781  -3.681
  313   1HB   ASP  40          HB2       ASP  40  -7.104  -4.740  -5.212
  314   2HB   ASP  40          HB1       ASP  40  -7.308  -5.235  -3.529
  315    H    GLY  41           HN       GLY  41  -7.498  -1.154  -5.162
  316   1HA   GLY  41          HA2       GLY  41  -9.370  -1.460  -7.424
  317   2HA   GLY  41          HA1       GLY  41  -9.650  -0.068  -6.373
  318    H    GLU  42           HN       GLU  42  -7.980   1.570  -6.245
  319    HA   GLU  42           HA       GLU  42  -5.977   1.460  -8.478
  320   1HB   GLU  42          HB2       GLU  42  -8.252   3.218  -7.975
  321   2HB   GLU  42          HB1       GLU  42  -6.753   4.139  -8.093
  322   1HG   GLU  42          HG2       GLU  42  -6.442   3.619 -10.300
  323   2HG   GLU  42          HG1       GLU  42  -7.140   2.008 -10.128
  324    H    TRP  43           HN       TRP  43  -3.960   1.589  -7.590
  325    HA   TRP  43           HA       TRP  43  -3.587   2.916  -4.947
  326   1HB   TRP  43          HB2       TRP  43  -1.852   1.157  -6.714
  327   2HB   TRP  43          HB1       TRP  43  -1.300   1.851  -5.201
  328    HD1  TRP  43           HD1      TRP  43  -4.869   0.450  -5.520
  329    HE1  TRP  43           HE1      TRP  43  -5.043  -1.648  -4.059
  330    HE3  TRP  43           HE3      TRP  43  -0.007  -0.015  -4.102
  331    HZ2  TRP  43           HZ2      TRP  43  -3.357  -3.290  -2.455
  332    HZ3  TRP  43           HZ3      TRP  43   0.684  -1.849  -2.574
  333    HH2  TRP  43           HH2      TRP  43  -0.978  -3.482  -1.752
  334    H    THR  44           HN       THR  44  -1.500   4.253  -4.801
  335    HA   THR  44           HA       THR  44  -0.668   5.565  -7.326
  336    HB   THR  44           HB       THR  44  -1.208   7.795  -6.404
  337    HG1  THR  44           HG1      THR  44  -1.914   8.011  -4.430
  338   1HG2  THR  44          HG21      THR  44  -2.874   6.414  -7.766
  339   2HG2  THR  44          HG22      THR  44  -3.557   7.721  -6.799
  340   3HG2  THR  44          HG23      THR  44  -3.672   6.054  -6.234
  341    H    TYR  45           HN       TYR  45   1.495   5.983  -7.211
  342    HA   TYR  45           HA       TYR  45   2.867   5.594  -4.599
  343   1HB   TYR  45          HB2       TYR  45   3.523   4.302  -6.611
  344   2HB   TYR  45          HB1       TYR  45   3.875   5.805  -7.459
  345    HD1  TYR  45           HD1      TYR  45   6.158   6.156  -7.672
  346    HD2  TYR  45           HD2      TYR  45   4.632   4.508  -4.010
  347    HE1  TYR  45           HE1      TYR  45   8.442   6.173  -6.713
  348    HE2  TYR  45           HE2      TYR  45   6.920   4.526  -3.049
  349    HH   TYR  45           HH       TYR  45   9.039   5.619  -3.367
  350    H    ASP  46           HN       ASP  46   4.635   7.152  -4.042
  351    HA   ASP  46           HA       ASP  46   4.551   9.801  -5.370
  352   1HB   ASP  46          HB2       ASP  46   4.014  10.935  -3.257
  353   2HB   ASP  46          HB1       ASP  46   2.750   9.774  -3.651
  354    H    ASP  47           HN       ASP  47   6.581  10.692  -5.384
  355    HA   ASP  47           HA       ASP  47   8.801   9.220  -4.169
  356   1HB   ASP  47          HB2       ASP  47   8.811  10.236  -6.441
  357   2HB   ASP  47          HB1       ASP  47   8.702  11.834  -5.703
  358    H    ALA  48           HN       ALA  48   6.709  11.397  -2.776
  359    HA   ALA  48           HA       ALA  48   8.385  13.333  -1.507
  360   1HB   ALA  48          HB1       ALA  48   5.730  12.758  -1.609
  361   2HB   ALA  48          HB2       ALA  48   6.429  13.846  -0.410
  362   3HB   ALA  48          HB3       ALA  48   6.108  12.163   0.007
  363    H    THR  49           HN       THR  49   7.253  10.157  -0.330
  364    HA   THR  49           HA       THR  49   9.766   9.790   1.191
  365    HB   THR  49           HB       THR  49   8.287  11.066   2.689
  366    HG1  THR  49           HG1      THR  49   8.516   9.720   4.364
  367   1HG2  THR  49          HG21      THR  49   6.242   9.666   1.417
  368   2HG2  THR  49          HG22      THR  49   6.061  10.729   2.814
  369   3HG2  THR  49          HG23      THR  49   6.267   8.994   3.048
  370    H    LYS  50           HN       LYS  50   8.388   8.519  -1.097
  371    HA   LYS  50           HA       LYS  50   7.906   6.375  -1.911
  372   1HB   LYS  50          HB2       LYS  50   9.271   5.542   0.669
  373   2HB   LYS  50          HB1       LYS  50   9.120   4.574  -0.793
  374   1HG   LYS  50          HG2       LYS  50  10.503   6.146  -2.040
  375   2HG   LYS  50          HG1       LYS  50  10.572   7.232  -0.654
  376   1HD   LYS  50          HD2       LYS  50  12.485   6.148  -0.108
  377   2HD   LYS  50          HD1       LYS  50  11.436   4.837   0.428
  378   1HE   LYS  50          HE2       LYS  50  12.815   3.688  -1.066
  379   2HE   LYS  50          HE1       LYS  50  11.520   4.195  -2.170
  380   1HZ   LYS  50          HZ1       LYS  50  13.610   4.878  -3.095
  381   2HZ   LYS  50          HZ2       LYS  50  14.071   5.626  -1.640
  382   3HZ   LYS  50          HZ3       LYS  50  12.791   6.263  -2.559
  383    H    THR  51           HN       THR  51   5.651   7.396  -0.901
  384    HA   THR  51           HA       THR  51   4.521   5.380   1.008
  385    HB   THR  51           HB       THR  51   3.300   7.981   0.032
  386    HG1  THR  51           HG1      THR  51   4.955   7.540   2.287
  387   1HG2  THR  51          HG21      THR  51   2.627   5.928   2.028
  388   2HG2  THR  51          HG22      THR  51   1.595   7.130   1.256
  389   3HG2  THR  51          HG23      THR  51   2.575   7.576   2.653
  390    H    TRP  52           HN       TRP  52   2.038   4.980   0.396
  391    HA   TRP  52           HA       TRP  52   1.691   4.764  -2.560
  392   1HB   TRP  52          HB2       TRP  52   1.778   2.594  -0.473
  393   2HB   TRP  52          HB1       TRP  52   0.891   2.371  -1.975
  394    HD1  TRP  52           HD1      TRP  52   4.397   2.525  -0.576
  395    HE1  TRP  52           HE1      TRP  52   6.072   1.940  -2.451
  396    HE3  TRP  52           HE3      TRP  52   1.249   2.525  -4.543
  397    HZ2  TRP  52           HZ2      TRP  52   6.055   1.517  -5.293
  398    HZ3  TRP  52           HZ3      TRP  52   2.074   2.025  -6.836
  399    HH2  TRP  52           HH2      TRP  52   4.476   1.521  -7.212
  400    H    THR  53           HN       THR  53  -0.631   3.432  -2.711
  401    HA   THR  53           HA       THR  53  -2.571   4.341  -0.694
  402    HB   THR  53           HB       THR  53  -2.804   5.324  -3.549
  403    HG1  THR  53           HG1      THR  53  -1.758   6.671  -1.282
  404   1HG2  THR  53          HG21      THR  53  -4.210   7.072  -2.198
  405   2HG2  THR  53          HG22      THR  53  -4.223   5.826  -0.950
  406   3HG2  THR  53          HG23      THR  53  -4.904   5.487  -2.542
  407    H    VAL  54           HN       VAL  54  -4.871   3.698  -1.506
  408    HA   VAL  54           HA       VAL  54  -5.145   1.715  -3.598
  409    HB   VAL  54           HB       VAL  54  -3.832   0.317  -2.150
  410   1HG1  VAL  54          HG11      VAL  54  -5.420   1.638  -0.004
  411   2HG1  VAL  54          HG12      VAL  54  -3.696   1.285  -0.075
  412   3HG1  VAL  54          HG13      VAL  54  -4.844  -0.002   0.287
  413   1HG2  VAL  54          HG21      VAL  54  -6.227  -0.526  -2.928
  414   2HG2  VAL  54          HG22      VAL  54  -6.543  -0.527  -1.193
  415   3HG2  VAL  54          HG23      VAL  54  -5.230  -1.509  -1.850
  416    H    THR  55           HN       THR  55  -7.036   2.905  -4.079
  417    HA   THR  55           HA       THR  55  -9.136   3.197  -1.999
  418    HB   THR  55           HB       THR  55  -9.218   4.039  -4.903
  419    HG1  THR  55           HG1      THR  55  -8.288   6.017  -4.075
  420   1HG2  THR  55          HG21      THR  55 -10.715   5.739  -4.101
  421   2HG2  THR  55          HG22      THR  55 -10.333   5.363  -2.421
  422   3HG2  THR  55          HG23      THR  55 -11.248   4.213  -3.396
  423    H    GLU  56           HN       GLU  56 -10.910   1.858  -1.935
  424    HA   GLU  56           HA       GLU  56 -11.067  -0.564  -3.446
  425   1HB   GLU  56          HB2       GLU  56 -12.116   0.167  -1.184
  426   2HB   GLU  56          HB1       GLU  56 -13.415   0.843  -2.168
  427   1HG   GLU  56          HG2       GLU  56 -12.486  -2.013  -2.501
  428   2HG   GLU  56          HG1       GLU  56 -13.735  -1.569  -1.337
  Start of MODEL   40
    1   1H    THR   1          HT1       THR   1  15.502   2.573   4.197
    2   2H    THR   1          HT2       THR   1  15.195   4.072   4.937
    3   3H    THR   1          HT3       THR   1  16.225   3.982   3.589
    4    HA   THR   1           HA       THR   1  14.006   4.852   2.999
    5    HB   THR   1           HB       THR   1  13.760   3.100   1.145
    6    HG1  THR   1           HG1      THR   1  15.235   1.443   1.172
    7   1HG2  THR   1          HG21      THR   1  15.426   5.109   1.294
    8   2HG2  THR   1          HG22      THR   1  15.683   3.876   0.059
    9   3HG2  THR   1          HG23      THR   1  16.643   3.856   1.539
   10    H    THR   2           HN       THR   2  11.890   4.756   3.625
   11    HA   THR   2           HA       THR   2  10.799   2.125   4.579
   12    HB   THR   2           HB       THR   2   9.936   4.872   5.499
   13    HG1  THR   2           HG1      THR   2  11.723   5.015   6.556
   14   1HG2  THR   2          HG21      THR   2   8.550   2.792   5.948
   15   2HG2  THR   2          HG22      THR   2   9.049   3.685   7.385
   16   3HG2  THR   2          HG23      THR   2   9.894   2.206   6.928
   17    H    PHE   3           HN       PHE   3   9.192   1.418   3.245
   18    HA   PHE   3           HA       PHE   3   7.960   3.167   1.247
   19   1HB   PHE   3          HB2       PHE   3   7.440   0.298   2.108
   20   2HB   PHE   3          HB1       PHE   3   6.807   1.046   0.641
   21    HD1  PHE   3           HD1      PHE   3   8.903   2.508  -0.560
   22    HD2  PHE   3           HD2      PHE   3   9.191  -1.171   1.646
   23    HE1  PHE   3           HE1      PHE   3  11.010   1.960  -1.747
   24    HE2  PHE   3           HE2      PHE   3  11.297  -1.716   0.458
   25    HZ   PHE   3           HZ       PHE   3  12.207  -0.151  -1.238
   26    H    LYS   4           HN       LYS   4   5.599   3.473   1.099
   27    HA   LYS   4           HA       LYS   4   4.096   3.161   3.666
   28   1HB   LYS   4          HB2       LYS   4   5.230   5.440   3.381
   29   2HB   LYS   4          HB1       LYS   4   4.150   5.700   2.020
   30   1HG   LYS   4          HG2       LYS   4   2.198   5.362   3.476
   31   2HG   LYS   4          HG1       LYS   4   3.267   5.096   4.852
   32   1HD   LYS   4          HD2       LYS   4   3.823   7.315   5.029
   33   2HD   LYS   4          HD1       LYS   4   3.696   7.591   3.292
   34   1HE   LYS   4          HE2       LYS   4   1.722   8.626   3.814
   35   2HE   LYS   4          HE1       LYS   4   1.081   6.980   3.985
   36   1HZ   LYS   4          HZ1       LYS   4   2.365   8.597   6.124
   37   2HZ   LYS   4          HZ2       LYS   4   1.864   6.983   6.294
   38   3HZ   LYS   4          HZ3       LYS   4   0.718   8.207   6.021
   39    H    LEU   5           HN       LEU   5   1.774   3.183   3.344
   40    HA   LEU   5           HA       LEU   5   0.739   3.305   0.569
   41   1HB   LEU   5          HB2       LEU   5   1.619   0.924   1.411
   42   2HB   LEU   5          HB1       LEU   5   0.045   0.890   2.198
   43    HG   LEU   5           HG       LEU   5  -0.206   1.845  -0.541
   44   1HD1  LEU   5          HD11      LEU   5   0.584   0.043  -1.798
   45   2HD1  LEU   5          HD12      LEU   5   0.658  -1.033  -0.391
   46   3HD1  LEU   5          HD13      LEU   5   1.865   0.242  -0.596
   47   1HD2  LEU   5          HD21      LEU   5  -1.294  -0.534   0.998
   48   2HD2  LEU   5          HD22      LEU   5  -1.834  -0.070  -0.616
   49   3HD2  LEU   5          HD23      LEU   5  -2.090   1.020   0.747
   50    H    ILE   6           HN       ILE   6  -1.398   3.991   0.559
   51    HA   ILE   6           HA       ILE   6  -2.675   4.434   3.233
   52    HB   ILE   6           HB       ILE   6  -2.938   5.821   0.548
   53   1HG1  ILE   6          HG12      ILE   6  -0.796   6.222   1.721
   54   2HG1  ILE   6          HG11      ILE   6  -1.784   7.681   1.679
   55   1HG2  ILE   6          HG21      ILE   6  -4.980   6.392   1.393
   56   2HG2  ILE   6          HG22      ILE   6  -4.038   7.531   2.355
   57   3HG2  ILE   6          HG23      ILE   6  -4.523   5.983   3.046
   58   1HD1  ILE   6          HD11      ILE   6  -0.829   6.161   3.976
   59   2HD1  ILE   6          HD12      ILE   6  -2.577   6.385   4.027
   60   3HD1  ILE   6          HD13      ILE   6  -1.512   7.786   3.919
   61    H    ILE   7           HN       ILE   7  -4.602   3.403   3.622
   62    HA   ILE   7           HA       ILE   7  -5.722   1.602   1.585
   63    HB   ILE   7           HB       ILE   7  -6.554   2.272   4.429
   64   1HG1  ILE   7          HG12      ILE   7  -4.960  -0.101   3.417
   65   2HG1  ILE   7          HG11      ILE   7  -4.212   1.343   4.101
   66   1HG2  ILE   7          HG21      ILE   7  -7.489  -0.162   4.150
   67   2HG2  ILE   7          HG22      ILE   7  -7.421   0.202   2.425
   68   3HG2  ILE   7          HG23      ILE   7  -8.413   1.192   3.498
   69   1HD1  ILE   7          HD11      ILE   7  -5.873  -0.753   5.451
   70   2HD1  ILE   7          HD12      ILE   7  -5.926   0.897   6.073
   71   3HD1  ILE   7          HD13      ILE   7  -4.392   0.028   6.005
   72    H    ASN   8           HN       ASN   8  -7.227   2.326   0.145
   73    HA   ASN   8           HA       ASN   8  -8.990   4.619   0.943
   74   1HB   ASN   8          HB2       ASN   8  -7.693   3.716  -1.622
   75   2HB   ASN   8          HB1       ASN   8  -9.124   4.745  -1.675
   76   1HD2  ASN   8          HD21      ASN   8  -7.763   6.519  -2.550
   77   2HD2  ASN   8          HD22      ASN   8  -6.737   7.400  -1.510
   78    H    GLY   9           HN       GLY   9  -9.898   2.228   1.849
   79   1HA   GLY   9          HA2       GLY   9 -11.585   0.901  -0.155
   80   2HA   GLY   9          HA1       GLY   9 -11.514   0.508   1.568
   81    H    LYS  10           HN       LYS  10 -13.929   0.862  -0.005
   82    HA   LYS  10           HA       LYS  10 -15.198   3.358   0.214
   83   1HB   LYS  10          HB2       LYS  10 -16.250   0.529   0.486
   84   2HB   LYS  10          HB1       LYS  10 -17.283   1.940   0.248
   85   1HG   LYS  10          HG2       LYS  10 -15.924   2.454  -1.832
   86   2HG   LYS  10          HG1       LYS  10 -15.166   0.873  -1.636
   87   1HD   LYS  10          HD2       LYS  10 -17.148  -0.281  -2.078
   88   2HD   LYS  10          HD1       LYS  10 -18.163   1.091  -1.632
   89   1HE   LYS  10          HE2       LYS  10 -17.546   2.285  -3.660
   90   2HE   LYS  10          HE1       LYS  10 -16.368   1.027  -4.084
   91   1HZ   LYS  10          HZ1       LYS  10 -18.213  -0.595  -4.009
   92   2HZ   LYS  10          HZ2       LYS  10 -18.411   0.571  -5.229
   93   3HZ   LYS  10          HZ3       LYS  10 -19.305   0.684  -3.789
   94    H    THR  11           HN       THR  11 -14.609   0.924   2.693
   95    HA   THR  11           HA       THR  11 -15.906   2.728   4.713
   96    HB   THR  11           HB       THR  11 -15.654  -0.285   4.856
   97    HG1  THR  11           HG1      THR  11 -17.589  -0.429   3.881
   98   1HG2  THR  11          HG21      THR  11 -17.243  -0.136   6.599
   99   2HG2  THR  11          HG22      THR  11 -17.711   1.503   6.146
  100   3HG2  THR  11          HG23      THR  11 -16.145   1.211   6.902
  101    H    LEU  12           HN       LEU  12 -13.329   0.343   4.101
  102    HA   LEU  12           HA       LEU  12 -11.990   0.941   6.660
  103   1HB   LEU  12          HB2       LEU  12 -11.287  -0.772   4.253
  104   2HB   LEU  12          HB1       LEU  12 -10.391  -0.765   5.773
  105    HG   LEU  12           HG       LEU  12 -13.344  -1.199   5.903
  106   1HD1  LEU  12          HD11      LEU  12 -13.306  -3.384   5.139
  107   2HD1  LEU  12          HD12      LEU  12 -11.582  -3.577   5.460
  108   3HD1  LEU  12          HD13      LEU  12 -12.120  -2.665   4.049
  109   1HD2  LEU  12          HD21      LEU  12 -11.585  -1.054   7.836
  110   2HD2  LEU  12          HD22      LEU  12 -11.165  -2.695   7.347
  111   3HD2  LEU  12          HD23      LEU  12 -12.802  -2.329   7.890
  112    H    LYS  13           HN       LYS  13  -9.936   1.973   6.813
  113    HA   LYS  13           HA       LYS  13  -8.599   3.056   4.433
  114   1HB   LYS  13          HB2       LYS  13 -10.471   4.604   6.164
  115   2HB   LYS  13          HB1       LYS  13  -8.995   5.425   5.654
  116   1HG   LYS  13          HG2       LYS  13  -9.735   4.322   3.297
  117   2HG   LYS  13          HG1       LYS  13 -11.322   4.535   4.036
  118   1HD   LYS  13          HD2       LYS  13  -9.255   6.743   3.900
  119   2HD   LYS  13          HD1       LYS  13 -10.505   6.516   2.677
  120   1HE   LYS  13          HE2       LYS  13 -11.497   6.524   5.471
  121   2HE   LYS  13          HE1       LYS  13 -10.856   8.073   4.888
  122   1HZ   LYS  13          HZ1       LYS  13 -12.180   7.754   2.848
  123   2HZ   LYS  13          HZ2       LYS  13 -13.148   7.895   4.237
  124   3HZ   LYS  13          HZ3       LYS  13 -12.881   6.371   3.534
  125    H    GLY  14           HN       GLY  14  -6.926   4.860   5.437
  126   1HA   GLY  14          HA2       GLY  14  -5.701   5.298   7.630
  127   2HA   GLY  14          HA1       GLY  14  -5.692   3.545   7.825
  128    H    GLU  15           HN       GLU  15  -3.261   4.665   7.896
  129    HA   GLU  15           HA       GLU  15  -2.106   4.289   5.151
  130   1HB   GLU  15          HB2       GLU  15  -0.274   5.741   6.028
  131   2HB   GLU  15          HB1       GLU  15  -1.844   6.541   6.093
  132   1HG   GLU  15          HG2       GLU  15  -1.130   4.978   8.508
  133   2HG   GLU  15          HG1       GLU  15  -0.129   6.399   8.210
  134    H    THR  16           HN       THR  16   0.241   3.431   5.287
  135    HA   THR  16           HA       THR  16   0.965   1.824   7.625
  136    HB   THR  16           HB       THR  16  -0.863   0.495   6.656
  137    HG1  THR  16           HG1      THR  16   0.919  -0.623   7.497
  138   1HG2  THR  16          HG21      THR  16   0.776   0.774   4.128
  139   2HG2  THR  16          HG22      THR  16  -0.923   1.177   4.380
  140   3HG2  THR  16          HG23      THR  16  -0.416  -0.510   4.335
  141    H    THR  17           HN       THR  17   3.115   1.022   7.449
  142    HA   THR  17           HA       THR  17   4.555   1.607   4.886
  143    HB   THR  17           HB       THR  17   6.400   2.494   6.316
  144    HG1  THR  17           HG1      THR  17   4.461   2.268   8.372
  145   1HG2  THR  17          HG21      THR  17   4.934   4.137   5.389
  146   2HG2  THR  17          HG22      THR  17   5.135   4.567   7.088
  147   3HG2  THR  17          HG23      THR  17   3.664   3.757   6.551
  148    H    THR  18           HN       THR  18   6.534   0.315   4.636
  149    HA   THR  18           HA       THR  18   6.846  -1.952   6.523
  150    HB   THR  18           HB       THR  18   5.562  -1.975   3.896
  151    HG1  THR  18           HG1      THR  18   4.923  -3.023   5.862
  152   1HG2  THR  18          HG21      THR  18   6.689  -3.884   2.900
  153   2HG2  THR  18          HG22      THR  18   7.862  -3.933   4.216
  154   3HG2  THR  18          HG23      THR  18   7.847  -2.568   3.097
  155    H    GLU  19           HN       GLU  19   8.934  -3.099   6.121
  156    HA   GLU  19           HA       GLU  19  10.980  -1.306   4.849
  157   1HB   GLU  19          HB2       GLU  19  10.960  -1.493   7.368
  158   2HB   GLU  19          HB1       GLU  19  11.290  -3.217   7.187
  159   1HG   GLU  19          HG2       GLU  19  13.231  -2.222   5.589
  160   2HG   GLU  19          HG1       GLU  19  13.083  -0.890   6.738
  161    H    ALA  20           HN       ALA  20  11.695  -2.284   2.990
  162    HA   ALA  20           HA       ALA  20  12.442  -5.157   3.065
  163   1HB   ALA  20          HB1       ALA  20  11.099  -5.233   0.779
  164   2HB   ALA  20          HB2       ALA  20  10.221  -3.884   1.502
  165   3HB   ALA  20          HB3       ALA  20  10.256  -5.450   2.314
  166    H    VAL  21           HN       VAL  21  13.366  -5.726   0.762
  167    HA   VAL  21           HA       VAL  21  15.624  -4.088   0.218
  168    HB   VAL  21           HB       VAL  21  15.836  -5.552  -1.776
  169   1HG1  VAL  21          HG11      VAL  21  14.735  -7.179   0.519
  170   2HG1  VAL  21          HG12      VAL  21  16.280  -6.336   0.626
  171   3HG1  VAL  21          HG13      VAL  21  16.046  -7.598  -0.584
  172   1HG2  VAL  21          HG21      VAL  21  13.934  -7.331  -1.951
  173   2HG2  VAL  21          HG22      VAL  21  13.667  -5.747  -2.676
  174   3HG2  VAL  21          HG23      VAL  21  12.946  -6.133  -1.115
  175    H    ASP  22           HN       ASP  22  12.450  -4.232  -1.396
  176    HA   ASP  22           HA       ASP  22  12.903  -1.518  -2.507
  177   1HB   ASP  22          HB2       ASP  22  12.278  -3.988  -4.165
  178   2HB   ASP  22          HB1       ASP  22  12.341  -2.339  -4.786
  179    H    ALA  23           HN       ALA  23  10.798  -0.771  -3.609
  180    HA   ALA  23           HA       ALA  23   8.556  -1.157  -1.846
  181   1HB   ALA  23          HB1       ALA  23   8.646   0.897  -2.975
  182   2HB   ALA  23          HB2       ALA  23   7.421   0.035  -3.907
  183   3HB   ALA  23          HB3       ALA  23   9.075   0.142  -4.510
  184    H    ALA  24           HN       ALA  24   9.596  -2.787  -4.775
  185    HA   ALA  24           HA       ALA  24   7.137  -3.958  -5.624
  186   1HB   ALA  24          HB1       ALA  24   9.537  -3.894  -6.654
  187   2HB   ALA  24          HB2       ALA  24   8.546  -5.325  -6.938
  188   3HB   ALA  24          HB3       ALA  24   9.810  -5.357  -5.708
  189    H    THR  25           HN       THR  25   9.600  -5.152  -3.321
  190    HA   THR  25           HA       THR  25   8.130  -7.577  -2.666
  191    HB   THR  25           HB       THR  25  10.470  -6.065  -1.467
  192    HG1  THR  25           HG1      THR  25  11.610  -7.765  -2.380
  193   1HG2  THR  25          HG21      THR  25   9.422  -8.787  -0.632
  194   2HG2  THR  25          HG22      THR  25   9.299  -7.313   0.335
  195   3HG2  THR  25          HG23      THR  25  10.883  -8.006  -0.026
  196    H    ALA  26           HN       ALA  26   8.560  -4.391  -1.084
  197    HA   ALA  26           HA       ALA  26   7.093  -4.975   1.286
  198   1HB   ALA  26          HB1       ALA  26   8.482  -2.999   1.097
  199   2HB   ALA  26          HB2       ALA  26   6.820  -2.446   1.338
  200   3HB   ALA  26          HB3       ALA  26   7.544  -2.410  -0.276
  201    H    GLU  27           HN       GLU  27   5.916  -2.934  -1.414
  202    HA   GLU  27           HA       GLU  27   3.216  -2.797  -0.851
  203   1HB   GLU  27          HB2       GLU  27   4.406  -1.714  -2.733
  204   2HB   GLU  27          HB1       GLU  27   4.526  -3.270  -3.552
  205   1HG   GLU  27          HG2       GLU  27   1.893  -3.276  -3.216
  206   2HG   GLU  27          HG1       GLU  27   2.124  -1.531  -3.127
  207    H    LYS  28           HN       LYS  28   4.934  -5.577  -2.129
  208    HA   LYS  28           HA       LYS  28   2.663  -7.172  -2.921
  209   1HB   LYS  28          HB2       LYS  28   4.621  -8.037  -3.772
  210   2HB   LYS  28          HB1       LYS  28   5.587  -7.398  -2.458
  211   1HG   LYS  28          HG2       LYS  28   4.567  -9.345  -1.052
  212   2HG   LYS  28          HG1       LYS  28   4.129 -10.030  -2.619
  213   1HD   LYS  28          HD2       LYS  28   6.408 -10.114  -3.322
  214   2HD   LYS  28          HD1       LYS  28   6.934  -9.074  -1.993
  215   1HE   LYS  28          HE2       LYS  28   5.618 -11.749  -1.454
  216   2HE   LYS  28          HE1       LYS  28   7.368 -11.613  -1.723
  217   1HZ   LYS  28          HZ1       LYS  28   7.346  -9.782  -0.046
  218   2HZ   LYS  28          HZ2       LYS  28   6.996 -11.317   0.593
  219   3HZ   LYS  28          HZ3       LYS  28   5.744 -10.200   0.322
  220    H    VAL  29           HN       VAL  29   4.548  -6.970   0.106
  221    HA   VAL  29           HA       VAL  29   2.887  -8.819   1.613
  222    HB   VAL  29           HB       VAL  29   4.961  -6.686   2.198
  223   1HG1  VAL  29          HG11      VAL  29   3.537  -8.363   4.293
  224   2HG1  VAL  29          HG12      VAL  29   3.352  -6.618   4.089
  225   3HG1  VAL  29          HG13      VAL  29   4.909  -7.291   4.583
  226   1HG2  VAL  29          HG21      VAL  29   6.097  -8.580   1.562
  227   2HG2  VAL  29          HG22      VAL  29   4.807  -9.660   2.090
  228   3HG2  VAL  29          HG23      VAL  29   5.905  -8.952   3.275
  229    H    LEU  30           HN       LEU  30   2.864  -5.325   0.997
  230    HA   LEU  30           HA       LEU  30   0.900  -4.630   2.968
  231   1HB   LEU  30          HB2       LEU  30   1.828  -3.451   0.341
  232   2HB   LEU  30          HB1       LEU  30   0.594  -2.660   1.302
  233    HG   LEU  30           HG       LEU  30   3.172  -2.018   1.542
  234   1HD1  LEU  30          HD11      LEU  30   1.176  -2.253   3.789
  235   2HD1  LEU  30          HD12      LEU  30   1.509  -0.849   2.771
  236   3HD1  LEU  30          HD13      LEU  30   2.718  -1.398   3.941
  237   1HD2  LEU  30          HD21      LEU  30   3.992  -3.100   3.715
  238   2HD2  LEU  30          HD22      LEU  30   4.197  -4.012   2.235
  239   3HD2  LEU  30          HD23      LEU  30   2.901  -4.420   3.352
  240    H    LYS  31           HN       LYS  31   0.738  -5.891  -0.314
  241    HA   LYS  31           HA       LYS  31  -2.073  -5.550  -0.834
  242   1HB   LYS  31          HB2       LYS  31   0.032  -6.438  -2.250
  243   2HB   LYS  31          HB1       LYS  31  -0.525  -7.988  -1.664
  244   1HG   LYS  31          HG2       LYS  31  -2.416  -6.033  -2.976
  245   2HG   LYS  31          HG1       LYS  31  -1.481  -7.192  -3.921
  246   1HD   LYS  31          HD2       LYS  31  -3.419  -7.873  -1.685
  247   2HD   LYS  31          HD1       LYS  31  -3.703  -8.111  -3.408
  248   1HE   LYS  31          HE2       LYS  31  -1.221  -9.359  -2.878
  249   2HE   LYS  31          HE1       LYS  31  -2.303  -9.847  -1.553
  250   1HZ   LYS  31          HZ1       LYS  31  -4.027 -10.283  -3.274
  251   2HZ   LYS  31          HZ2       LYS  31  -2.683 -11.317  -3.387
  252   3HZ   LYS  31          HZ3       LYS  31  -2.855 -10.021  -4.472
  253    H    GLN  32           HN       GLN  32  -0.164  -8.148   0.643
  254    HA   GLN  32           HA       GLN  32  -2.211 -10.023   1.212
  255   1HB   GLN  32          HB2       GLN  32   0.485  -9.302   2.217
  256   2HB   GLN  32          HB1       GLN  32  -0.503 -10.311   3.275
  257   1HG   GLN  32          HG2       GLN  32  -0.620 -12.059   1.730
  258   2HG   GLN  32          HG1       GLN  32  -0.269 -11.000   0.363
  259   1HE2  GLN  32          HE21      GLN  32   1.804 -11.313  -0.436
  260   2HE2  GLN  32          HE22      GLN  32   3.159 -11.761   0.499
  261    H    TYR  33           HN       TYR  33  -1.081  -7.205   3.063
  262    HA   TYR  33           HA       TYR  33  -2.748  -7.538   5.389
  263   1HB   TYR  33          HB2       TYR  33  -0.817  -6.041   5.300
  264   2HB   TYR  33          HB1       TYR  33  -1.556  -5.105   4.001
  265    HD1  TYR  33           HD1      TYR  33  -1.959  -6.140   7.537
  266    HD2  TYR  33           HD2      TYR  33  -3.078  -3.345   4.481
  267    HE1  TYR  33           HE1      TYR  33  -3.119  -4.768   9.228
  268    HE2  TYR  33           HE2      TYR  33  -4.237  -1.958   6.175
  269    HH   TYR  33           HH       TYR  33  -3.747  -1.945   9.193
  270    H    ILE  34           HN       ILE  34  -3.210  -5.923   2.271
  271    HA   ILE  34           HA       ILE  34  -5.802  -4.772   2.816
  272    HB   ILE  34           HB       ILE  34  -4.430  -5.633   0.250
  273   1HG1  ILE  34          HG12      ILE  34  -3.267  -3.974   1.880
  274   2HG1  ILE  34          HG11      ILE  34  -3.384  -3.525   0.187
  275   1HG2  ILE  34          HG21      ILE  34  -6.798  -3.818   0.739
  276   2HG2  ILE  34          HG22      ILE  34  -6.745  -5.281  -0.244
  277   3HG2  ILE  34          HG23      ILE  34  -5.890  -3.832  -0.773
  278   1HD1  ILE  34          HD11      ILE  34  -5.375  -2.146   0.712
  279   2HD1  ILE  34          HD12      ILE  34  -3.967  -1.629   1.640
  280   3HD1  ILE  34          HD13      ILE  34  -5.226  -2.595   2.412
  281    H    ASN  35           HN       ASN  35  -4.697  -7.961   1.856
  282    HA   ASN  35           HA       ASN  35  -7.047  -9.048   0.688
  283   1HB   ASN  35          HB2       ASN  35  -4.687  -9.997   0.873
  284   2HB   ASN  35          HB1       ASN  35  -5.098 -10.468   2.522
  285   1HD2  ASN  35          HD21      ASN  35  -5.394 -11.376  -0.803
  286   2HD2  ASN  35          HD22      ASN  35  -6.430 -12.700  -0.573
  287    H    ASP  36           HN       ASP  36  -6.193  -8.473   4.061
  288    HA   ASP  36           HA       ASP  36  -8.340 -10.072   5.206
  289   1HB   ASP  36          HB2       ASP  36  -6.140  -9.360   6.268
  290   2HB   ASP  36          HB1       ASP  36  -6.824  -7.741   6.415
  291    H    ASN  37           HN       ASN  37  -7.892  -6.613   4.467
  292    HA   ASN  37           HA       ASN  37 -10.515  -5.841   5.506
  293   1HB   ASN  37          HB2       ASN  37  -8.446  -4.466   3.757
  294   2HB   ASN  37          HB1       ASN  37  -9.851  -3.659   4.462
  295   1HD2  ASN  37          HD21      ASN  37  -8.957  -2.374   6.108
  296   2HD2  ASN  37          HD22      ASN  37  -7.934  -2.967   7.338
  297    H    GLY  38           HN       GLY  38  -9.166  -6.785   2.393
  298   1HA   GLY  38          HA2       GLY  38 -10.327  -7.487   0.457
  299   2HA   GLY  38          HA1       GLY  38 -11.846  -7.117   1.275
  300    H    ILE  39           HN       ILE  39  -9.062  -4.976   0.675
  301    HA   ILE  39           HA       ILE  39 -10.878  -3.241  -0.974
  302    HB   ILE  39           HB       ILE  39  -8.713  -2.485   1.020
  303   1HG1  ILE  39          HG12      ILE  39 -10.755  -3.349   2.102
  304   2HG1  ILE  39          HG11      ILE  39 -10.601  -1.610   2.366
  305   1HG2  ILE  39          HG21      ILE  39  -8.850  -0.852  -0.789
  306   2HG2  ILE  39          HG22      ILE  39  -9.569  -0.169   0.669
  307   3HG2  ILE  39          HG23      ILE  39 -10.604  -0.776  -0.624
  308   1HD1  ILE  39          HD11      ILE  39 -12.906  -2.109   1.761
  309   2HD1  ILE  39          HD12      ILE  39 -12.378  -2.976   0.319
  310   3HD1  ILE  39          HD13      ILE  39 -12.150  -1.231   0.432
  311    H    ASP  40           HN       ASP  40  -9.853  -4.514  -2.804
  312    HA   ASP  40           HA       ASP  40  -7.098  -3.500  -3.440
  313   1HB   ASP  40          HB2       ASP  40  -7.555  -6.003  -2.998
  314   2HB   ASP  40          HB1       ASP  40  -8.420  -5.988  -4.538
  315    H    GLY  41           HN       GLY  41  -7.024  -2.164  -5.203
  316   1HA   GLY  41          HA2       GLY  41  -8.821  -2.585  -7.488
  317   2HA   GLY  41          HA1       GLY  41  -9.079  -1.068  -6.620
  318    H    GLU  42           HN       GLU  42  -7.510   0.573  -6.774
  319    HA   GLU  42           HA       GLU  42  -5.319   0.073  -8.766
  320   1HB   GLU  42          HB2       GLU  42  -7.380   2.201  -8.395
  321   2HB   GLU  42          HB1       GLU  42  -5.796   2.714  -8.980
  322   1HG   GLU  42          HG2       GLU  42  -5.982   1.521 -10.956
  323   2HG   GLU  42          HG1       GLU  42  -7.072   0.325 -10.254
  324    H    TRP  43           HN       TRP  43  -3.335   0.250  -7.825
  325    HA   TRP  43           HA       TRP  43  -3.045   1.836  -5.314
  326   1HB   TRP  43          HB2       TRP  43  -1.407  -0.310  -6.691
  327   2HB   TRP  43          HB1       TRP  43  -0.815   0.582  -5.303
  328    HD1  TRP  43           HD1      TRP  43  -4.471  -0.605  -5.606
  329    HE1  TRP  43           HE1      TRP  43  -4.892  -2.339  -3.761
  330    HE3  TRP  43           HE3      TRP  43   0.229  -1.013  -3.742
  331    HZ2  TRP  43           HZ2      TRP  43  -3.429  -3.691  -1.716
  332    HZ3  TRP  43           HZ3      TRP  43   0.702  -2.515  -1.818
  333    HH2  TRP  43           HH2      TRP  43  -1.120  -3.849  -0.806
  334    H    THR  44           HN       THR  44  -2.966   3.945  -6.444
  335    HA   THR  44           HA       THR  44  -1.151   4.560  -8.567
  336    HB   THR  44           HB       THR  44  -1.519   6.887  -7.795
  337    HG1  THR  44           HG1      THR  44  -1.413   6.442  -5.560
  338   1HG2  THR  44          HG21      THR  44  -3.705   4.902  -8.117
  339   2HG2  THR  44          HG22      THR  44  -3.361   6.362  -9.047
  340   3HG2  THR  44          HG23      THR  44  -4.179   6.481  -7.489
  341    H    TYR  45           HN       TYR  45   1.037   4.814  -8.543
  342    HA   TYR  45           HA       TYR  45   2.466   4.579  -5.938
  343   1HB   TYR  45          HB2       TYR  45   2.924   3.011  -7.803
  344   2HB   TYR  45          HB1       TYR  45   3.379   4.370  -8.830
  345    HD1  TYR  45           HD1      TYR  45   4.136   3.401  -5.279
  346    HD2  TYR  45           HD2      TYR  45   5.678   4.484  -9.138
  347    HE1  TYR  45           HE1      TYR  45   6.446   3.310  -4.382
  348    HE2  TYR  45           HE2      TYR  45   7.987   4.394  -8.241
  349    HH   TYR  45           HH       TYR  45   8.715   3.033  -5.175
  350    H    ASP  46           HN       ASP  46   4.371   6.014  -5.596
  351    HA   ASP  46           HA       ASP  46   4.568   8.466  -7.227
  352   1HB   ASP  46          HB2       ASP  46   4.071   9.908  -5.254
  353   2HB   ASP  46          HB1       ASP  46   2.688   8.920  -5.718
  354    H    ASP  47           HN       ASP  47   6.730   8.791  -7.403
  355    HA   ASP  47           HA       ASP  47   8.625   7.573  -5.532
  356   1HB   ASP  47          HB2       ASP  47  10.265   8.460  -7.142
  357   2HB   ASP  47          HB1       ASP  47   8.943   7.662  -7.987
  358    H    ALA  48           HN       ALA  48   7.051  10.650  -5.773
  359    HA   ALA  48           HA       ALA  48   8.979  12.453  -4.753
  360   1HB   ALA  48          HB1       ALA  48   6.003  12.170  -4.731
  361   2HB   ALA  48          HB2       ALA  48   7.000  13.451  -5.421
  362   3HB   ALA  48          HB3       ALA  48   6.712  13.398  -3.682
  363    H    THR  49           HN       THR  49   7.127   9.954  -3.102
  364    HA   THR  49           HA       THR  49   8.769  10.349  -0.669
  365    HB   THR  49           HB       THR  49   6.856  11.864  -0.400
  366    HG1  THR  49           HG1      THR  49   6.065  10.960   1.521
  367   1HG2  THR  49          HG21      THR  49   4.556  10.636  -0.178
  368   2HG2  THR  49          HG22      THR  49   5.312   9.409  -1.192
  369   3HG2  THR  49          HG23      THR  49   5.150  11.061  -1.783
  370    H    LYS  50           HN       LYS  50   8.364   8.251  -2.756
  371    HA   LYS  50           HA       LYS  50   7.892   5.955  -2.994
  372   1HB   LYS  50          HB2       LYS  50   9.198   4.701  -1.414
  373   2HB   LYS  50          HB1       LYS  50   9.999   6.247  -1.652
  374   1HG   LYS  50          HG2       LYS  50   8.047   6.130   0.595
  375   2HG   LYS  50          HG1       LYS  50   9.514   5.184   0.790
  376   1HD   LYS  50          HD2       LYS  50   9.948   7.906  -0.275
  377   2HD   LYS  50          HD1       LYS  50   9.327   7.849   1.375
  378   1HE   LYS  50          HE2       LYS  50  11.487   5.901   0.860
  379   2HE   LYS  50          HE1       LYS  50  11.989   7.599   0.727
  380   1HZ   LYS  50          HZ1       LYS  50  10.434   6.434   2.978
  381   2HZ   LYS  50          HZ2       LYS  50  10.923   8.056   2.841
  382   3HZ   LYS  50          HZ3       LYS  50  12.083   6.828   3.030
  383    H    THR  51           HN       THR  51   5.586   7.448  -1.876
  384    HA   THR  51           HA       THR  51   4.399   5.591   0.099
  385    HB   THR  51           HB       THR  51   3.339   8.068  -1.309
  386    HG1  THR  51           HG1      THR  51   3.862   8.996   0.772
  387   1HG2  THR  51          HG21      THR  51   2.303   6.309   0.891
  388   2HG2  THR  51          HG22      THR  51   1.433   7.025  -0.466
  389   3HG2  THR  51          HG23      THR  51   1.918   8.030   0.900
  390    H    TRP  52           HN       TRP  52   2.101   4.808  -0.415
  391    HA   TRP  52           HA       TRP  52   1.770   4.155  -3.325
  392   1HB   TRP  52          HB2       TRP  52   1.817   2.409  -0.871
  393   2HB   TRP  52          HB1       TRP  52   0.940   1.906  -2.308
  394    HD1  TRP  52           HD1      TRP  52   4.434   2.336  -0.943
  395    HE1  TRP  52           HE1      TRP  52   6.126   1.414  -2.663
  396    HE3  TRP  52           HE3      TRP  52   1.310   1.552  -4.860
  397    HZ2  TRP  52           HZ2      TRP  52   6.131   0.459  -5.372
  398    HZ3  TRP  52           HZ3      TRP  52   2.161   0.634  -7.009
  399    HH2  TRP  52           HH2      TRP  52   4.567   0.085  -7.266
  400    H    THR  53           HN       THR  53  -0.541   2.797  -3.288
  401    HA   THR  53           HA       THR  53  -2.532   4.079  -1.538
  402    HB   THR  53           HB       THR  53  -2.839   4.399  -4.521
  403    HG1  THR  53           HG1      THR  53  -1.513   6.156  -2.735
  404   1HG2  THR  53          HG21      THR  53  -3.961   6.566  -3.396
  405   2HG2  THR  53          HG22      THR  53  -4.090   5.450  -2.037
  406   3HG2  THR  53          HG23      THR  53  -4.830   5.044  -3.585
  407    H    VAL  54           HN       VAL  54  -4.831   3.298  -2.395
  408    HA   VAL  54           HA       VAL  54  -5.039   0.884  -3.950
  409    HB   VAL  54           HB       VAL  54  -3.764  -0.163  -2.194
  410   1HG1  VAL  54          HG11      VAL  54  -3.713   1.263  -0.388
  411   2HG1  VAL  54          HG12      VAL  54  -4.819   0.031   0.218
  412   3HG1  VAL  54          HG13      VAL  54  -5.451   1.547  -0.423
  413   1HG2  VAL  54          HG21      VAL  54  -6.170  -1.138  -2.840
  414   2HG2  VAL  54          HG22      VAL  54  -6.480  -0.821  -1.133
  415   3HG2  VAL  54          HG23      VAL  54  -5.166  -1.902  -1.603
  416    H    THR  55           HN       THR  55  -6.849   2.220  -4.649
  417    HA   THR  55           HA       THR  55  -9.039   2.711  -2.705
  418    HB   THR  55           HB       THR  55  -8.892   3.328  -5.668
  419    HG1  THR  55           HG1      THR  55  -7.554   4.877  -5.224
  420   1HG2  THR  55          HG21      THR  55 -10.353   5.245  -4.916
  421   2HG2  THR  55          HG22      THR  55 -10.421   4.486  -3.326
  422   3HG2  THR  55          HG23      THR  55 -11.089   3.653  -4.730
  423    H    GLU  56           HN       GLU  56 -10.936   1.523  -2.708
  424    HA   GLU  56           HA       GLU  56 -11.035  -1.027  -4.093
  425   1HB   GLU  56          HB2       GLU  56 -12.058  -0.103  -1.819
  426   2HB   GLU  56          HB1       GLU  56 -13.429   0.292  -2.857
  427   1HG   GLU  56          HG2       GLU  56 -12.148  -2.451  -2.703
  428   2HG   GLU  56          HG1       GLU  56 -13.600  -1.984  -1.817