*HEADER    TOXIN                                   05-DEC-19   6V6T              
*TITLE     SOLUTION STRUCTURE OF DELTA-THERAPHOTOXIN-HM1B FROM HETEROSCODRA      
*TITLE    2 MACULATA                                                             
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: DELTA-THERAPHOTOXIN-HM1B;                                  
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: DELTA-TRTX-HM1B;                                            
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HETEROSCODRA MACULATA;                          
*SOURCE   3 ORGANISM_COMMON: TOGO STARBURST TARANTULA;                           
*SOURCE   4 ORGANISM_TAXID: 268413;                                              
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_TAXID: 562                                         
*KEYWDS    SPIDER TOXIN, INHIBITOR, CYSTINE KNOT, TOXIN                          
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    Y.K.Y.CHIN,C.Y.CHOW,G.F.KING                                          
*REVDAT   1   13-MAY-20 6V6T    0                                                
# Restraints file 1: hm1b-ssbond.upl
  3 CYSS SG     17 CYSS SG     2.10   10.0 
  3 CYSS SG     17 CYSS CB     3.10   5.0 
  3 CYSS CB     17 CYSS SG     3.10   5.0 
 10 CYSS SG     22 CYSS SG     2.10   10.0 
 10 CYSS SG     22 CYSS CB     3.10   5.0 
 10 CYSS CB     22 CYSS SG     3.10   5.0 
 16 CYSS SG     29 CYSS SG     2.10   10.0 
 16 CYSS SG     29 CYSS CB     3.10   5.0 
 16 CYSS CB     29 CYSS SG     3.10   5.0 
# Restraints file 2: hm1b-final.aco
   1 SER   PHI    -175.0    75.0 5.00E-01 type=2
   1 SER   PSI     -75.0   185.0 5.00E-01 type=2
   1 SER   PHI    -255.0   -25.0 5.00E-01 type=2 OR
   1 SER   PSI      25.0    55.0 5.00E-01 type=2
   1 SER   PHI    -135.0    75.0 5.00E-01 type=2 OR
   1 SER   PSI     105.0   185.0 5.00E-01 type=2
   2 GLU   PHI    -175.0    75.0 5.00E-01 type=2
   2 GLU   PSI     -75.0   185.0 5.00E-01 type=2
   2 GLU   PHI    -255.0   -25.0 5.00E-01 type=2 OR
   2 GLU   PSI      25.0    55.0 5.00E-01 type=2
   2 GLU   PHI    -135.0    75.0 5.00E-01 type=2 OR
   2 GLU   PSI     105.0   185.0 5.00E-01 type=2
   3 CYSS  PHI    -175.0    75.0 5.00E-01 type=2
   3 CYSS  PSI     -75.0   185.0 5.00E-01 type=2
   3 CYSS  PHI    -255.0   -25.0 5.00E-01 type=2 OR
   3 CYSS  PSI      25.0    55.0 5.00E-01 type=2
   3 CYSS  PHI    -135.0    75.0 5.00E-01 type=2 OR
   3 CYSS  PSI     105.0   185.0 5.00E-01 type=2
   4 ARG   PHI    -175.0    75.0 5.00E-01 type=2
   4 ARG   PSI     -75.0   185.0 5.00E-01 type=2
   4 ARG   PHI    -255.0   -25.0 5.00E-01 type=2 OR
   4 ARG   PSI      25.0    55.0 5.00E-01 type=2
   4 ARG   PHI    -135.0    75.0 5.00E-01 type=2 OR
   4 ARG   PSI     105.0   185.0 5.00E-01 type=2
   5 TYR   PHI    -175.0    75.0 5.00E-01 type=2
   5 TYR   PSI     -75.0   185.0 5.00E-01 type=2
   5 TYR   PHI    -255.0   -25.0 5.00E-01 type=2 OR
   5 TYR   PSI      25.0    55.0 5.00E-01 type=2
   5 TYR   PHI    -135.0    75.0 5.00E-01 type=2 OR
   5 TYR   PSI     105.0   185.0 5.00E-01 type=2
   6 LEU   PHI    -175.0    75.0 5.00E-01 type=2
   6 LEU   PSI     -75.0   185.0 5.00E-01 type=2
   6 LEU   PHI    -255.0   -25.0 5.00E-01 type=2 OR
   6 LEU   PSI      25.0    55.0 5.00E-01 type=2
   6 LEU   PHI    -135.0    75.0 5.00E-01 type=2 OR
   6 LEU   PSI     105.0   185.0 5.00E-01 type=2
   7 PHE   PHI    -175.0    75.0 5.00E-01 type=2
   7 PHE   PSI     -75.0   185.0 5.00E-01 type=2
   7 PHE   PHI    -255.0   -25.0 5.00E-01 type=2 OR
   7 PHE   PSI      25.0    55.0 5.00E-01 type=2
   7 PHE   PHI    -135.0    75.0 5.00E-01 type=2 OR
   7 PHE   PSI     105.0   185.0 5.00E-01 type=2
  10 CYSS  PHI    -175.0    75.0 5.00E-01 type=2
  10 CYSS  PSI     -75.0   185.0 5.00E-01 type=2
  10 CYSS  PHI    -255.0   -25.0 5.00E-01 type=2 OR
  10 CYSS  PSI      25.0    55.0 5.00E-01 type=2
  10 CYSS  PHI    -135.0    75.0 5.00E-01 type=2 OR
  10 CYSS  PSI     105.0   185.0 5.00E-01 type=2
  11 LYS   PHI    -175.0    75.0 5.00E-01 type=2
  11 LYS   PSI     -75.0   185.0 5.00E-01 type=2
  11 LYS   PHI    -255.0   -25.0 5.00E-01 type=2 OR
  11 LYS   PSI      25.0    55.0 5.00E-01 type=2
  11 LYS   PHI    -135.0    75.0 5.00E-01 type=2 OR
  11 LYS   PSI     105.0   185.0 5.00E-01 type=2
  12 THR   PHI    -175.0    75.0 5.00E-01 type=2
  12 THR   PSI     -75.0   185.0 5.00E-01 type=2
  12 THR   PHI    -255.0   -25.0 5.00E-01 type=2 OR
  12 THR   PSI      25.0    55.0 5.00E-01 type=2
  12 THR   PHI    -135.0    75.0 5.00E-01 type=2 OR
  12 THR   PSI     105.0   185.0 5.00E-01 type=2
  13 THR   PHI    -175.0    75.0 5.00E-01 type=2
  13 THR   PSI     -75.0   185.0 5.00E-01 type=2
  13 THR   PHI    -255.0   -25.0 5.00E-01 type=2 OR
  13 THR   PSI      25.0    55.0 5.00E-01 type=2
  13 THR   PHI    -135.0    75.0 5.00E-01 type=2 OR
  13 THR   PSI     105.0   185.0 5.00E-01 type=2
  14 ALA   PHI    -175.0    75.0 5.00E-01 type=2
  14 ALA   PSI     -75.0   185.0 5.00E-01 type=2
  14 ALA   PHI    -255.0   -25.0 5.00E-01 type=2 OR
  14 ALA   PSI      25.0    55.0 5.00E-01 type=2
  14 ALA   PHI    -135.0    75.0 5.00E-01 type=2 OR
  14 ALA   PSI     105.0   185.0 5.00E-01 type=2
  15 ASP   PHI    -175.0    75.0 5.00E-01 type=2
  15 ASP   PSI     -75.0   185.0 5.00E-01 type=2
  15 ASP   PHI    -255.0   -25.0 5.00E-01 type=2 OR
  15 ASP   PSI      25.0    55.0 5.00E-01 type=2
  15 ASP   PHI    -135.0    75.0 5.00E-01 type=2 OR
  15 ASP   PSI     105.0   185.0 5.00E-01 type=2
  16 CYSS  PHI    -175.0    75.0 5.00E-01 type=2
  16 CYSS  PSI     -75.0   185.0 5.00E-01 type=2
  16 CYSS  PHI    -255.0   -25.0 5.00E-01 type=2 OR
  16 CYSS  PSI      25.0    55.0 5.00E-01 type=2
  16 CYSS  PHI    -135.0    75.0 5.00E-01 type=2 OR
  16 CYSS  PSI     105.0   185.0 5.00E-01 type=2
  17 CYSS  PHI    -175.0    75.0 5.00E-01 type=2
  17 CYSS  PSI     -75.0   185.0 5.00E-01 type=2
  17 CYSS  PHI    -255.0   -25.0 5.00E-01 type=2 OR
  17 CYSS  PSI      25.0    55.0 5.00E-01 type=2
  17 CYSS  PHI    -135.0    75.0 5.00E-01 type=2 OR
  17 CYSS  PSI     105.0   185.0 5.00E-01 type=2
  18 LYS   PHI    -175.0    75.0 5.00E-01 type=2
  18 LYS   PSI     -75.0   185.0 5.00E-01 type=2
  18 LYS   PHI    -255.0   -25.0 5.00E-01 type=2 OR
  18 LYS   PSI      25.0    55.0 5.00E-01 type=2
  18 LYS   PHI    -135.0    75.0 5.00E-01 type=2 OR
  18 LYS   PSI     105.0   185.0 5.00E-01 type=2
  19 HIS   PHI    -175.0    75.0 5.00E-01 type=2
  19 HIS   PSI     -75.0   185.0 5.00E-01 type=2
  19 HIS   PHI    -255.0   -25.0 5.00E-01 type=2 OR
  19 HIS   PSI      25.0    55.0 5.00E-01 type=2
  19 HIS   PHI    -135.0    75.0 5.00E-01 type=2 OR
  19 HIS   PSI     105.0   185.0 5.00E-01 type=2
  20 LEU   PHI    -175.0    75.0 5.00E-01 type=2
  20 LEU   PSI     -75.0   185.0 5.00E-01 type=2
  20 LEU   PHI    -255.0   -25.0 5.00E-01 type=2 OR
  20 LEU   PSI      25.0    55.0 5.00E-01 type=2
  20 LEU   PHI    -135.0    75.0 5.00E-01 type=2 OR
  20 LEU   PSI     105.0   185.0 5.00E-01 type=2
  22 CYSS  PHI    -175.0    75.0 5.00E-01 type=2
  22 CYSS  PSI     -75.0   185.0 5.00E-01 type=2
  22 CYSS  PHI    -255.0   -25.0 5.00E-01 type=2 OR
  22 CYSS  PSI      25.0    55.0 5.00E-01 type=2
  22 CYSS  PHI    -135.0    75.0 5.00E-01 type=2 OR
  22 CYSS  PSI     105.0   185.0 5.00E-01 type=2
  23 ARG   PHI    -175.0    75.0 5.00E-01 type=2
  23 ARG   PSI     -75.0   185.0 5.00E-01 type=2
  23 ARG   PHI    -255.0   -25.0 5.00E-01 type=2 OR
  23 ARG   PSI      25.0    55.0 5.00E-01 type=2
  23 ARG   PHI    -135.0    75.0 5.00E-01 type=2 OR
  23 ARG   PSI     105.0   185.0 5.00E-01 type=2
  24 THR   PHI    -175.0    75.0 5.00E-01 type=2
  24 THR   PSI     -75.0   185.0 5.00E-01 type=2
  24 THR   PHI    -255.0   -25.0 5.00E-01 type=2 OR
  24 THR   PSI      25.0    55.0 5.00E-01 type=2
  24 THR   PHI    -135.0    75.0 5.00E-01 type=2 OR
  24 THR   PSI     105.0   185.0 5.00E-01 type=2
  25 ASP   PHI    -175.0    75.0 5.00E-01 type=2
  25 ASP   PSI     -75.0   185.0 5.00E-01 type=2
  25 ASP   PHI    -255.0   -25.0 5.00E-01 type=2 OR
  25 ASP   PSI      25.0    55.0 5.00E-01 type=2
  25 ASP   PHI    -135.0    75.0 5.00E-01 type=2 OR
  25 ASP   PSI     105.0   185.0 5.00E-01 type=2
  26 LEU   PHI    -175.0    75.0 5.00E-01 type=2
  26 LEU   PSI     -75.0   185.0 5.00E-01 type=2
  26 LEU   PHI    -255.0   -25.0 5.00E-01 type=2 OR
  26 LEU   PSI      25.0    55.0 5.00E-01 type=2
  26 LEU   PHI    -135.0    75.0 5.00E-01 type=2 OR
  26 LEU   PSI     105.0   185.0 5.00E-01 type=2
  27 TYR   PHI    -175.0    75.0 5.00E-01 type=2
  27 TYR   PSI     -75.0   185.0 5.00E-01 type=2
  27 TYR   PHI    -255.0   -25.0 5.00E-01 type=2 OR
  27 TYR   PSI      25.0    55.0 5.00E-01 type=2
  27 TYR   PHI    -135.0    75.0 5.00E-01 type=2 OR
  27 TYR   PSI     105.0   185.0 5.00E-01 type=2
  28 TYR   PHI    -175.0    75.0 5.00E-01 type=2
  28 TYR   PSI     -75.0   185.0 5.00E-01 type=2
  28 TYR   PHI    -255.0   -25.0 5.00E-01 type=2 OR
  28 TYR   PSI      25.0    55.0 5.00E-01 type=2
  28 TYR   PHI    -135.0    75.0 5.00E-01 type=2 OR
  28 TYR   PSI     105.0   185.0 5.00E-01 type=2
  29 CYSS  PHI    -175.0    75.0 5.00E-01 type=2
  29 CYSS  PSI     -75.0   185.0 5.00E-01 type=2
  29 CYSS  PHI    -255.0   -25.0 5.00E-01 type=2 OR
  29 CYSS  PSI      25.0    55.0 5.00E-01 type=2
  29 CYSS  PHI    -135.0    75.0 5.00E-01 type=2 OR
  29 CYSS  PSI     105.0   185.0 5.00E-01 type=2
  30 ALA   PHI    -175.0    75.0 5.00E-01 type=2
  30 ALA   PSI     -75.0   185.0 5.00E-01 type=2
  30 ALA   PHI    -255.0   -25.0 5.00E-01 type=2 OR
  30 ALA   PSI      25.0    55.0 5.00E-01 type=2
  30 ALA   PHI    -135.0    75.0 5.00E-01 type=2 OR
  30 ALA   PSI     105.0   185.0 5.00E-01 type=2
  31 TRP   PHI    -175.0    75.0 5.00E-01 type=2
  31 TRP   PSI     -75.0   185.0 5.00E-01 type=2
  31 TRP   PHI    -255.0   -25.0 5.00E-01 type=2 OR
  31 TRP   PSI      25.0    55.0 5.00E-01 type=2
  31 TRP   PHI    -135.0    75.0 5.00E-01 type=2 OR
  31 TRP   PSI     105.0   185.0 5.00E-01 type=2
  32 ASP   PHI    -175.0    75.0 5.00E-01 type=2
  32 ASP   PSI     -75.0   185.0 5.00E-01 type=2
  32 ASP   PHI    -255.0   -25.0 5.00E-01 type=2 OR
  32 ASP   PSI      25.0    55.0 5.00E-01 type=2
  32 ASP   PHI    -135.0    75.0 5.00E-01 type=2 OR
  32 ASP   PSI     105.0   185.0 5.00E-01 type=2
  34 THR   PHI    -175.0    75.0 5.00E-01 type=2
  34 THR   PSI     -75.0   185.0 5.00E-01 type=2
  34 THR   PHI    -255.0   -25.0 5.00E-01 type=2 OR
  34 THR   PSI      25.0    55.0 5.00E-01 type=2
  34 THR   PHI    -135.0    75.0 5.00E-01 type=2 OR
  34 THR   PSI     105.0   185.0 5.00E-01 type=2
  35 PHE   PHI    -175.0    75.0 5.00E-01 type=2
  35 PHE   PSI     -75.0   185.0 5.00E-01 type=2
  35 PHE   PHI    -255.0   -25.0 5.00E-01 type=2 OR
  35 PHE   PSI      25.0    55.0 5.00E-01 type=2
  35 PHE   PHI    -135.0    75.0 5.00E-01 type=2 OR
  35 PHE   PSI     105.0   185.0 5.00E-01 type=2
   1 SER   CHI1    -90.0   210.0 2.00E-01 type=2
   1 SER   CHI1   -330.0   -30.0 2.00E-01 type=2
   1 SER   CHI1   -210.0    90.0 2.00E-01 type=2
   2 GLU   CHI1    -90.0   210.0 2.00E-01 type=2
   2 GLU   CHI1   -330.0   -30.0 2.00E-01 type=2
   2 GLU   CHI1   -210.0    90.0 2.00E-01 type=2
   2 GLU   CHI2    -90.0   210.0 2.00E-01 type=2
   2 GLU   CHI2   -330.0   -30.0 2.00E-01 type=2
   2 GLU   CHI2   -210.0    90.0 2.00E-01 type=2
   3 CYSS  CHI1    -90.0   210.0 2.00E-01 type=2
   3 CYSS  CHI1   -330.0   -30.0 2.00E-01 type=2
   3 CYSS  CHI1   -210.0    90.0 2.00E-01 type=2
   4 ARG   CHI1    -90.0   210.0 2.00E-01 type=2
   4 ARG   CHI1   -330.0   -30.0 2.00E-01 type=2
   4 ARG   CHI1   -210.0    90.0 2.00E-01 type=2
   4 ARG   CHI2    -90.0   210.0 2.00E-01 type=2
   4 ARG   CHI2   -330.0   -30.0 2.00E-01 type=2
   4 ARG   CHI2   -210.0    90.0 2.00E-01 type=2
   4 ARG   CHI3    -90.0   210.0 2.00E-01 type=2
   4 ARG   CHI3   -330.0   -30.0 2.00E-01 type=2
   4 ARG   CHI3   -210.0    90.0 2.00E-01 type=2
   5 TYR   CHI1    -90.0   210.0 2.00E-01 type=2
   5 TYR   CHI1   -330.0   -30.0 2.00E-01 type=2
   5 TYR   CHI1   -210.0    90.0 2.00E-01 type=2
   6 LEU   CHI1    -90.0   210.0 2.00E-01 type=2
   6 LEU   CHI1   -330.0   -30.0 2.00E-01 type=2
   6 LEU   CHI1   -210.0    90.0 2.00E-01 type=2
   6 LEU   CHI2    -90.0   210.0 2.00E-01 type=2
   6 LEU   CHI2   -330.0   -30.0 2.00E-01 type=2
   6 LEU   CHI2   -210.0    90.0 2.00E-01 type=2
   7 PHE   CHI1    -90.0   210.0 2.00E-01 type=2
   7 PHE   CHI1   -330.0   -30.0 2.00E-01 type=2
   7 PHE   CHI1   -210.0    90.0 2.00E-01 type=2
  10 CYSS  CHI1    -90.0   210.0 2.00E-01 type=2
  10 CYSS  CHI1   -330.0   -30.0 2.00E-01 type=2
  10 CYSS  CHI1   -210.0    90.0 2.00E-01 type=2
  11 LYS   CHI1    -90.0   210.0 2.00E-01 type=2
  11 LYS   CHI1   -330.0   -30.0 2.00E-01 type=2
  11 LYS   CHI1   -210.0    90.0 2.00E-01 type=2
  11 LYS   CHI2    -90.0   210.0 2.00E-01 type=2
  11 LYS   CHI2   -330.0   -30.0 2.00E-01 type=2
  11 LYS   CHI2   -210.0    90.0 2.00E-01 type=2
  11 LYS   CHI3    -90.0   210.0 2.00E-01 type=2
  11 LYS   CHI3   -330.0   -30.0 2.00E-01 type=2
  11 LYS   CHI3   -210.0    90.0 2.00E-01 type=2
  11 LYS   CHI4    -90.0   210.0 2.00E-01 type=2
  11 LYS   CHI4   -330.0   -30.0 2.00E-01 type=2
  11 LYS   CHI4   -210.0    90.0 2.00E-01 type=2
  12 THR   CHI1    -90.0   210.0 2.00E-01 type=2
  12 THR   CHI1   -330.0   -30.0 2.00E-01 type=2
  12 THR   CHI1   -210.0    90.0 2.00E-01 type=2
  13 THR   CHI1    -90.0   210.0 2.00E-01 type=2
  13 THR   CHI1   -330.0   -30.0 2.00E-01 type=2
  13 THR   CHI1   -210.0    90.0 2.00E-01 type=2
  15 ASP   CHI1    -90.0   210.0 2.00E-01 type=2
  15 ASP   CHI1   -330.0   -30.0 2.00E-01 type=2
  15 ASP   CHI1   -210.0    90.0 2.00E-01 type=2
  16 CYSS  CHI1    -90.0   210.0 2.00E-01 type=2
  16 CYSS  CHI1   -330.0   -30.0 2.00E-01 type=2
  16 CYSS  CHI1   -210.0    90.0 2.00E-01 type=2
  17 CYSS  CHI1    -90.0   210.0 2.00E-01 type=2
  17 CYSS  CHI1   -330.0   -30.0 2.00E-01 type=2
  17 CYSS  CHI1   -210.0    90.0 2.00E-01 type=2
  18 LYS   CHI1    -90.0   210.0 2.00E-01 type=2
  18 LYS   CHI1   -330.0   -30.0 2.00E-01 type=2
  18 LYS   CHI1   -210.0    90.0 2.00E-01 type=2
  18 LYS   CHI2    -90.0   210.0 2.00E-01 type=2
  18 LYS   CHI2   -330.0   -30.0 2.00E-01 type=2
  18 LYS   CHI2   -210.0    90.0 2.00E-01 type=2
  18 LYS   CHI3    -90.0   210.0 2.00E-01 type=2
  18 LYS   CHI3   -330.0   -30.0 2.00E-01 type=2
  18 LYS   CHI3   -210.0    90.0 2.00E-01 type=2
  18 LYS   CHI4    -90.0   210.0 2.00E-01 type=2
  18 LYS   CHI4   -330.0   -30.0 2.00E-01 type=2
  18 LYS   CHI4   -210.0    90.0 2.00E-01 type=2
  19 HIS   CHI1    -90.0   210.0 2.00E-01 type=2
  19 HIS   CHI1   -330.0   -30.0 2.00E-01 type=2
  19 HIS   CHI1   -210.0    90.0 2.00E-01 type=2
  20 LEU   CHI1    -90.0   210.0 2.00E-01 type=2
  20 LEU   CHI1   -330.0   -30.0 2.00E-01 type=2
  20 LEU   CHI1   -210.0    90.0 2.00E-01 type=2
  20 LEU   CHI2    -90.0   210.0 2.00E-01 type=2
  20 LEU   CHI2   -330.0   -30.0 2.00E-01 type=2
  20 LEU   CHI2   -210.0    90.0 2.00E-01 type=2
  22 CYSS  CHI1    -90.0   210.0 2.00E-01 type=2
  22 CYSS  CHI1   -330.0   -30.0 2.00E-01 type=2
  22 CYSS  CHI1   -210.0    90.0 2.00E-01 type=2
  23 ARG   CHI1    -90.0   210.0 2.00E-01 type=2
  23 ARG   CHI1   -330.0   -30.0 2.00E-01 type=2
  23 ARG   CHI1   -210.0    90.0 2.00E-01 type=2
  23 ARG   CHI2    -90.0   210.0 2.00E-01 type=2
  23 ARG   CHI2   -330.0   -30.0 2.00E-01 type=2
  23 ARG   CHI2   -210.0    90.0 2.00E-01 type=2
  23 ARG   CHI3    -90.0   210.0 2.00E-01 type=2
  23 ARG   CHI3   -330.0   -30.0 2.00E-01 type=2
  23 ARG   CHI3   -210.0    90.0 2.00E-01 type=2
  24 THR   CHI1    -90.0   210.0 2.00E-01 type=2
  24 THR   CHI1   -330.0   -30.0 2.00E-01 type=2
  24 THR   CHI1   -210.0    90.0 2.00E-01 type=2
  25 ASP   CHI1    -90.0   210.0 2.00E-01 type=2
  25 ASP   CHI1   -330.0   -30.0 2.00E-01 type=2
  25 ASP   CHI1   -210.0    90.0 2.00E-01 type=2
  26 LEU   CHI1    -90.0   210.0 2.00E-01 type=2
  26 LEU   CHI1   -330.0   -30.0 2.00E-01 type=2
  26 LEU   CHI1   -210.0    90.0 2.00E-01 type=2
  26 LEU   CHI2    -90.0   210.0 2.00E-01 type=2
  26 LEU   CHI2   -330.0   -30.0 2.00E-01 type=2
  26 LEU   CHI2   -210.0    90.0 2.00E-01 type=2
  27 TYR   CHI1    -90.0   210.0 2.00E-01 type=2
  27 TYR   CHI1   -330.0   -30.0 2.00E-01 type=2
  27 TYR   CHI1   -210.0    90.0 2.00E-01 type=2
  28 TYR   CHI1    -90.0   210.0 2.00E-01 type=2
  28 TYR   CHI1   -330.0   -30.0 2.00E-01 type=2
  28 TYR   CHI1   -210.0    90.0 2.00E-01 type=2
  29 CYSS  CHI1    -90.0   210.0 2.00E-01 type=2
  29 CYSS  CHI1   -330.0   -30.0 2.00E-01 type=2
  29 CYSS  CHI1   -210.0    90.0 2.00E-01 type=2
  31 TRP   CHI1    -90.0   210.0 2.00E-01 type=2
  31 TRP   CHI1   -330.0   -30.0 2.00E-01 type=2
  31 TRP   CHI1   -210.0    90.0 2.00E-01 type=2
  32 ASP   CHI1    -90.0   210.0 2.00E-01 type=2
  32 ASP   CHI1   -330.0   -30.0 2.00E-01 type=2
  32 ASP   CHI1   -210.0    90.0 2.00E-01 type=2
  34 THR   CHI1    -90.0   210.0 2.00E-01 type=2
  34 THR   CHI1   -330.0   -30.0 2.00E-01 type=2
  34 THR   CHI1   -210.0    90.0 2.00E-01 type=2
  35 PHE   CHI1    -90.0   210.0 2.00E-01 type=2
  35 PHE   CHI1   -330.0   -30.0 2.00E-01 type=2
  35 PHE   CHI1   -210.0    90.0 2.00E-01 type=2
# Restraints file 3: hm1b-final.upl
 16 CYSS HA     17 CYSS HB3     4.98            #peak 7 #SUP 0.93 #QF 0.93
 20 LEU  QD2    21 GLY  H       4.27            #peak 12 #SUP 0.99 #QF 0.99
 20 LEU  QD1    21 GLY  H       4.98            #peak 13 #SUP 0.97 #QF 0.97
 20 LEU  HB3    21 GLY  H       3.60            #peak 14 #SUP 0.98 #QF 0.98
 21 GLY  H      30 ALA  QB      3.93            #peak 15 #SUP 0.53 #QF 0.53
 11 LYS  H      11 LYS  HG2     4.22            #peak 16 #SUP 0.99 #QF 0.99
 11 LYS  H      11 LYS  QB      3.23            #peak 17 #SUP 0.99 #QF 0.99
 21 GLY  H      29 CYSS HB3     4.16            #peak 18 #SUP 0.41 #QF 0.41
 20 LEU  HB2    21 GLY  H       3.96            #peak 19 #SUP 0.99 #QF 0.99
 11 LYS  H      15 ASP  HB2     3.65            #peak 20 #SUP 0.98 #QF 0.92
 11 LYS  H      15 ASP  HB3     4.19            #peak 20 #SUP 0.98 #QF 0.92
 10 CYSS HB2    11 LYS  H       3.24            #peak 21 #SUP 0.91 #QF 0.91
  7 PHE  H      20 LEU  QD2     5.31            #peak 22 #SUP 1.00 #QF 0.99
 20 LEU  QD2    29 CYSS H       5.50            #peak 22 #SUP 1.00 #QF 0.99
 11 LYS  H      11 LYS  HG3     4.22            #peak 23 #SUP 0.98 #QF 0.98
 20 LEU  HA     21 GLY  H       2.98            #peak 28 #SUP 0.95 #QF 0.95
 10 CYSS HA     11 LYS  H       2.96            #peak 29 #SUP 0.45 #QF 0.45
 29 CYSS HA     30 ALA  H       2.87            #peak 31 #SUP 0.43 #QF 0.43
 29 CYSS HB2    30 ALA  H       4.47            #peak 32 #SUP 0.72 #QF 0.72
 29 CYSS HB3    30 ALA  H       3.93            #peak 33 #SUP 0.95 #QF 0.95
 30 ALA  H      30 ALA  QB      3.28            #peak 34 #SUP 0.99 #QF 0.99
 20 LEU  HB3    30 ALA  H       4.19            #peak 35 #SUP 0.97 #QF 0.97
 13 THR  H      22 CYSS HB2     4.41            #peak 36 #SUP 0.87 #QF 0.87
 13 THR  H      13 THR  QG2     3.76            #peak 37 #SUP 0.91 #QF 0.91
 12 THR  QG2    13 THR  H       3.84            #peak 38 #SUP 0.99 #QF 0.99
 13 THR  H      22 CYSS HB3     3.73            #peak 39 #SUP 0.99 #QF 0.99
 12 THR  HA     13 THR  H       3.05            #peak 41 #SUP 0.87 #QF 0.87
 12 THR  HB     13 THR  H       2.91            #peak 42 #SUP 0.74 #QF 0.74
 13 THR  H      13 THR  HB      2.89            #peak 43 #SUP 0.85 #QF 0.85
 20 LEU  HB2    30 ALA  H       4.73            #peak 48 #SUP 0.99 #QF 0.99
 20 LEU  QD2    30 ALA  H       4.51            #peak 49 #SUP 1.00
 17 CYSS H      20 LEU  QD1     3.49            #peak 50 #SUP 0.96 #QF 0.96
  6 LEU  HG      7 PHE  H       3.98            #peak 51 #SUP 0.53 #QF 0.53
  6 LEU  QD1     7 PHE  H       3.60            #peak 52 #SUP 0.89 #QF 0.89
  4 ARG  HB2     8 GLY  H       4.28            #peak 53 #SUP 0.82 #QF 0.82
  8 GLY  H      29 CYSS HB2     3.79            #peak 54 #SUP 0.86 #QF 0.86
 17 CYSS H      17 CYSS HB2     3.74            #peak 55 #SUP 0.98 #QF 0.98
  3 CYSS HB2    17 CYSS H       3.95            #peak 56 #SUP 0.82 #QF 0.26
 16 CYSS HB3    17 CYSS H       3.91            #peak 56 #SUP 0.82 #QF 0.26
 17 CYSS H      17 CYSS HB3     3.25            #peak 58 #SUP 0.82 #QF 0.82
 17 CYSS H      20 LEU  HB2     3.82            #peak 59 #SUP 0.57 #QF 0.57
 16 CYSS HA     17 CYSS H       2.83            #peak 61 #SUP 0.83 #QF 0.83
  8 GLY  H      28 TYR  HB2     4.78            #peak 65 #SUP 0.60 #QF 0.60
  4 ARG  HB3     8 GLY  H       4.70            #peak 67 #SUP 0.97 #QF 0.97
 20 LEU  QD2    32 ASP  H       4.17            #peak 68 #SUP 0.97 #QF 0.97
 20 LEU  HG     32 ASP  H       5.00            #peak 70 #SUP 0.98 #QF 0.96
 30 ALA  QB     32 ASP  H       5.37            #peak 70 #SUP 0.98 #QF 0.96
  4 ARG  H       4 ARG  HG2     3.74            #peak 73 #SUP 0.96 #QF 0.96
  4 ARG  H       4 ARG  HB2     3.75            #peak 74 #SUP 0.67 #QF 0.67
 32 ASP  H      32 ASP  HB3     3.67            #peak 76 #SUP 0.87 #QF 0.87
 32 ASP  H      32 ASP  HB2     3.73            #peak 77 #SUP 0.94 #QF 0.94
 31 TRP  HB2    32 ASP  H       4.73            #peak 78 #SUP 0.93 #QF 0.93
  4 ARG  QD      9 GLY  H       4.75            #peak 79 #SUP 0.98 #QF 0.98
  8 GLY  HA3     9 GLY  H       3.31            #peak 80 #SUP 0.93 #QF 0.93
 31 TRP  HB3    32 ASP  H       4.45            #peak 81 #SUP 0.97 #QF 0.97
 28 TYR  HA     29 CYSS H       2.92            #peak 82 #SUP 0.93 #QF 0.93
  4 ARG  H      16 CYSS HA      3.21            #peak 83 #SUP 0.79 #QF 0.79
 20 LEU  HA     32 ASP  H       3.37            #peak 84 #SUP 0.83 #QF 0.83
 31 TRP  HA     32 ASP  H       2.94            #peak 85 #SUP 0.40 #QF 0.40
  3 CYSS HA      4 ARG  H       2.88            #peak 89 #SUP 0.81 #QF 0.81
  4 ARG  H       4 ARG  HG3     3.12            #peak 92 #SUP 0.56 #QF 0.56
 28 TYR  HB2    29 CYSS H       3.09            #peak 95 #SUP 0.41 #QF 0.41
 29 CYSS H      29 CYSS HB2     3.10            #peak 96 #SUP 0.86 #QF 0.86
  3 CYSS HB2     4 ARG  H       3.74            #peak 97 #SUP 0.92 #QF 0.92
  6 LEU  HA      7 PHE  H       2.89            #peak 98 #SUP 0.89 #QF 0.89
  8 GLY  HA2     9 GLY  H       3.51            #peak 100 #SUP 0.94 #QF 0.94
 19 HIS  H      19 HIS  HA      2.92            #peak 102 #SUP 0.99 #QF 0.99
 13 THR  HA     22 CYSS H       2.93            #peak 104 #SUP 0.95 #QF 0.95
 22 CYSS H      22 CYSS HB2     3.36            #peak 105 #SUP 0.85 #QF 0.85
 22 CYSS H      22 CYSS HB3     3.32            #peak 106 #SUP 0.98 #QF 0.98
 16 CYSS HB2    22 CYSS H       4.58            #peak 107 #SUP 0.21 #QF 0.21
 23 ARG  QB     25 ASP  H       3.60            #peak 110 #SUP 0.93 #QF 0.93
 23 ARG  HA     25 ASP  H       4.17            #peak 114 #SUP 0.81 #QF 0.81
  2 GLU  HA      3 CYSS H       3.03            #peak 116 #SUP 0.55 #QF 0.55
 21 GLY  HA2    22 CYSS H       3.24            #peak 117 #SUP 0.87 #QF 0.87
  4 ARG  HB2     5 TYR  H       4.05            #peak 119 #SUP 0.87 #QF 0.87
  4 ARG  HB3     5 TYR  H       4.09            #peak 120 #SUP 0.94 #QF 0.94
 16 CYSS H      20 LEU  HB2     5.39            #peak 121 #SUP 0.91 #QF 0.91
 20 LEU  H      20 LEU  HB2     3.53            #peak 122 #SUP 0.99 #QF 0.99
 20 LEU  H      20 LEU  HB3     3.94            #peak 124 #SUP 1.00
 20 LEU  H      20 LEU  HG      3.60            #peak 126 #SUP 0.89 #QF 0.89
 20 LEU  HG     31 TRP  HE3     3.78            #peak 128 #SUP 0.89 #QF 0.89
 14 ALA  QB     15 ASP  H       3.19            #peak 129 #SUP 0.94 #QF 0.94
 18 LYS  HB3    19 HIS  H       4.00            #peak 130 #SUP 0.80 #QF 0.80
 13 THR  QG2    22 CYSS H       3.50            #peak 131 #SUP 0.89 #QF 0.89
 18 LYS  HG2    19 HIS  H       4.38            #peak 132 #SUP 0.95 #QF 0.95
 18 LYS  HG3    19 HIS  H       4.38            #peak 133 #SUP 0.91 #QF 0.91
  2 GLU  HB3     3 CYSS H       4.61            #peak 134 #SUP 0.98 #QF 0.98
  2 GLU  HB2     3 CYSS H       4.61            #peak 135 #SUP 0.97 #QF 0.97
  3 CYSS H       3 CYSS HB2     3.77            #peak 137 #SUP 0.96 #QF 0.96
 25 ASP  H      25 ASP  HB2     3.83            #peak 140 #SUP 0.45 #QF 0.45
 25 ASP  H      26 LEU  HB2     4.94            #peak 142 #SUP 0.94 #QF 0.94
  5 TYR  H       5 TYR  HB3     3.63            #peak 143 #SUP 0.96 #QF 0.96
  5 TYR  H       5 TYR  HB2     3.63            #peak 144 #SUP 0.88 #QF 0.88
  4 ARG  HA      5 TYR  H       2.95            #peak 146 #SUP 0.75 #QF 0.75
 22 CYSS HB3    23 ARG  H       4.38            #peak 149 #SUP 0.85 #QF 0.85
 22 CYSS HA     23 ARG  H       2.98            #peak 150 #SUP 0.61 #QF 0.61
 14 ALA  HA     16 CYSS H       4.04            #peak 155 #SUP 0.74 #QF 0.74
 16 CYSS H      16 CYSS HB3     3.89            #peak 159 #SUP 0.97 #QF 0.97
 16 CYSS H      16 CYSS HB2     3.00            #peak 160 #SUP 0.75 #QF 0.75
 17 CYSS HB3    18 LYS  H       3.71            #peak 162 #SUP 0.86 #QF 0.86
 11 LYS  QB     12 THR  H       3.32            #peak 163 #SUP 0.97 #QF 0.97
 18 LYS  H      18 LYS  HB3     3.03            #peak 164 #SUP 0.94 #QF 0.94
 17 CYSS H      29 CYSS HB3     5.15            #peak 170 #SUP 0.98 #QF 0.98
 17 CYSS H      20 LEU  HB3     4.66            #peak 171 #SUP 0.99 #QF 0.99
  4 ARG  HB2     9 GLY  H       5.33            #peak 172 #SUP 0.71 #QF 0.71
  7 PHE  H       8 GLY  HA2     5.22            #peak 173 #SUP 0.46 #QF 0.46
 23 ARG  HA     23 ARG  HE      4.75            #peak 175 #SUP 0.95 #QF 0.95
 10 CYSS H      28 TYR  HA      3.41            #peak 176 #SUP 0.98 #QF 0.98
 18 LYS  HA     20 LEU  H       3.94            #peak 179 #SUP 0.52 #QF 0.52
 23 ARG  HA     24 THR  H       3.32            #peak 180 #SUP 0.95 #QF 0.77
 34 THR  HA     35 PHE  H       3.21            #peak 181 #SUP 0.55 #QF 0.55
 31 TRP  HB3    31 TRP  HD1     3.80            #peak 184 #SUP 0.97 #QF 0.97
 19 HIS  HB3    31 TRP  HD1     5.50            #peak 186 #SUP 0.52 #QF 0.52
 31 TRP  HA     31 TRP  HD1     4.08            #peak 187 #SUP 0.55 #QF 0.55
 20 LEU  H      20 LEU  QD2     4.60            #peak 188 #SUP 0.99 #QF 0.99
 20 LEU  QD2    31 TRP  HE3     3.97            #peak 189 #SUP 0.98 #QF 0.98
 20 LEU  QD2    31 TRP  HD1     4.90            #peak 190 #SUP 0.99 #QF 0.99
 34 THR  QG2    35 PHE  H       4.41            #peak 194 #SUP 0.90 #QF 0.90
 26 LEU  H      26 LEU  HB2     4.13            #peak 195 #SUP 0.99 #QF 0.99
 20 LEU  QD1    31 TRP  HE3     4.57            #peak 197 #SUP 0.89 #QF 0.89
  5 TYR  QD     20 LEU  QD2     5.07            #peak 198 #SUP 1.00 #QF 0.85
 20 LEU  QD2    31 TRP  HZ3     5.24            #peak 198 #SUP 1.00 #QF 0.85
  6 LEU  QD1    28 TYR  QD      4.49            #peak 199 #SUP 0.99 #QF 0.99
 20 LEU  QD1    31 TRP  HZ3     3.82            #peak 200 #SUP 0.63 #QF 0.63
  6 LEU  QD1     7 PHE  QE      4.13            #peak 201 #SUP 0.44 #QF 0.44
  6 LEU  HG      7 PHE  QE      3.57            #peak 202 #SUP 0.97 #QF 0.97
 17 CYSS H      20 LEU  HG      5.18            #peak 206 #SUP 1.00
  6 LEU  HG      8 GLY  H       5.35            #peak 207 #SUP 0.82 #QF 0.82
  4 ARG  HB3     9 GLY  H       5.50            #peak 209 #SUP 0.79 #QF 0.79
 23 ARG  HE     26 LEU  HB2     5.03            #peak 211 #SUP 0.98 #QF 0.98
  5 TYR  H       8 GLY  HA3     4.71            #peak 212 #SUP 0.92 #QF 0.92
  9 GLY  H      28 TYR  HA      4.74            #peak 213 #SUP 0.92 #QF 0.92
 19 HIS  H      20 LEU  HA      5.50            #peak 214 #SUP 0.97 #QF 0.87
 20 LEU  HA     22 CYSS H       5.50            #peak 214 #SUP 0.97 #QF 0.87
 21 GLY  HA3    30 ALA  H       4.94            #peak 219 #SUP 0.91 #QF 0.91
 16 CYSS HB3    30 ALA  H       5.44            #peak 220 #SUP 0.77 #QF 0.77
 20 LEU  HA     30 ALA  H       4.57            #peak 221 #SUP 0.89 #QF 0.89
 13 THR  H      15 ASP  HB2     5.42            #peak 222 #SUP 0.52 #QF 0.52
 18 LYS  QE     19 HIS  HE1     4.74            #peak 225 #SUP 0.35 #QF 0.35
 19 HIS  H      19 HIS  HB2     3.72            #peak 226 #SUP 0.95 #QF 0.95
 20 LEU  HA     31 TRP  HE3     5.50            #peak 228 #SUP 0.98 #QF 0.98
  9 GLY  HA2    10 CYSS H       2.93            #peak 229 #SUP 0.69 #QF 0.69
 31 TRP  HA     31 TRP  HE3     3.82            #peak 230 #SUP 0.65 #QF 0.65
 18 LYS  H      18 LYS  HG3     4.19            #peak 233 #SUP 0.98 #QF 0.98
 18 LYS  H      20 LEU  QD1     5.50            #peak 234 #SUP 0.84 #QF 0.84
  5 TYR  H      20 LEU  QD1     5.12            #peak 235 #SUP 0.79 #QF 0.79
 26 LEU  HB3    28 TYR  QD      3.32            #peak 236 #SUP 0.94 #QF 0.94
  6 LEU  HG     28 TYR  QD      4.04            #peak 237 #SUP 0.78 #QF 0.78
 23 ARG  QB     28 TYR  QD      3.40            #peak 238 #SUP 0.44 #QF 0.44
 26 LEU  HB2    28 TYR  QD      3.50            #peak 239 #SUP 0.97 #QF 0.97
 11 LYS  QB     27 TYR  QD      4.67            #peak 240 #SUP 0.98 #QF 0.98
 26 LEU  HB2    28 TYR  QE      3.54            #peak 243 #SUP 0.98 #QF 0.98
 23 ARG  HD3    28 TYR  QE      3.97            #peak 244 #SUP 0.90 #QF 0.90
 24 THR  HA     27 TYR  QE      4.13            #peak 245 #SUP 0.98 #QF 0.98
 11 LYS  QE     27 TYR  QE      4.91            #peak 246 #SUP 0.99 #QF 0.45
 27 TYR  HA     27 TYR  QE      4.41            #peak 247 #SUP 0.96 #QF 0.96
 11 LYS  HA     27 TYR  QE      3.86            #peak 249 #SUP 0.90 #QF 0.90
 24 THR  HB     27 TYR  QE      4.00            #peak 250 #SUP 0.36 #QF 0.36
 22 CYSS HA     28 TYR  H       4.43            #peak 251 #SUP 0.75 #QF 0.75
  7 PHE  HA     28 TYR  QD      3.22            #peak 252 #SUP 0.98 #QF 0.98
 27 TYR  HA     27 TYR  QD      3.24            #peak 253 #SUP 0.93 #QF 0.93
 24 THR  HA     27 TYR  QD      4.21            #peak 255 #SUP 0.96 #QF 0.96
  6 LEU  HA     28 TYR  QD      4.21            #peak 256 #SUP 0.67 #QF 0.67
  5 TYR  QD      6 LEU  HA      4.98            #peak 258 #SUP 0.97 #QF 0.97
 21 GLY  HA3    35 PHE  QE      4.20            #peak 260 #SUP 0.93 #QF 0.93
 19 HIS  HA     19 HIS  HD2     4.23            #peak 261 #SUP 0.97 #QF 0.97
 11 LYS  HA     27 TYR  QD      3.47            #peak 264 #SUP 0.82 #QF 0.82
  5 TYR  HA      5 TYR  QE      4.67            #peak 266 #SUP 0.97 #QF 0.97
 28 TYR  HA     28 TYR  QD      4.02            #peak 267 #SUP 0.96 #QF 0.96
  5 TYR  HA      6 LEU  H       3.52            #peak 269 #SUP 0.97 #QF 0.97
  6 LEU  H       6 LEU  HB3     3.27            #peak 271 #SUP 0.81 #QF 0.74
  6 LEU  HB3     7 PHE  QD      3.66            #peak 271 #SUP 0.81 #QF 0.74
  4 ARG  HB3     4 ARG  HE      4.35            #peak 275 #SUP 0.98 #QF 0.48
 18 LYS  HB2    19 HIS  HD2     4.67            #peak 277 #SUP 0.94 #QF 0.94
 30 ALA  QB     35 PHE  QE      4.46            #peak 278 #SUP 0.36 #QF 0.36
 18 LYS  HB3    19 HIS  HD2     5.04            #peak 281 #SUP 0.61 #QF 0.61
 19 HIS  HB3    31 TRP  HZ3     4.63            #peak 292 #SUP 0.92 #QF 0.92
 21 GLY  HA3    35 PHE  HZ      3.88            #peak 293 #SUP 0.81 #QF 0.81
 19 HIS  HB2    31 TRP  HZ3     4.28            #peak 294 #SUP 0.80 #QF 0.80
  5 TYR  HA      5 TYR  QD      3.20            #peak 296 #SUP 0.95 #QF 0.95
  4 ARG  HA      5 TYR  QD      4.85            #peak 301 #SUP 0.59 #QF 0.59
 35 PHE  HA     35 PHE  QD      3.94            #peak 302 #SUP 1.00
  7 PHE  HA     28 TYR  QE      4.63            #peak 303 #SUP 1.00
  6 LEU  H      31 TRP  HB2     3.91            #peak 306 #SUP 0.80 #QF 0.80
 28 TYR  H      28 TYR  HB3     4.04            #peak 309 #SUP 0.42 #QF 0.42
 27 TYR  HB3    28 TYR  H       4.54            #peak 310 #SUP 0.99 #QF 0.99
  7 PHE  HA      7 PHE  QD      3.11            #peak 312 #SUP 0.93 #QF 0.93
 27 TYR  HA     28 TYR  H       3.19            #peak 313 #SUP 0.94 #QF 0.94
 26 LEU  HB2    28 TYR  H       4.79            #peak 314 #SUP 0.99 #QF 0.99
 22 CYSS HB2    28 TYR  H       5.50            #peak 315 #SUP 0.95 #QF 0.81
 23 ARG  HD3    28 TYR  H       5.50            #peak 315 #SUP 0.95 #QF 0.81
 26 LEU  HB3    28 TYR  QE      3.35            #peak 318 #SUP 0.95 #QF 0.88
 26 LEU  HB3    28 TYR  H       4.44            #peak 319 #SUP 0.95 #QF 0.95
 23 ARG  QB     28 TYR  QE      3.24            #peak 320 #SUP 0.60 #QF 0.44
 28 TYR  QE     30 ALA  QB      3.61            #peak 320 #SUP 0.60 #QF 0.44
  6 LEU  H       6 LEU  HB2     3.30            #peak 321 #SUP 0.99 #QF 0.99
  6 LEU  H      20 LEU  QD2     4.34            #peak 322 #SUP 0.99 #QF 0.99
 18 LYS  QE     19 HIS  HD2     5.06            #peak 324 #SUP 0.87 #QF 0.87
 31 TRP  HD1    32 ASP  HB2     5.37            #peak 325 #SUP 0.95 #QF 0.95
 26 LEU  HA     28 TYR  QE      5.29            #peak 327 #SUP 0.97 #QF 0.97
 15 ASP  H      22 CYSS HB2     5.46            #peak 328 #SUP 0.96 #QF 0.82
 23 ARG  QB     23 ARG  HE      3.28            #peak 329 #SUP 0.53 #QF 0.53
 27 TYR  H      27 TYR  HA      2.89            #peak 334 #SUP 0.97 #QF 0.97
 27 TYR  H      27 TYR  HB2     4.13            #peak 335 #SUP 0.97 #QF 0.97
 13 THR  HA     15 ASP  H       4.11            #peak 336 #SUP 0.93 #QF 0.93
 31 TRP  HB3    31 TRP  HE3     4.02            #peak 338 #SUP 0.99 #QF 0.99
 19 HIS  HB3    31 TRP  HE3     4.55            #peak 339 #SUP 0.97 #QF 0.97
 16 CYSS HB2    20 LEU  H       4.96            #peak 345 #SUP 0.92 #QF 0.92
 11 LYS  QD     27 TYR  QE      5.02            #peak 349 #SUP 0.47 #QF 0.47
 11 LYS  QB     27 TYR  QE      5.07            #peak 350 #SUP 0.99 #QF 0.99
  7 PHE  H       7 PHE  QD      3.71            #peak 353 #SUP 0.72 #QF 0.72
 23 ARG  H      30 ALA  H       4.46            #peak 354 #SUP 0.74 #QF 0.74
 13 THR  H      14 ALA  H       3.36            #peak 355 #SUP 0.79 #QF 0.79
 17 CYSS H      18 LYS  H       4.53            #peak 359 #SUP 0.99 #QF 0.99
 17 CYSS HB2    18 LYS  H       2.90            #peak 371 #SUP 0.92 #QF 0.92
 10 CYSS HB2    12 THR  H       3.45            #peak 372 #SUP 0.82 #QF 0.82
 12 THR  H      15 ASP  HB2     3.64            #peak 373 #SUP 0.65 #QF 0.65
 10 CYSS H      27 TYR  HB3     4.84            #peak 374 #SUP 0.80 #QF 0.80
 10 CYSS H      28 TYR  HB3     4.61            #peak 375 #SUP 0.48 #QF 0.48
 15 ASP  H      15 ASP  HB2     2.91            #peak 376 #SUP 0.83 #QF 0.83
 24 THR  HA     27 TYR  H       3.95            #peak 379 #SUP 0.88 #QF 0.88
 10 CYSS HB2    15 ASP  H       4.40            #peak 380 #SUP 0.94 #QF 0.94
 10 CYSS H      10 CYSS HB3     3.77            #peak 381 #SUP 0.93 #QF 0.55
 18 LYS  H      18 LYS  HG2     4.19            #peak 383 #SUP 0.99 #QF 0.99
 18 LYS  H      18 LYS  HB2     3.72            #peak 385 #SUP 1.00
 18 LYS  H      18 LYS  QD      3.56            #peak 386 #SUP 0.95 #QF 0.95
 12 THR  H      12 THR  QG2     3.61            #peak 387 #SUP 0.90 #QF 0.90
  6 LEU  QD1     7 PHE  QD      4.82            #peak 389 #SUP 1.00
  6 LEU  HG      7 PHE  QD      3.30            #peak 390 #SUP 0.52 #QF 0.52
 23 ARG  H      23 ARG  HG3     3.39            #peak 393 #SUP 0.81 #QF 0.81
 23 ARG  H      23 ARG  QB      3.17            #peak 394 #SUP 0.97 #QF 0.96
 19 HIS  HB2    19 HIS  HD2     3.83            #peak 398 #SUP 0.83 #QF 0.83
  7 PHE  HA      7 PHE  QE      4.70            #peak 399 #SUP 0.85 #QF 0.85
 31 TRP  HB2    31 TRP  HE3     3.90            #peak 402 #SUP 0.92 #QF 0.92
 14 ALA  H      15 ASP  HB2     4.90            #peak 404 #SUP 0.73 #QF 0.73
 23 ARG  HD3    28 TYR  QD      4.67            #peak 413 #SUP 0.85 #QF 0.85
  6 LEU  QD1    28 TYR  QE      5.12            #peak 414 #SUP 0.89 #QF 0.35
 28 TYR  HA     29 CYSS HB2     5.50            #peak 416 #SUP 0.93 #QF 0.39
 10 CYSS HB3    28 TYR  HA      4.69            #peak 417 #SUP 0.92 #QF 0.92
  7 PHE  HA     28 TYR  HA      4.19            #peak 418 #SUP 0.58 #QF 0.58
  9 GLY  HA2    28 TYR  HA      3.71            #peak 419 #SUP 0.76 #QF 0.76
  6 LEU  QD1     7 PHE  HA      5.47            #peak 429 #SUP 0.47 #QF 0.47
  6 LEU  QD1    31 TRP  HB3     4.97            #peak 443 #SUP 0.46 #QF 0.46
  6 LEU  HB2    31 TRP  HB3     4.46            #peak 444 #SUP 0.57 #QF 0.57
  4 ARG  HB2     8 GLY  HA3     3.68            #peak 445 #SUP 0.85 #QF 0.85
  4 ARG  HB3     8 GLY  HA3     4.01            #peak 446 #SUP 0.88 #QF 0.88
 16 CYSS HB3    20 LEU  QD2     4.78            #peak 453 #SUP 0.58 #QF 0.58
 20 LEU  QD1    31 TRP  HB2     4.64            #peak 455 #SUP 0.42 #QF 0.42
 23 ARG  QB     24 THR  HA      4.68            #peak 458 #SUP 0.85 #QF 0.85
 16 CYSS HB2    20 LEU  QD1     4.36            #peak 460 #SUP 0.62 #QF 0.62
 20 LEU  QD1    29 CYSS HB2     4.28            #peak 461 #SUP 0.91 #QF 0.91
 20 LEU  HB3    29 CYSS HB2     4.12            #peak 462 #SUP 0.98 #QF 0.98
 16 CYSS HB2    20 LEU  HB3     4.02            #peak 464 #SUP 0.97 #QF 0.97
 18 LYS  HG2    18 LYS  QE      4.03            #peak 466 #SUP 0.36 #QF 0.36
 20 LEU  HG     29 CYSS HB3     4.74            #peak 477 #SUP 0.73 #QF 0.73
 20 LEU  HB2    29 CYSS HB3     4.08            #peak 479 #SUP 0.54 #QF 0.54
 16 CYSS HB2    20 LEU  HB2     3.62            #peak 480 #SUP 0.97 #QF 0.97
 23 ARG  QB     27 TYR  H       3.75            #peak 482 #SUP 0.40 #QF 0.40
 26 LEU  HB3    27 TYR  H       3.78            #peak 483 #SUP 0.92 #QF 0.92
 26 LEU  HB2    27 TYR  H       4.33            #peak 484 #SUP 0.97 #QF 0.97
 18 LYS  HB2    19 HIS  H       4.53            #peak 487 #SUP 0.49 #QF 0.49
 17 CYSS HA     18 LYS  H       2.88            #peak 496 #SUP 0.85 #QF 0.85
 31 TRP  HA     33 GLY  H       4.22            #peak 497 #SUP 0.36 #QF 0.36
  7 PHE  HA     28 TYR  HB2     3.58            #peak 500 #SUP 0.55 #QF 0.55
 13 THR  HA     22 CYSS HB2     3.05            #peak 501 #SUP 0.83 #QF 0.83
 13 THR  HA     22 CYSS HB3     3.31            #peak 502 #SUP 0.98 #QF 0.98
 17 CYSS HB2    18 LYS  HB3     4.96            #peak 510 #SUP 0.82 #QF 0.82
 16 CYSS HB3    29 CYSS HB3     4.06            #peak 515 #SUP 0.48 #QF 0.48
 16 CYSS HB3    20 LEU  HB2     3.27            #peak 517 #SUP 0.55 #QF 0.55
 13 THR  QG2    16 CYSS HB2     4.59            #peak 522 #SUP 0.72 #QF 0.72
 26 LEU  HB3    28 TYR  HB3     4.58            #peak 524 #SUP 0.97 #QF 0.78
  2 GLU  HG2     3 CYSS H       5.50            #peak 528 #SUP 0.81 #QF 0.34
  2 GLU  HG3     3 CYSS H       5.50            #peak 528 #SUP 0.81 #QF 0.34
 20 LEU  HB3    20 LEU  QD1     3.83            #peak 531 #SUP 0.97 #QF 0.97
  6 LEU  HB3    20 LEU  QD2     5.26            #peak 532 #SUP 1.00
 11 LYS  QB     12 THR  QG2     4.15            #peak 541 #SUP 0.65 #QF 0.65
 16 CYSS HB3    20 LEU  HB3     3.56            #peak 543 #SUP 0.55 #QF 0.55
 13 THR  QG2    16 CYSS HB3     5.35            #peak 544 #SUP 0.51 #QF 0.51
 10 CYSS HB2    11 LYS  QB      4.76            #peak 546 #SUP 0.36 #QF 0.36
 10 CYSS HB2    22 CYSS HB3     4.84            #peak 548 #SUP 0.42 #QF 0.42
 20 LEU  HB2    29 CYSS HB2     4.72            #peak 549 #SUP 0.76 #QF 0.76
 19 HIS  HB2    31 TRP  HE3     4.60            #peak 551 #SUP 0.83 #QF 0.83
 31 TRP  HB2    31 TRP  HZ3     5.01            #peak 552 #SUP 0.62 #QF 0.62
 29 CYSS HA     31 TRP  H       5.50            #peak 557 #SUP 0.45 #QF 0.45
 31 TRP  HD1    32 ASP  H       3.94            #peak 560 #SUP 0.97 #QF 0.97
  7 PHE  H      28 TYR  QD      3.31            #peak 561 #SUP 0.97 #QF 0.97
  8 GLY  H      28 TYR  QD      4.64            #peak 562 #SUP 0.94 #QF 0.94
  7 PHE  H      28 TYR  QE      4.03            #peak 563 #SUP 0.98 #QF 0.98
  7 PHE  QD      8 GLY  H       4.96            #peak 566 #SUP 0.90 #QF 0.90
 21 GLY  H      35 PHE  QE      4.49            #peak 568 #SUP 1.00
 21 GLY  H      35 PHE  HZ      4.94            #peak 569 #SUP 0.45 #QF 0.45
 11 LYS  H      15 ASP  H       4.72            #peak 571 #SUP 0.83 #QF 0.83
 34 THR  H      35 PHE  H       4.56            #peak 572 #SUP 0.95 #QF 0.95
 10 CYSS H      28 TYR  H       4.94            #peak 574 #SUP 0.69 #QF 0.69
  6 LEU  QD2     7 PHE  H       4.46            #peak 611 #SUP 0.97 #QF 0.97
 20 LEU  QD2    31 TRP  H       4.23            #peak 614 #SUP 0.91 #QF 0.69
  6 LEU  QD2     7 PHE  QD      4.11            #peak 618 #SUP 0.75 #QF 0.75
  6 LEU  H       6 LEU  QD1     3.74            #peak 619 #SUP 0.99 #QF 0.99
  6 LEU  QD1    31 TRP  HD1     4.93            #peak 620 #SUP 0.98 #QF 0.98
  6 LEU  QD2     7 PHE  QE      4.71            #peak 622 #SUP 1.00 #QF 0.97
  6 LEU  QD1    31 TRP  H       4.04            #peak 624 #SUP 0.96 #QF 0.96
 20 LEU  H      20 LEU  QD1     3.98            #peak 629 #SUP 0.98 #QF 0.98
  6 LEU  HB3     7 PHE  H       5.09            #peak 634 #SUP 0.99 #QF 0.99
 24 THR  QG2    25 ASP  H       4.18            #peak 642 #SUP 0.97 #QF 0.97
 24 THR  H      24 THR  QG2     3.33            #peak 643 #SUP 0.81 #QF 0.81
 24 THR  QG2    26 LEU  H       5.50            #peak 644 #SUP 0.81 #QF 0.51
 24 THR  QG2    27 TYR  H       5.50            #peak 644 #SUP 0.81 #QF 0.51
 24 THR  QG2    27 TYR  QD      4.60            #peak 645 #SUP 0.96 #QF 0.96
 24 THR  QG2    27 TYR  QE      4.03            #peak 646 #SUP 0.98 #QF 0.98
 23 ARG  HG2    24 THR  H       4.19            #peak 654 #SUP 0.78 #QF 0.70
 23 ARG  QB     24 THR  H       3.47            #peak 655 #SUP 0.47 #QF 0.47
 30 ALA  QB     31 TRP  H       3.51            #peak 656 #SUP 0.81 #QF 0.81
 14 ALA  H      14 ALA  QB      2.87            #peak 658 #SUP 0.97 #QF 0.97
 12 THR  QG2    15 ASP  H       5.18            #peak 659 #SUP 0.75 #QF 0.44
 23 ARG  HG2    26 LEU  H       5.50            #peak 659 #SUP 0.75 #QF 0.44
 13 THR  QG2    14 ALA  H       4.19            #peak 660 #SUP 0.84 #QF 0.32
  4 ARG  HG2     5 TYR  H       4.88            #peak 667 #SUP 0.96 #QF 0.96
 18 LYS  QD     19 HIS  H       5.03            #peak 669 #SUP 0.96 #QF 0.96
 22 CYSS HB2    23 ARG  H       4.92            #peak 681 #SUP 0.98 #QF 0.93
 23 ARG  H      23 ARG  HD3     5.32            #peak 681 #SUP 0.98 #QF 0.93
  7 PHE  QD     28 TYR  HB3     4.05            #peak 687 #SUP 0.64 #QF 0.64
  7 PHE  QD     28 TYR  HB2     4.10            #peak 688 #SUP 0.75 #QF 0.75
 25 ASP  H      25 ASP  HB3     3.83            #peak 692 #SUP 0.73 #QF 0.73
  7 PHE  H      28 TYR  HB2     3.85            #peak 694 #SUP 1.00 #QF 0.94
 16 CYSS HB2    17 CYSS H       4.23            #peak 696 #SUP 0.97 #QF 0.97
  6 LEU  HA     20 LEU  QD2     3.66            #peak 711 #SUP 0.94 #QF 0.94
 20 LEU  QD2    31 TRP  HB2     4.30            #peak 712 #SUP 0.96 #QF 0.52
 20 LEU  QD2    29 CYSS HB2     4.32            #peak 713 #SUP 0.69 #QF 0.69
 20 LEU  QD2    29 CYSS HB3     4.02            #peak 714 #SUP 0.83 #QF 0.83
 20 LEU  HB2    20 LEU  QD2     3.94            #peak 715 #SUP 1.00
 20 LEU  HA     20 LEU  QD2     3.64            #peak 716 #SUP 0.99 #QF 0.99
 20 LEU  QD2    31 TRP  HA      3.51            #peak 717 #SUP 0.41 #QF 0.41
 20 LEU  QD2    30 ALA  HA      4.14            #peak 718 #SUP 0.93 #QF 0.93
  5 TYR  HA     20 LEU  QD2     4.75            #peak 719 #SUP 0.95 #QF 0.95
  6 LEU  QD1    29 CYSS HA      5.50            #peak 720 #SUP 0.77 #QF 0.77
  6 LEU  QD1    30 ALA  HA      3.41            #peak 721 #SUP 0.85 #QF 0.85
  6 LEU  QD2    30 ALA  HA      5.00            #peak 722 #SUP 0.87 #QF 0.87
  6 LEU  HA      6 LEU  QD2     4.16            #peak 723 #SUP 0.87 #QF 0.87
  6 LEU  HA      6 LEU  QD1     3.30            #peak 724 #SUP 0.96 #QF 0.96
  6 LEU  QD1    31 TRP  HB2     4.61            #peak 725 #SUP 1.00
  6 LEU  HA      6 LEU  HG      3.26            #peak 728 #SUP 0.93 #QF 0.93
 16 CYSS HB3    20 LEU  QD1     3.57            #peak 729 #SUP 0.74 #QF 0.74
 16 CYSS HA     20 LEU  QD1     4.35            #peak 731 #SUP 0.85 #QF 0.56
 20 LEU  QD1    29 CYSS HA      4.44            #peak 732 #SUP 0.69 #QF 0.69
  6 LEU  HG     30 ALA  HA      4.26            #peak 733 #SUP 0.68 #QF 0.68
  5 TYR  HA     20 LEU  QD1     3.41            #peak 734 #SUP 0.89 #QF 0.89
  4 ARG  HG2    16 CYSS HA      5.50            #peak 736 #SUP 0.91 #QF 0.91
  4 ARG  HB2    16 CYSS HA      4.67            #peak 737 #SUP 0.83 #QF 0.83
 20 LEU  HA     20 LEU  HG      4.14            #peak 740 #SUP 0.99 #QF 0.99
 20 LEU  HB3    29 CYSS HA      4.44            #peak 741 #SUP 0.93 #QF 0.93
 23 ARG  HA     24 THR  QG2     4.01            #peak 747 #SUP 0.73 #QF 0.73
 34 THR  HA     34 THR  QG2     3.34            #peak 749 #SUP 0.86 #QF 0.44
 23 ARG  HA     23 ARG  HG2     3.76            #peak 751 #SUP 0.92 #QF 0.32
 13 THR  HA     13 THR  QG2     2.98            #peak 753 #SUP 0.93 #QF 0.93
 13 THR  HA     14 ALA  QB      5.10            #peak 754 #SUP 0.96 #QF 0.96
 18 LYS  HA     18 LYS  QD      4.45            #peak 755 #SUP 0.94 #QF 0.94
  4 ARG  HG2     8 GLY  HA2     5.50            #peak 759 #SUP 0.76 #QF 0.76
  4 ARG  HA      4 ARG  HG2     4.02            #peak 760 #SUP 0.86 #QF 0.86
  4 ARG  HB3     8 GLY  HA2     4.65            #peak 763 #SUP 0.61 #QF 0.61
  4 ARG  HG2     8 GLY  HA3     4.44            #peak 764 #SUP 0.98 #QF 0.98
 20 LEU  HB2    29 CYSS HA      4.89            #peak 771 #SUP 0.96 #QF 0.96
 29 CYSS HA     30 ALA  QB      4.04            #peak 776 #SUP 0.65 #QF 0.65
 13 THR  QG2    21 GLY  HA2     3.19            #peak 778 #SUP 0.38 #QF 0.38
 20 LEU  HA     29 CYSS HB3     4.60            #peak 783 #SUP 0.48 #QF 0.48
 20 LEU  HA     32 ASP  HB3     5.06            #peak 784 #SUP 0.52 #QF 0.52
 16 CYSS HA     29 CYSS HB3     5.39            #peak 785 #SUP 0.72 #QF 0.22
 27 TYR  HB3    28 TYR  HA      4.77            #peak 791 #SUP 0.97 #QF 0.97
  6 LEU  QD1    30 ALA  QB      4.37            #peak 816 #SUP 0.97 #QF 0.97
 27 TYR  HB2    28 TYR  H       4.64            #peak 821 #SUP 0.87 #QF 0.87
 23 ARG  HG2    23 ARG  HE      3.57            #peak 822 #SUP 0.99 #QF 0.99
  4 ARG  HB2     4 ARG  QD      3.98            #peak 823 #SUP 0.93 #QF 0.93
  6 LEU  HB2    31 TRP  HB2     3.64            #peak 826 #SUP 0.91 #QF 0.91
 24 THR  HA     24 THR  QG2     3.23            #peak 827 #SUP 0.95 #QF 0.95
 18 LYS  HG3    18 LYS  QE      4.03            #peak 828 #SUP 0.54 #QF 0.54
 20 LEU  HB3    29 CYSS HB3     3.59            #peak 830 #SUP 0.93 #QF 0.93
 23 ARG  QB     23 ARG  HD3     3.44            #peak 834 #SUP 0.58 #QF 0.58
 23 ARG  QB     23 ARG  HD2     3.41            #peak 836 #SUP 0.50 #QF 0.50
 23 ARG  HG2    25 ASP  H       4.45            #peak 841 #SUP 0.42 #QF 0.42
  5 TYR  H       6 LEU  H       4.71            #peak 845 #SUP 1.00
 31 TRP  H      31 TRP  HD1     5.07            #peak 847 #SUP 0.50 #QF 0.50
 29 CYSS H      30 ALA  H       4.62            #peak 848 #SUP 0.94 #QF 0.94
 21 GLY  H      32 ASP  H       4.71            #peak 849 #SUP 0.98 #QF 0.98
 21 GLY  H      22 CYSS H       4.74            #peak 850 #SUP 0.85 #QF 0.85
 13 THR  H      22 CYSS H       5.12            #peak 851 #SUP 0.85 #QF 0.85
  8 GLY  H       9 GLY  H       4.44            #peak 852 #SUP 0.98 #QF 0.98
  7 PHE  H       8 GLY  H       3.65            #peak 853 #SUP 0.95 #QF 0.80
  8 GLY  H      29 CYSS H       3.86            #peak 853 #SUP 0.95 #QF 0.80
 13 THR  HA     16 CYSS H       3.90            #peak 859 #SUP 0.96 #QF 0.96
  4 ARG  HB2     8 GLY  HA2     4.44            #peak 863 #SUP 0.65 #QF 0.65
  5 TYR  QD      6 LEU  HB2     3.91            #peak 866 #SUP 0.34 #QF 0.34
 14 ALA  QB     16 CYSS H       4.58            #peak 868 #SUP 0.82 #QF 0.82
 11 LYS  H      11 LYS  QD      5.23            #peak 873 #SUP 1.00
 21 GLY  H      32 ASP  HB3     5.50            #peak 879 #SUP 0.68 #QF 0.68
  8 GLY  H      29 CYSS HB3     4.85            #peak 883 #SUP 0.81 #QF 0.81
 29 CYSS H      29 CYSS HB3     3.80            #peak 885 #SUP 0.88 #QF 0.88
 25 ASP  HB3    26 LEU  H       4.14            #peak 888 #SUP 0.47 #QF 0.47
 24 THR  HA     25 ASP  H       3.44            #peak 905 #SUP 0.97 #QF 0.97
  3 CYSS H       3 CYSS HB3     3.77            #peak 913 #SUP 0.75 #QF 0.75
  3 CYSS HB3     4 ARG  H       3.74            #peak 915 #SUP 0.38 #QF 0.38
  3 CYSS HB3    17 CYSS H       3.95            #peak 916 #SUP 0.53 #QF 0.53
 23 ARG  HE     26 LEU  H       4.25            #peak 917 #SUP 0.46 #QF 0.46
 23 ARG  HE     24 THR  H       4.44            #peak 918 #SUP 0.85 #QF 0.85
 22 CYSS H      35 PHE  QE      5.14            #peak 919 #SUP 0.67 #QF 0.67
  4 ARG  HE      9 GLY  H       5.50            #peak 920 #SUP 0.95 #QF 0.95
 31 TRP  HD1    32 ASP  HA      5.19            #peak 924 #SUP 0.70 #QF 0.70
 20 LEU  HB3    29 CYSS H       5.50            #peak 925 #SUP 0.93 #QF 0.93
 20 LEU  HB3    32 ASP  H       5.18            #peak 926 #SUP 0.97 #QF 0.97
  5 TYR  QD      6 LEU  QD1     5.36            #peak 928 #SUP 0.50 #QF 0.50
 25 ASP  H      26 LEU  H       3.13            #peak 929 #SUP 0.59 #QF 0.59
 24 THR  H      25 ASP  H       3.46            #peak 930 #SUP 0.90 #QF 0.90
 19 HIS  H      20 LEU  H       3.34            #peak 931 #SUP 0.98 #QF 0.98
 20 LEU  QD1    29 CYSS HB3     3.64            #peak 934 #SUP 0.67 #QF 0.67
 17 CYSS HB3    20 LEU  QD1     4.09            #peak 935 #SUP 0.84 #QF 0.84
 20 LEU  HB2    20 LEU  QD1     3.31            #peak 936 #SUP 0.99 #QF 0.99
  6 LEU  HB2     6 LEU  QD1     3.31            #peak 937 #SUP 0.91 #QF 0.91
  6 LEU  HB2     6 LEU  QD2     3.73            #peak 938 #SUP 0.93 #QF 0.93
  6 LEU  QD1    20 LEU  QD2     3.47            #peak 943 #SUP 0.81 #QF 0.81
 20 LEU  HB3    20 LEU  QD2     3.53            #peak 945 #SUP 0.89 #QF 0.89
 11 LYS  QB     11 LYS  QE      4.17            #peak 951 #SUP 1.00
  6 LEU  HA     29 CYSS HB3     4.42            #peak 954 #SUP 0.41 #QF 0.41
 10 CYSS HB2    15 ASP  HB2     3.04            #peak 957 #SUP 0.74 #QF 0.60
  3 CYSS H       4 ARG  H       4.93            #peak 962 #SUP 0.87 #QF 0.87
 21 GLY  H      30 ALA  H       3.45            #peak 964 #SUP 0.94 #QF 0.94
 32 ASP  H      35 PHE  QE      5.50            #peak 967 #SUP 0.62 #QF 0.62
 27 TYR  H      27 TYR  QD      3.82            #peak 969 #SUP 0.82 #QF 0.82
  5 TYR  QD      6 LEU  H       3.66            #peak 971 #SUP 0.99 #QF 0.99
  5 TYR  H       5 TYR  QD      3.65            #peak 976 #SUP 0.82 #QF 0.82
 27 TYR  H      28 TYR  H       3.45            #peak 977 #SUP 0.97 #QF 0.97
 23 ARG  H      28 TYR  H       3.72            #peak 978 #SUP 0.89 #QF 0.89
 15 ASP  H      16 CYSS H       3.08            #peak 981 #SUP 0.69 #QF 0.69
  4 ARG  H      16 CYSS H       5.50            #peak 982 #SUP 0.77 #QF 0.77
 16 CYSS H      17 CYSS H       4.49            #peak 983 #SUP 0.95 #QF 0.95
 21 GLY  H      23 ARG  H       5.50            #peak 986 #SUP 0.79 #QF 0.79
  4 ARG  H       5 TYR  H       5.03            #peak 987 #SUP 0.96 #QF 0.96
  5 TYR  H       8 GLY  H       5.50            #peak 988 #SUP 0.98 #QF 0.98
 19 HIS  H      19 HIS  HD2     4.13            #peak 994 #SUP 0.72 #QF 0.72
 27 TYR  H      27 TYR  QE      4.87            #peak 996 #SUP 0.99 #QF 0.99
 24 THR  H      27 TYR  QE      5.04            #peak 997 #SUP 0.63 #QF 0.63
 25 ASP  H      27 TYR  QE      4.78            #peak 998 #SUP 0.93 #QF 0.93
  7 PHE  QE     28 TYR  QE      3.71            #peak 1001 #SUP 0.76 #QF 0.64
 27 TYR  H      28 TYR  QE      5.16            #peak 1002 #SUP 0.93 #QF 0.93
 23 ARG  HE     28 TYR  QE      5.09            #peak 1004 #SUP 0.97 #QF 0.97
 25 ASP  HB2    26 LEU  H       4.14            #peak 1006 #SUP 0.44 #QF 0.44
 32 ASP  HB3    33 GLY  H       4.93            #peak 1007 #SUP 0.47 #QF 0.47
 23 ARG  HD3    26 LEU  H       5.50            #peak 1008 #SUP 0.97 #QF 0.75
 12 THR  H      22 CYSS HB2     5.05            #peak 1009 #SUP 0.84 #QF 0.84
  6 LEU  QD1    32 ASP  HB2     5.50            #peak 1010 #SUP 0.35 #QF 0.35
  6 LEU  QD1    29 CYSS HB3     5.33            #peak 1011 #SUP 0.66 #QF 0.66
 24 THR  HA     27 TYR  HA      4.10            #peak 1016 #SUP 0.73 #QF 0.73
  4 ARG  QD     16 CYSS HA      5.01            #peak 1019 #SUP 0.34 #QF 0.34
 20 LEU  HA     21 GLY  HA3     4.37            #peak 1021 #SUP 0.49 #QF 0.49
 27 TYR  HA     28 TYR  HA      4.90            #peak 1023 #SUP 0.89 #QF 0.89
  6 LEU  HB3    31 TRP  HB2     5.37            #peak 1029 #SUP 0.61 #QF 0.61
  4 ARG  H       4 ARG  QD      4.26            #peak 1032 #SUP 0.83 #QF 0.83
 20 LEU  H      32 ASP  H       5.14            #peak 1033 #SUP 0.96 #QF 0.96
 11 LYS  H      12 THR  H       2.80            #peak 1034 #SUP 0.96 #QF 0.96
 10 CYSS H      11 LYS  H       4.70            #peak 1035 #SUP 0.96 #QF 0.96
 20 LEU  H      21 GLY  H       4.49            #peak 1036 #SUP 0.89 #QF 0.89
 10 CYSS H      29 CYSS H       4.48            #peak 1037 #SUP 0.95 #QF 0.95
  9 GLY  H      10 CYSS H       4.11            #peak 1038 #SUP 0.39 #QF 0.39
  3 CYSS H      17 CYSS H       5.24            #peak 1042 #SUP 0.78 #QF 0.78
  7 PHE  QD      9 GLY  H       5.17            #peak 1048 #SUP 0.54 #QF 0.54
 19 HIS  H      20 LEU  HB2     5.50            #peak 1049 #SUP 0.97 #QF 0.92
 20 LEU  HB2    22 CYSS H       5.50            #peak 1049 #SUP 0.97 #QF 0.92
 10 CYSS HB2    22 CYSS HB2     3.75            #peak 1052 #SUP 0.82 #QF 0.82
 13 THR  HB     22 CYSS HB2     5.27            #peak 1057 #SUP 0.36 #QF 0.36
  1 SER  QB      2 GLU  H       4.12            #peak 88
  1 SER  QB      3 CYSS H       4.70            #peak 799
  3 CYSS H       3 CYSS QB      3.18            #peak 137
  3 CYSS HA      3 CYSS QB      2.64            #peak 1062
  3 CYSS QB      4 ARG  H       3.09            #peak 915
  3 CYSS QB     16 CYSS HA      4.17            #peak 790
  3 CYSS QB     17 CYSS H       3.30            #peak 56
  3 CYSS QB     17 CYSS HB2     4.92            #peak 956
  5 TYR  H       5 TYR  QB      3.14            #peak 144
  5 TYR  QB      6 LEU  H       3.39            #peak 308
  7 PHE  QB     28 TYR  QD      4.99            #peak 1047
  7 PHE  QB     28 TYR  QE      5.27            #peak 820
  7 PHE  QE     26 LEU  QQD     4.75            #peak 283
  7 PHE  HZ     26 LEU  QQD     5.23            #peak 283
 11 LYS  H      11 LYS  QG      3.67            #peak 23
 11 LYS  QG     12 THR  H       4.59            #peak 384
 11 LYS  QG     27 TYR  QD      4.60            #peak 274
 18 LYS  H      18 LYS  QG      3.42            #peak 383
 18 LYS  HA     18 LYS  QG      3.48            #peak 438
 18 LYS  QG     18 LYS  QE      3.49            #peak 828
 18 LYS  QG     19 HIS  H       3.72            #peak 132
 18 LYS  QG     19 HIS  HD2     3.68            #peak 280
 23 ARG  QB     25 ASP  QB      3.58            #peak 835
 23 ARG  HD3    26 LEU  QQD     3.81            #peak 832
 23 ARG  HE     26 LEU  QQD     4.17            #peak 109
 25 ASP  H      25 ASP  QB      3.26            #peak 140
 25 ASP  H      26 LEU  QQD     4.30            #peak 108
 25 ASP  QB     26 LEU  QQD     3.68            #peak 833
 26 LEU  H      26 LEU  QQD     3.55            #peak 127
 26 LEU  HA     26 LEU  QQD     3.54            #peak 742
 26 LEU  QQD    28 TYR  QE      3.63            #peak 318
 35 PHE  H      35 PHE  QB      3.56            #peak 182
# Restraints file 4: hm1b-ssbond.lol
  3 CYSS SG     17 CYSS SG      2.00   10.0 
  3 CYSS SG     17 CYSS CB      3.00   5.0 
  3 CYSS CB     17 CYSS SG      3.00   5.0 
 10 CYSS SG     22 CYSS SG      2.00   10.0 
 10 CYSS SG     22 CYSS CB      3.00   5.0 
 10 CYSS CB     22 CYSS SG      3.00   5.0 
 16 CYSS SG     29 CYSS SG      2.00   10.0 
 16 CYSS SG     29 CYSS CB      3.00   5.0 
 16 CYSS CB     29 CYSS SG      3.00   5.0
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   SER   1           H        SER   1   1.807   0.001   0.856
    2    HA   SER   1           HA       SER   1   1.675   0.759  -1.888
    3    HB2  SER   1           HB2      SER   1   4.150   0.122  -1.839
    4    HB3  SER   1           HB3      SER   1   3.644   1.390  -0.723
    5    HG   SER   1           HG       SER   1   4.371   0.175   0.812
    6    H    GLU   2           H        GLU   2   1.693  -0.450  -3.701
    7    HA   GLU   2           HA       GLU   2   1.620  -3.372  -3.353
    8    HB2  GLU   2           HB2      GLU   2   0.205  -1.506  -5.212
    9    HB3  GLU   2           HB3      GLU   2   0.517  -3.155  -5.735
   10    HG2  GLU   2           HG2      GLU   2  -0.739  -4.044  -3.906
   11    HG3  GLU   2           HG3      GLU   2  -0.915  -2.443  -3.189
   12    H    CYS   3           H        CYS   3   3.962  -1.507  -3.786
   13    HA   CYS   3           HA       CYS   3   5.054  -2.885  -6.149
   14    HB2  CYS   3           HB2      CYS   3   6.538  -0.774  -6.343
   15    HB3  CYS   3           HB3      CYS   3   4.874  -0.681  -6.910
   16    H    ARG   4           H        ARG   4   7.446  -3.049  -6.127
   17    HA   ARG   4           HA       ARG   4   8.324  -3.988  -3.551
   18    HB2  ARG   4           HB2      ARG   4  10.029  -3.790  -6.024
   19    HB3  ARG   4           HB3      ARG   4  10.182  -4.915  -4.681
   20    HG2  ARG   4           HG2      ARG   4   8.179  -6.070  -5.362
   21    HG3  ARG   4           HG3      ARG   4   7.899  -4.889  -6.643
   22    HD2  ARG   4           HD2      ARG   4   9.007  -6.317  -7.961
   23    HD3  ARG   4           HD3      ARG   4  10.457  -5.719  -7.156
   24    HE   ARG   4           HE       ARG   4  10.686  -7.767  -6.185
   25   HH11  ARG   4          HH11      ARG   4   7.373  -7.379  -7.180
   26   HH12  ARG   4          HH12      ARG   4   6.918  -8.994  -6.749
   27   HH21  ARG   4          HH21      ARG   4  10.100  -9.895  -5.613
   28   HH22  ARG   4          HH22      ARG   4   8.469 -10.424  -5.857
   29    H    TYR   5           H        TYR   5   9.539  -2.935  -2.117
   30    HA   TYR   5           HA       TYR   5  10.089  -0.204  -2.326
   31    HB2  TYR   5           HB2      TYR   5  10.706  -2.363  -0.425
   32    HB3  TYR   5           HB3      TYR   5  11.861  -1.035  -0.417
   33    HD1  TYR   5           HD1      TYR   5   8.941  -2.211   1.045
   34    HD2  TYR   5           HD2      TYR   5  10.658   1.378  -0.464
   35    HE1  TYR   5           HE1      TYR   5   7.408  -0.895   2.447
   36    HE2  TYR   5           HE2      TYR   5   9.130   2.704   0.934
   37    HH   TYR   5           HH       TYR   5   7.527   2.657   2.465
   38    H    LEU   6           H        LEU   6  12.372   0.704  -1.968
   39    HA   LEU   6           HA       LEU   6  13.862   0.577  -4.230
   40    HB2  LEU   6           HB2      LEU   6  14.081   2.081  -2.135
   41    HB3  LEU   6           HB3      LEU   6  15.246   0.875  -1.592
   42    HG   LEU   6           HG       LEU   6  16.270   1.381  -4.007
   43   HD11  LEU   6          HD11      LEU   6  14.421   3.583  -3.455
   44   HD12  LEU   6          HD12      LEU   6  15.155   3.066  -4.973
   45   HD13  LEU   6          HD13      LEU   6  16.062   4.089  -3.859
   46   HD21  LEU   6          HD21      LEU   6  16.807   3.318  -1.784
   47   HD22  LEU   6          HD22      LEU   6  17.940   2.579  -2.915
   48   HD23  LEU   6          HD23      LEU   6  17.224   1.612  -1.625
   49    H    PHE   7           H        PHE   7  15.423  -0.679  -5.106
   50    HA   PHE   7           HA       PHE   7  16.707  -2.514  -5.501
   51    HB2  PHE   7           HB2      PHE   7  17.062  -2.202  -2.528
   52    HB3  PHE   7           HB3      PHE   7  17.850  -3.504  -3.414
   53    HD1  PHE   7           HD1      PHE   7  17.926  -0.022  -2.540
   54    HD2  PHE   7           HD2      PHE   7  19.446  -2.923  -5.259
   55    HE1  PHE   7           HE1      PHE   7  19.759   1.506  -3.141
   56    HE2  PHE   7           HE2      PHE   7  21.281  -1.400  -5.864
   57    HZ   PHE   7           HZ       PHE   7  21.440   0.817  -4.804
   58    H    GLY   8           H        GLY   8  13.974  -2.968  -5.418
   59    HA2  GLY   8           HA2      GLY   8  13.461  -5.321  -3.806
   60    HA3  GLY   8           HA3      GLY   8  12.344  -4.558  -4.928
   61    H    GLY   9           H        GLY   9  15.244  -4.942  -6.489
   62    HA2  GLY   9           HA2      GLY   9  16.023  -6.419  -8.067
   63    HA3  GLY   9           HA3      GLY   9  15.216  -7.689  -7.158
   64    H    CYS  10           H        CYS  10  14.022  -4.859  -8.965
   65    HA   CYS  10           HA       CYS  10  11.935  -6.485 -10.141
   66    HB2  CYS  10           HB2      CYS  10  11.013  -4.441 -10.960
   67    HB3  CYS  10           HB3      CYS  10  11.581  -4.122  -9.324
   68    H    LYS  11           H        LYS  11  11.496  -5.837 -12.589
   69    HA   LYS  11           HA       LYS  11  14.022  -6.080 -14.078
   70    HB2  LYS  11           HB2      LYS  11  11.498  -7.665 -14.591
   71    HB3  LYS  11           HB3      LYS  11  12.952  -7.711 -15.580
   72    HG2  LYS  11           HG2      LYS  11  14.079  -8.369 -13.293
   73    HG3  LYS  11           HG3      LYS  11  12.437  -8.887 -12.902
   74    HD2  LYS  11           HD2      LYS  11  13.978  -9.748 -15.350
   75    HD3  LYS  11           HD3      LYS  11  13.834 -10.694 -13.867
   76    HE2  LYS  11           HE2      LYS  11  11.480  -9.761 -15.499
   77    HE3  LYS  11           HE3      LYS  11  12.243 -11.338 -15.694
   78    HZ1  LYS  11           HZ1      LYS  11  11.423 -10.572 -12.999
   79    HZ2  LYS  11           HZ2      LYS  11  11.403 -12.090 -13.746
   80    HZ3  LYS  11           HZ3      LYS  11  10.194 -10.960 -14.096
   81    H    THR  12           H        THR  12  10.616  -5.183 -14.107
   82    HA   THR  12           HA       THR  12  11.211  -3.276 -16.264
   83    HB   THR  12           HB       THR  12   8.763  -3.696 -17.003
   84    HG1  THR  12           HG1      THR  12   8.299  -5.122 -15.216
   85   HG21  THR  12          HG21      THR  12   9.598  -4.862 -18.752
   86   HG22  THR  12          HG22      THR  12  10.345  -6.080 -17.717
   87   HG23  THR  12          HG23      THR  12  11.145  -4.530 -17.974
   88    H    THR  13           H        THR  13   9.614  -1.501 -16.398
   89    HA   THR  13           HA       THR  13   9.284  -0.209 -13.952
   90    HB   THR  13           HB       THR  13   7.560   0.366 -16.357
   91    HG1  THR  13           HG1      THR  13   9.306   1.555 -17.172
   92   HG21  THR  13          HG21      THR  13   8.236   1.724 -13.864
   93   HG22  THR  13          HG22      THR  13   6.907   2.016 -14.986
   94   HG23  THR  13          HG23      THR  13   8.491   2.728 -15.291
   95    H    ALA  14           H        ALA  14   7.109  -2.307 -15.735
   96    HA   ALA  14           HA       ALA  14   4.739  -1.753 -14.332
   97    HB1  ALA  14           HB1      ALA  14   5.064  -3.093 -16.491
   98    HB2  ALA  14           HB2      ALA  14   5.396  -4.465 -15.432
   99    HB3  ALA  14           HB3      ALA  14   3.835  -3.647 -15.354
  100    H    ASP  15           H        ASP  15   7.537  -3.617 -13.494
  101    HA   ASP  15           HA       ASP  15   6.373  -5.258 -11.504
  102    HB2  ASP  15           HB2      ASP  15   9.222  -4.282 -11.793
  103    HB3  ASP  15           HB3      ASP  15   8.698  -5.568 -10.709
  104    H    CYS  16           H        CYS  16   7.469  -1.958 -11.536
  105    HA   CYS  16           HA       CYS  16   6.968  -1.770  -8.639
  106    HB2  CYS  16           HB2      CYS  16   8.466   0.287 -10.246
  107    HB3  CYS  16           HB3      CYS  16   8.498   0.016  -8.506
  108    H    CYS  17           H        CYS  17   6.258   0.553  -8.022
  109    HA   CYS  17           HA       CYS  17   3.889   1.139  -9.621
  110    HB2  CYS  17           HB2      CYS  17   3.225   2.533  -7.665
  111    HB3  CYS  17           HB3      CYS  17   3.511   0.845  -7.253
  112    H    LYS  18           H        LYS  18   3.266   3.558  -9.641
  113    HA   LYS  18           HA       LYS  18   4.962   4.937 -11.322
  114    HB2  LYS  18           HB2      LYS  18   3.625   6.961 -10.729
  115    HB3  LYS  18           HB3      LYS  18   2.649   5.561 -11.151
  116    HG2  LYS  18           HG2      LYS  18   2.539   5.132  -8.621
  117    HG3  LYS  18           HG3      LYS  18   3.095   6.800  -8.464
  118    HD2  LYS  18           HD2      LYS  18   1.138   7.274 -10.151
  119    HD3  LYS  18           HD3      LYS  18   0.515   5.745  -9.528
  120    HE2  LYS  18           HE2      LYS  18   0.334   6.575  -7.348
  121    HE3  LYS  18           HE3      LYS  18   1.403   7.937  -7.683
  122    HZ1  LYS  18           HZ1      LYS  18  -1.029   7.810  -9.267
  123    HZ2  LYS  18           HZ2      LYS  18  -0.264   9.143  -8.562
  124    HZ3  LYS  18           HZ3      LYS  18  -1.243   8.135  -7.620
  125    H    HIS  19           H        HIS  19   4.667   5.209  -7.801
  126    HA   HIS  19           HA       HIS  19   6.355   7.351  -7.345
  127    HB2  HIS  19           HB2      HIS  19   6.011   4.862  -5.661
  128    HB3  HIS  19           HB3      HIS  19   6.743   6.365  -5.105
  129    HD1  HIS  19           HD1      HIS  19   5.195   8.009  -4.074
  130    HD2  HIS  19           HD2      HIS  19   3.183   5.228  -6.414
  131    HE1  HIS  19           HE1      HIS  19   2.750   8.481  -3.725
  132    H    LEU  20           H        LEU  20   7.135   4.042  -8.147
  133    HA   LEU  20           HA       LEU  20   9.999   4.626  -7.849
  134    HB2  LEU  20           HB2      LEU  20   8.669   1.962  -8.303
  135    HB3  LEU  20           HB3      LEU  20  10.364   2.245  -7.912
  136    HG   LEU  20           HG       LEU  20   8.312   3.181  -5.973
  137   HD11  LEU  20          HD11      LEU  20   9.149   0.294  -6.202
  138   HD12  LEU  20          HD12      LEU  20   7.557   0.924  -6.624
  139   HD13  LEU  20          HD13      LEU  20   8.122   1.003  -4.955
  140   HD21  LEU  20          HD21      LEU  20  10.195   3.540  -4.852
  141   HD22  LEU  20          HD22      LEU  20  11.148   2.699  -6.075
  142   HD23  LEU  20          HD23      LEU  20  10.410   1.792  -4.754
  143    H    GLY  21           H        GLY  21  11.407   3.520  -9.546
  144    HA2  GLY  21           HA2      GLY  21  10.145   3.486 -12.195
  145    HA3  GLY  21           HA3      GLY  21  11.470   4.607 -11.918
  146    H    CYS  22           H        CYS  22  10.566   1.231 -12.169
  147    HA   CYS  22           HA       CYS  22  12.948  -0.040 -11.639
  148    HB2  CYS  22           HB2      CYS  22  10.669  -1.034 -12.315
  149    HB3  CYS  22           HB3      CYS  22  11.224  -0.841 -13.974
  150    H    ARG  23           H        ARG  23  14.921   0.281 -12.402
  151    HA   ARG  23           HA       ARG  23  15.334   1.638 -14.922
  152    HB2  ARG  23           HB2      ARG  23  17.076   0.802 -12.641
  153    HB3  ARG  23           HB3      ARG  23  17.820   1.156 -14.194
  154    HG2  ARG  23           HG2      ARG  23  16.547   3.371 -14.093
  155    HG3  ARG  23           HG3      ARG  23  16.291   2.992 -12.389
  156    HD2  ARG  23           HD2      ARG  23  18.227   4.222 -12.276
  157    HD3  ARG  23           HD3      ARG  23  18.876   2.588 -12.402
  158    HE   ARG  23           HE       ARG  23  18.761   3.364 -14.974
  159   HH11  ARG  23          HH11      ARG  23  20.056   4.878 -12.119
  160   HH12  ARG  23          HH12      ARG  23  21.299   5.729 -12.975
  161   HH21  ARG  23          HH21      ARG  23  20.393   4.479 -16.113
  162   HH22  ARG  23          HH22      ARG  23  21.489   5.502 -15.247
  163    H    THR  24           H        THR  24  16.357   0.808 -16.729
  164    HA   THR  24           HA       THR  24  16.071  -2.044 -17.099
  165    HB   THR  24           HB       THR  24  16.642  -1.626 -19.434
  166    HG1  THR  24           HG1      THR  24  18.189   0.051 -19.074
  167   HG21  THR  24          HG21      THR  24  14.568  -0.901 -19.850
  168   HG22  THR  24          HG22      THR  24  14.897   0.676 -19.131
  169   HG23  THR  24          HG23      THR  24  14.401  -0.673 -18.110
  170    H    ASP  25           H        ASP  25  18.611   0.195 -16.433
  171    HA   ASP  25           HA       ASP  25  20.683  -1.724 -17.187
  172    HB2  ASP  25           HB2      ASP  25  20.873   0.737 -17.743
  173    HB3  ASP  25           HB3      ASP  25  21.066   1.034 -16.017
  174    H    LEU  26           H        LEU  26  19.318  -0.139 -14.353
  175    HA   LEU  26           HA       LEU  26  21.173  -1.503 -12.577
  176    HB2  LEU  26           HB2      LEU  26  19.005   0.530 -12.196
  177    HB3  LEU  26           HB3      LEU  26  19.688  -0.334 -10.820
  178    HG   LEU  26           HG       LEU  26  20.733   1.826 -11.023
  179   HD11  LEU  26          HD11      LEU  26  22.670   0.951 -10.390
  180   HD12  LEU  26          HD12      LEU  26  23.028   0.421 -12.033
  181   HD13  LEU  26          HD13      LEU  26  22.091  -0.615 -10.957
  182   HD21  LEU  26          HD21      LEU  26  20.313   1.687 -13.655
  183   HD22  LEU  26          HD22      LEU  26  22.008   1.200 -13.620
  184   HD23  LEU  26          HD23      LEU  26  21.521   2.752 -12.936
  185    H    TYR  27           H        TYR  27  17.809  -1.650 -13.560
  186    HA   TYR  27           HA       TYR  27  16.193  -3.220 -13.256
  187    HB2  TYR  27           HB2      TYR  27  18.712  -4.723 -12.907
  188    HB3  TYR  27           HB3      TYR  27  17.278  -5.488 -12.232
  189    HD1  TYR  27           HD1      TYR  27  17.374  -3.356 -15.259
  190    HD2  TYR  27           HD2      TYR  27  17.055  -7.311 -13.723
  191    HE1  TYR  27           HE1      TYR  27  16.762  -4.170 -17.498
  192    HE2  TYR  27           HE2      TYR  27  16.443  -8.136 -15.957
  193    HH   TYR  27           HH       TYR  27  16.823  -7.363 -18.373
  194    H    TYR  28           H        TYR  28  16.077  -1.435 -11.362
  195    HA   TYR  28           HA       TYR  28  15.167  -2.912  -9.064
  196    HB2  TYR  28           HB2      TYR  28  16.640  -2.167  -7.453
  197    HB3  TYR  28           HB3      TYR  28  17.730  -2.348  -8.823
  198    HD1  TYR  28           HD1      TYR  28  17.680  -0.081 -10.383
  199    HD2  TYR  28           HD2      TYR  28  17.001  -0.284  -6.187
  200    HE1  TYR  28           HE1      TYR  28  18.347   2.276 -10.167
  201    HE2  TYR  28           HE2      TYR  28  17.665   2.073  -5.960
  202    HH   TYR  28           HH       TYR  28  17.966   4.160  -8.589
  203    H    CYS  29           H        CYS  29  13.684  -1.777  -7.831
  204    HA   CYS  29           HA       CYS  29  12.353   0.365  -9.120
  205    HB2  CYS  29           HB2      CYS  29  12.037  -0.656  -6.288
  206    HB3  CYS  29           HB3      CYS  29  10.902   0.390  -7.136
  207    H    ALA  30           H        ALA  30  12.997   2.405  -9.179
  208    HA   ALA  30           HA       ALA  30  14.692   3.446  -7.029
  209    HB1  ALA  30           HB1      ALA  30  15.607   3.764  -9.213
  210    HB2  ALA  30           HB2      ALA  30  14.106   4.484  -9.796
  211    HB3  ALA  30           HB3      ALA  30  15.090   5.338  -8.607
  212    H    TRP  31           H        TRP  31  13.430   4.132  -5.387
  213    HA   TRP  31           HA       TRP  31  10.871   5.295  -5.694
  214    HB2  TRP  31           HB2      TRP  31  11.651   4.189  -3.614
  215    HB3  TRP  31           HB3      TRP  31  12.766   5.526  -3.346
  216    HD1  TRP  31           HD1      TRP  31  11.540   8.005  -2.966
  217    HE1  TRP  31           HE1      TRP  31   9.350   8.536  -1.725
  218    HE3  TRP  31           HE3      TRP  31   9.429   3.350  -3.018
  219    HZ2  TRP  31           HZ2      TRP  31   7.033   7.164  -0.878
  220    HZ3  TRP  31           HZ3      TRP  31   7.223   3.043  -1.971
  221    HH2  TRP  31           HH2      TRP  31   6.052   4.912  -0.923
  222    H    ASP  32           H        ASP  32  10.528   7.168  -6.690
  223    HA   ASP  32           HA       ASP  32  11.976   9.527  -5.794
  224    HB2  ASP  32           HB2      ASP  32  13.186   8.571  -7.811
  225    HB3  ASP  32           HB3      ASP  32  11.743   8.949  -8.748
  226    H    GLY  33           H        GLY  33   9.621   8.424  -8.243
  227    HA2  GLY  33           HA2      GLY  33   7.333   8.993  -8.276
  228    HA3  GLY  33           HA3      GLY  33   7.659  10.278  -7.122
  229    H    THR  34           H        THR  34  10.002  11.112  -8.855
  230    HA   THR  34           HA       THR  34   8.485  12.354 -11.050
  231    HB   THR  34           HB       THR  34   9.973  14.405 -10.664
  232    HG1  THR  34           HG1      THR  34  10.477  14.533  -8.293
  233   HG21  THR  34          HG21      THR  34   7.456  13.762  -9.776
  234   HG22  THR  34          HG22      THR  34   8.185  15.366  -9.705
  235   HG23  THR  34          HG23      THR  34   8.256  14.302  -8.300
  236    H    PHE  35           H        PHE  35   9.358  11.839 -12.937
  237    HA   PHE  35           HA       PHE  35  12.282  11.519 -13.097
  238    HB2  PHE  35           HB2      PHE  35  10.152   9.885 -14.488
  239    HB3  PHE  35           HB3      PHE  35  11.869   9.798 -14.865
  240    HD1  PHE  35           HD1      PHE  35  13.203   9.753 -12.348
  241    HD2  PHE  35           HD2      PHE  35   9.500   7.957 -13.433
  242    HE1  PHE  35           HE1      PHE  35  13.507   8.068 -10.581
  243    HE2  PHE  35           HE2      PHE  35   9.797   6.270 -11.667
  244    HZ   PHE  35           HZ       PHE  35  11.802   6.324 -10.238
  Start of MODEL    2
    1    H1   SER   1           H        SER   1   2.017   1.823  -2.497
    2    HA   SER   1           HA       SER   1   2.819  -0.039  -0.538
    3    HB2  SER   1           HB2      SER   1   0.718   1.454  -0.589
    4    HB3  SER   1           HB3      SER   1  -0.002   0.181  -1.574
    5    HG   SER   1           HG       SER   1   0.607  -1.269   0.192
    6    H    GLU   2           H        GLU   2   1.456  -0.420  -3.763
    7    HA   GLU   2           HA       GLU   2   1.519  -3.335  -3.468
    8    HB2  GLU   2           HB2      GLU   2   0.152  -1.453  -5.346
    9    HB3  GLU   2           HB3      GLU   2   0.473  -3.099  -5.873
   10    HG2  GLU   2           HG2      GLU   2  -0.680  -3.821  -3.710
   11    HG3  GLU   2           HG3      GLU   2  -1.264  -2.160  -3.623
   12    H    CYS   3           H        CYS   3   3.876  -1.473  -3.834
   13    HA   CYS   3           HA       CYS   3   5.022  -2.847  -6.173
   14    HB2  CYS   3           HB2      CYS   3   6.502  -0.739  -6.350
   15    HB3  CYS   3           HB3      CYS   3   4.845  -0.641  -6.938
   16    H    ARG   4           H        ARG   4   7.441  -2.931  -6.097
   17    HA   ARG   4           HA       ARG   4   8.256  -3.901  -3.507
   18    HB2  ARG   4           HB2      ARG   4  10.016  -3.654  -5.938
   19    HB3  ARG   4           HB3      ARG   4  10.166  -4.779  -4.596
   20    HG2  ARG   4           HG2      ARG   4   8.224  -5.991  -5.322
   21    HG3  ARG   4           HG3      ARG   4   7.907  -4.798  -6.584
   22    HD2  ARG   4           HD2      ARG   4   8.965  -6.447  -7.786
   23    HD3  ARG   4           HD3      ARG   4  10.324  -5.406  -7.361
   24    HE   ARG   4           HE       ARG   4  10.304  -7.174  -5.338
   25   HH11  ARG   4          HH11      ARG   4  10.190  -7.569  -8.796
   26   HH12  ARG   4          HH12      ARG   4  11.001  -9.100  -8.778
   27   HH21  ARG   4          HH21      ARG   4  11.373  -9.189  -5.303
   28   HH22  ARG   4          HH22      ARG   4  11.673 -10.021  -6.791
   29    H    TYR   5           H        TYR   5   9.687  -2.995  -2.114
   30    HA   TYR   5           HA       TYR   5  10.112  -0.200  -2.229
   31    HB2  TYR   5           HB2      TYR   5  10.736  -2.394  -0.373
   32    HB3  TYR   5           HB3      TYR   5  11.889  -1.064  -0.335
   33    HD1  TYR   5           HD1      TYR   5   8.980  -2.274   1.108
   34    HD2  TYR   5           HD2      TYR   5  10.675   1.348  -0.342
   35    HE1  TYR   5           HE1      TYR   5   7.442  -0.991   2.535
   36    HE2  TYR   5           HE2      TYR   5   9.143   2.643   1.081
   37    HH   TYR   5           HH       TYR   5   7.837   2.045   3.398
   38    H    LEU   6           H        LEU   6  12.385   0.721  -1.840
   39    HA   LEU   6           HA       LEU   6  13.883   0.671  -4.098
   40    HB2  LEU   6           HB2      LEU   6  14.090   2.106  -1.950
   41    HB3  LEU   6           HB3      LEU   6  15.266   0.892  -1.452
   42    HG   LEU   6           HG       LEU   6  16.306   1.478  -3.825
   43   HD11  LEU   6          HD11      LEU   6  14.403   3.642  -3.267
   44   HD12  LEU   6          HD12      LEU   6  15.126   3.127  -4.789
   45   HD13  LEU   6          HD13      LEU   6  16.032   4.168  -3.692
   46   HD21  LEU   6          HD21      LEU   6  17.074   1.823  -1.303
   47   HD22  LEU   6          HD22      LEU   6  16.850   3.516  -1.743
   48   HD23  LEU   6          HD23      LEU   6  17.965   2.506  -2.663
   49    H    PHE   7           H        PHE   7  15.345  -0.613  -5.055
   50    HA   PHE   7           HA       PHE   7  16.620  -2.439  -5.513
   51    HB2  PHE   7           HB2      PHE   7  17.148  -2.044  -2.585
   52    HB3  PHE   7           HB3      PHE   7  17.835  -3.427  -3.431
   53    HD1  PHE   7           HD1      PHE   7  17.970   0.165  -2.938
   54    HD2  PHE   7           HD2      PHE   7  19.472  -3.095  -5.225
   55    HE1  PHE   7           HE1      PHE   7  19.824   1.577  -3.726
   56    HE2  PHE   7           HE2      PHE   7  21.330  -1.688  -6.016
   57    HZ   PHE   7           HZ       PHE   7  21.508   0.651  -5.266
   58    H    GLY   8           H        GLY   8  14.020  -3.036  -5.517
   59    HA2  GLY   8           HA2      GLY   8  13.534  -5.325  -3.778
   60    HA3  GLY   8           HA3      GLY   8  12.388  -4.607  -4.902
   61    H    GLY   9           H        GLY   9  15.162  -4.898  -6.609
   62    HA2  GLY   9           HA2      GLY   9  15.998  -6.436  -8.106
   63    HA3  GLY   9           HA3      GLY   9  15.187  -7.694  -7.185
   64    H    CYS  10           H        CYS  10  13.990  -4.878  -9.010
   65    HA   CYS  10           HA       CYS  10  11.910  -6.519 -10.181
   66    HB2  CYS  10           HB2      CYS  10  10.998  -4.469 -11.035
   67    HB3  CYS  10           HB3      CYS  10  11.506  -4.179  -9.375
   68    H    LYS  11           H        LYS  11  11.466  -5.902 -12.627
   69    HA   LYS  11           HA       LYS  11  13.995  -6.146 -14.112
   70    HB2  LYS  11           HB2      LYS  11  11.451  -7.656 -14.733
   71    HB3  LYS  11           HB3      LYS  11  12.981  -7.784 -15.590
   72    HG2  LYS  11           HG2      LYS  11  12.775  -8.429 -12.672
   73    HG3  LYS  11           HG3      LYS  11  12.374  -9.617 -13.913
   74    HD2  LYS  11           HD2      LYS  11  14.973  -8.145 -14.046
   75    HD3  LYS  11           HD3      LYS  11  14.793  -9.511 -12.942
   76    HE2  LYS  11           HE2      LYS  11  13.950  -9.807 -15.789
   77    HE3  LYS  11           HE3      LYS  11  15.666  -9.870 -15.387
   78    HZ1  LYS  11           HZ1      LYS  11  15.253 -12.025 -15.028
   79    HZ2  LYS  11           HZ2      LYS  11  13.583 -11.803 -14.879
   80    HZ3  LYS  11           HZ3      LYS  11  14.595 -11.518 -13.554
   81    H    THR  12           H        THR  12  10.628  -5.141 -14.104
   82    HA   THR  12           HA       THR  12  11.256  -3.242 -16.254
   83    HB   THR  12           HB       THR  12   8.976  -3.593 -17.204
   84    HG1  THR  12           HG1      THR  12   7.651  -4.911 -16.219
   85   HG21  THR  12          HG21      THR  12  11.098  -4.713 -18.057
   86   HG22  THR  12          HG22      THR  12   9.570  -5.459 -18.527
   87   HG23  THR  12          HG23      THR  12  10.535  -6.167 -17.233
   88    H    THR  13           H        THR  13   9.634  -1.467 -16.395
   89    HA   THR  13           HA       THR  13   9.314  -0.191 -13.932
   90    HB   THR  13           HB       THR  13   7.645   0.412 -16.373
   91    HG1  THR  13           HG1      THR  13  10.202   1.520 -15.855
   92   HG21  THR  13          HG21      THR  13   8.750   2.639 -14.886
   93   HG22  THR  13          HG22      THR  13   7.775   1.592 -13.856
   94   HG23  THR  13          HG23      THR  13   7.075   2.295 -15.313
   95    H    ALA  14           H        ALA  14   7.146  -2.266 -15.745
   96    HA   ALA  14           HA       ALA  14   4.762  -1.702 -14.370
   97    HB1  ALA  14           HB1      ALA  14   5.343  -4.443 -15.404
   98    HB2  ALA  14           HB2      ALA  14   3.847  -3.510 -15.470
   99    HB3  ALA  14           HB3      ALA  14   5.194  -3.090 -16.528
  100    H    ASP  15           H        ASP  15   7.538  -3.584 -13.505
  101    HA   ASP  15           HA       ASP  15   6.342  -5.221 -11.531
  102    HB2  ASP  15           HB2      ASP  15   9.198  -4.269 -11.822
  103    HB3  ASP  15           HB3      ASP  15   8.670  -5.518 -10.698
  104    H    CYS  16           H        CYS  16   7.467  -1.931 -11.543
  105    HA   CYS  16           HA       CYS  16   6.934  -1.744  -8.651
  106    HB2  CYS  16           HB2      CYS  16   8.447   0.327 -10.219
  107    HB3  CYS  16           HB3      CYS  16   8.487   0.007  -8.488
  108    H    CYS  17           H        CYS  17   6.233   0.584  -8.038
  109    HA   CYS  17           HA       CYS  17   3.888   1.192  -9.667
  110    HB2  CYS  17           HB2      CYS  17   3.188   2.558  -7.713
  111    HB3  CYS  17           HB3      CYS  17   3.482   0.873  -7.301
  112    H    LYS  18           H        LYS  18   3.280   3.617  -9.665
  113    HA   LYS  18           HA       LYS  18   5.001   5.004 -11.311
  114    HB2  LYS  18           HB2      LYS  18   3.674   7.023 -10.736
  115    HB3  LYS  18           HB3      LYS  18   2.676   5.627 -11.123
  116    HG2  LYS  18           HG2      LYS  18   2.738   5.286  -8.513
  117    HG3  LYS  18           HG3      LYS  18   3.073   7.019  -8.531
  118    HD2  LYS  18           HD2      LYS  18   1.021   7.539  -9.464
  119    HD3  LYS  18           HD3      LYS  18   0.811   5.926 -10.151
  120    HE2  LYS  18           HE2      LYS  18   0.784   5.204  -7.628
  121    HE3  LYS  18           HE3      LYS  18   0.337   6.890  -7.366
  122    HZ1  LYS  18           HZ1      LYS  18  -1.465   5.054  -7.786
  123    HZ2  LYS  18           HZ2      LYS  18  -1.116   5.376  -9.409
  124    HZ3  LYS  18           HZ3      LYS  18  -1.658   6.619  -8.397
  125    H    HIS  19           H        HIS  19   4.702   5.200  -7.788
  126    HA   HIS  19           HA       HIS  19   6.390   7.333  -7.281
  127    HB2  HIS  19           HB2      HIS  19   6.154   4.813  -5.623
  128    HB3  HIS  19           HB3      HIS  19   6.706   6.387  -5.059
  129    HD1  HIS  19           HD1      HIS  19   4.343   5.057  -3.676
  130    HD2  HIS  19           HD2      HIS  19   3.951   7.694  -6.862
  131    HE1  HIS  19           HE1      HIS  19   2.011   5.982  -3.499
  132    H    LEU  20           H        LEU  20   7.169   4.039  -8.152
  133    HA   LEU  20           HA       LEU  20  10.034   4.635  -7.870
  134    HB2  LEU  20           HB2      LEU  20   8.760   1.947  -8.327
  135    HB3  LEU  20           HB3      LEU  20  10.428   2.279  -7.867
  136    HG   LEU  20           HG       LEU  20   8.295   3.180  -6.010
  137   HD11  LEU  20          HD11      LEU  20   9.103   0.293  -6.322
  138   HD12  LEU  20          HD12      LEU  20   7.502   0.969  -6.617
  139   HD13  LEU  20          HD13      LEU  20   8.166   0.958  -4.983
  140   HD21  LEU  20          HD21      LEU  20  10.384   1.755  -4.765
  141   HD22  LEU  20          HD22      LEU  20  10.103   3.497  -4.765
  142   HD23  LEU  20          HD23      LEU  20  11.122   2.768  -6.006
  143    H    GLY  21           H        GLY  21  11.428   3.525  -9.576
  144    HA2  GLY  21           HA2      GLY  21  10.134   3.456 -12.208
  145    HA3  GLY  21           HA3      GLY  21  11.448   4.597 -11.959
  146    H    CYS  22           H        CYS  22  10.585   1.209 -12.175
  147    HA   CYS  22           HA       CYS  22  12.981  -0.035 -11.658
  148    HB2  CYS  22           HB2      CYS  22  10.706  -1.048 -12.332
  149    HB3  CYS  22           HB3      CYS  22  11.268  -0.861 -13.990
  150    H    ARG  23           H        ARG  23  14.948   0.302 -12.428
  151    HA   ARG  23           HA       ARG  23  15.345   1.668 -14.946
  152    HB2  ARG  23           HB2      ARG  23  17.089   0.844 -12.666
  153    HB3  ARG  23           HB3      ARG  23  17.839   1.174 -14.222
  154    HG2  ARG  23           HG2      ARG  23  16.648   3.403 -14.177
  155    HG3  ARG  23           HG3      ARG  23  16.257   3.050 -12.491
  156    HD2  ARG  23           HD2      ARG  23  18.204   4.174 -12.163
  157    HD3  ARG  23           HD3      ARG  23  18.869   2.559 -12.402
  158    HE   ARG  23           HE       ARG  23  18.848   3.550 -14.901
  159   HH11  ARG  23          HH11      ARG  23  20.020   4.822 -11.880
  160   HH12  ARG  23          HH12      ARG  23  21.289   5.748 -12.612
  161   HH21  ARG  23          HH21      ARG  23  20.514   4.763 -15.877
  162   HH22  ARG  23          HH22      ARG  23  21.569   5.714 -14.886
  163    H    THR  24           H        THR  24  16.383   0.853 -16.755
  164    HA   THR  24           HA       THR  24  16.095  -1.996 -17.147
  165    HB   THR  24           HB       THR  24  16.705  -1.551 -19.480
  166    HG1  THR  24           HG1      THR  24  17.894   0.149 -19.859
  167   HG21  THR  24          HG21      THR  24  14.456  -1.243 -19.389
  168   HG22  THR  24          HG22      THR  24  14.906   0.420 -19.764
  169   HG23  THR  24          HG23      THR  24  14.562  -0.047 -18.099
  170    H    ASP  25           H        ASP  25  18.636   0.235 -16.458
  171    HA   ASP  25           HA       ASP  25  20.706  -1.680 -17.219
  172    HB2  ASP  25           HB2      ASP  25  20.972   0.727 -17.803
  173    HB3  ASP  25           HB3      ASP  25  21.012   1.107 -16.083
  174    H    LEU  26           H        LEU  26  19.327  -0.122 -14.379
  175    HA   LEU  26           HA       LEU  26  21.176  -1.498 -12.606
  176    HB2  LEU  26           HB2      LEU  26  19.009   0.533 -12.217
  177    HB3  LEU  26           HB3      LEU  26  19.688  -0.340 -10.845
  178    HG   LEU  26           HG       LEU  26  20.736   1.819 -11.028
  179   HD11  LEU  26          HD11      LEU  26  22.882   0.086 -12.108
  180   HD12  LEU  26          HD12      LEU  26  22.052  -0.456 -10.650
  181   HD13  LEU  26          HD13      LEU  26  22.862   1.110 -10.672
  182   HD21  LEU  26          HD21      LEU  26  21.979   1.188 -13.649
  183   HD22  LEU  26          HD22      LEU  26  21.574   2.748 -12.932
  184   HD23  LEU  26          HD23      LEU  26  20.307   1.747 -13.644
  185    H    TYR  27           H        TYR  27  17.811  -1.626 -13.593
  186    HA   TYR  27           HA       TYR  27  16.190  -3.195 -13.304
  187    HB2  TYR  27           HB2      TYR  27  18.706  -4.709 -12.977
  188    HB3  TYR  27           HB3      TYR  27  17.271  -5.477 -12.308
  189    HD1  TYR  27           HD1      TYR  27  17.389  -3.316 -15.315
  190    HD2  TYR  27           HD2      TYR  27  17.021  -7.280 -13.813
  191    HE1  TYR  27           HE1      TYR  27  16.768  -4.103 -17.561
  192    HE2  TYR  27           HE2      TYR  27  16.400  -8.078 -16.055
  193    HH   TYR  27           HH       TYR  27  16.966  -6.539 -18.777
  194    H    TYR  28           H        TYR  28  16.084  -1.432 -11.389
  195    HA   TYR  28           HA       TYR  28  15.175  -2.933  -9.107
  196    HB2  TYR  28           HB2      TYR  28  16.650  -2.207  -7.489
  197    HB3  TYR  28           HB3      TYR  28  17.738  -2.374  -8.863
  198    HD1  TYR  28           HD1      TYR  28  17.682  -0.089 -10.401
  199    HD2  TYR  28           HD2      TYR  28  17.023  -0.339  -6.204
  200    HE1  TYR  28           HE1      TYR  28  18.352   2.265 -10.161
  201    HE2  TYR  28           HE2      TYR  28  17.690   2.014  -5.954
  202    HH   TYR  28           HH       TYR  28  18.975   3.697  -7.117
  203    H    CYS  29           H        CYS  29  13.698  -1.808  -7.854
  204    HA   CYS  29           HA       CYS  29  12.374   0.358  -9.120
  205    HB2  CYS  29           HB2      CYS  29  12.036  -0.720  -6.312
  206    HB3  CYS  29           HB3      CYS  29  10.911   0.349  -7.144
  207    H    ALA  30           H        ALA  30  13.023   2.397  -9.134
  208    HA   ALA  30           HA       ALA  30  14.691   3.393  -6.940
  209    HB1  ALA  30           HB1      ALA  30  15.535   3.645  -9.241
  210    HB2  ALA  30           HB2      ALA  30  14.138   4.652  -9.623
  211    HB3  ALA  30           HB3      ALA  30  15.316   5.195  -8.428
  212    H    TRP  31           H        TRP  31  13.393   4.067  -5.321
  213    HA   TRP  31           HA       TRP  31  10.852   5.247  -5.662
  214    HB2  TRP  31           HB2      TRP  31  11.569   4.144  -3.573
  215    HB3  TRP  31           HB3      TRP  31  12.724   5.443  -3.294
  216    HD1  TRP  31           HD1      TRP  31  11.548   7.974  -2.978
  217    HE1  TRP  31           HE1      TRP  31   9.376   8.570  -1.731
  218    HE3  TRP  31           HE3      TRP  31   9.355   3.358  -2.919
  219    HZ2  TRP  31           HZ2      TRP  31   7.042   7.256  -0.841
  220    HZ3  TRP  31           HZ3      TRP  31   7.152   3.112  -1.849
  221    HH2  TRP  31           HH2      TRP  31   6.022   5.022  -0.832
  222    H    ASP  32           H        ASP  32  10.541   7.116  -6.682
  223    HA   ASP  32           HA       ASP  32  11.998   9.469  -5.768
  224    HB2  ASP  32           HB2      ASP  32  13.187   8.514  -7.794
  225    HB3  ASP  32           HB3      ASP  32  11.738   8.894  -8.720
  226    H    GLY  33           H        GLY  33   9.613   8.391  -8.198
  227    HA2  GLY  33           HA2      GLY  33   7.316   8.973  -8.151
  228    HA3  GLY  33           HA3      GLY  33   7.703  10.309  -7.076
  229    H    THR  34           H        THR  34  10.001  11.007  -8.923
  230    HA   THR  34           HA       THR  34   8.420  12.200 -11.104
  231    HB   THR  34           HB       THR  34   9.613  14.277 -10.914
  232    HG1  THR  34           HG1      THR  34  11.609  13.938 -10.201
  233   HG21  THR  34          HG21      THR  34   7.664  13.971  -9.429
  234   HG22  THR  34          HG22      THR  34   8.864  15.065  -8.739
  235   HG23  THR  34          HG23      THR  34   8.744  13.405  -8.155
  236    H    PHE  35           H        PHE  35   9.423  12.402 -13.088
  237    HA   PHE  35           HA       PHE  35  12.115  11.229 -13.313
  238    HB2  PHE  35           HB2      PHE  35   9.744  10.771 -15.134
  239    HB3  PHE  35           HB3      PHE  35  11.386  10.237 -15.483
  240    HD1  PHE  35           HD1      PHE  35  12.188   8.210 -14.651
  241    HD2  PHE  35           HD2      PHE  35   8.604   9.869 -13.064
  242    HE1  PHE  35           HE1      PHE  35  11.772   6.122 -13.416
  243    HE2  PHE  35           HE2      PHE  35   8.183   7.784 -11.825
  244    HZ   PHE  35           HZ       PHE  35   9.768   5.907 -12.002
  Start of MODEL    3
    1    H1   SER   1           H        SER   1   0.908  -0.468   0.300
    2    HA   SER   1           HA       SER   1   1.906   0.834  -2.149
    3    HB2  SER   1           HB2      SER   1   3.635  -0.619  -0.142
    4    HB3  SER   1           HB3      SER   1   4.161   0.390  -1.490
    5    HG   SER   1           HG       SER   1   3.822   2.125  -0.330
    6    H    GLU   2           H        GLU   2   1.479  -0.434  -3.827
    7    HA   GLU   2           HA       GLU   2   1.531  -3.346  -3.468
    8    HB2  GLU   2           HB2      GLU   2   0.429  -1.759  -5.791
    9    HB3  GLU   2           HB3      GLU   2   0.232  -3.483  -5.509
   10    HG2  GLU   2           HG2      GLU   2  -0.707  -2.164  -3.204
   11    HG3  GLU   2           HG3      GLU   2  -1.375  -1.314  -4.597
   12    H    CYS   3           H        CYS   3   3.867  -1.464  -3.861
   13    HA   CYS   3           HA       CYS   3   5.030  -2.852  -6.186
   14    HB2  CYS   3           HB2      CYS   3   6.505  -0.741  -6.361
   15    HB3  CYS   3           HB3      CYS   3   4.849  -0.647  -6.953
   16    H    ARG   4           H        ARG   4   7.446  -2.935  -6.101
   17    HA   ARG   4           HA       ARG   4   8.254  -3.898  -3.506
   18    HB2  ARG   4           HB2      ARG   4  10.024  -3.652  -5.930
   19    HB3  ARG   4           HB3      ARG   4  10.167  -4.777  -4.587
   20    HG2  ARG   4           HG2      ARG   4   8.233  -5.992  -5.321
   21    HG3  ARG   4           HG3      ARG   4   7.915  -4.799  -6.581
   22    HD2  ARG   4           HD2      ARG   4   8.980  -6.444  -7.784
   23    HD3  ARG   4           HD3      ARG   4  10.336  -5.400  -7.354
   24    HE   ARG   4           HE       ARG   4  10.317  -7.171  -5.335
   25   HH11  ARG   4          HH11      ARG   4  10.205  -7.564  -8.792
   26   HH12  ARG   4          HH12      ARG   4  11.017  -9.095  -8.775
   27   HH21  ARG   4          HH21      ARG   4  11.386  -9.185  -5.300
   28   HH22  ARG   4          HH22      ARG   4  11.688 -10.016  -6.788
   29    H    TYR   5           H        TYR   5   9.695  -2.996  -2.117
   30    HA   TYR   5           HA       TYR   5  10.110  -0.197  -2.230
   31    HB2  TYR   5           HB2      TYR   5  10.735  -2.388  -0.372
   32    HB3  TYR   5           HB3      TYR   5  11.887  -1.060  -0.335
   33    HD1  TYR   5           HD1      TYR   5   8.973  -2.269   1.103
   34    HD2  TYR   5           HD2      TYR   5  10.675   1.352  -0.342
   35    HE1  TYR   5           HE1      TYR   5   7.434  -0.984   2.528
   36    HE2  TYR   5           HE2      TYR   5   9.142   2.647   1.079
   37    HH   TYR   5           HH       TYR   5   6.460   1.238   2.650
   38    H    LEU   6           H        LEU   6  12.383   0.728  -1.838
   39    HA   LEU   6           HA       LEU   6  13.882   0.679  -4.095
   40    HB2  LEU   6           HB2      LEU   6  14.084   2.115  -1.946
   41    HB3  LEU   6           HB3      LEU   6  15.263   0.903  -1.449
   42    HG   LEU   6           HG       LEU   6  16.309   1.488  -3.816
   43   HD11  LEU   6          HD11      LEU   6  14.391   3.646  -3.276
   44   HD12  LEU   6          HD12      LEU   6  15.120   3.123  -4.794
   45   HD13  LEU   6          HD13      LEU   6  16.018   4.176  -3.701
   46   HD21  LEU   6          HD21      LEU   6  17.278   1.710  -1.487
   47   HD22  LEU   6          HD22      LEU   6  16.691   3.373  -1.503
   48   HD23  LEU   6          HD23      LEU   6  17.880   2.845  -2.695
   49    H    PHE   7           H        PHE   7  15.346  -0.605  -5.052
   50    HA   PHE   7           HA       PHE   7  16.624  -2.429  -5.507
   51    HB2  PHE   7           HB2      PHE   7  17.149  -2.032  -2.578
   52    HB3  PHE   7           HB3      PHE   7  17.840  -3.412  -3.424
   53    HD1  PHE   7           HD1      PHE   7  17.969   0.178  -2.926
   54    HD2  PHE   7           HD2      PHE   7  19.475  -3.073  -5.223
   55    HE1  PHE   7           HE1      PHE   7  19.821   1.595  -3.712
   56    HE2  PHE   7           HE2      PHE   7  21.328  -1.662  -6.012
   57    HZ   PHE   7           HZ       PHE   7  21.504   0.676  -5.257
   58    H    GLY   8           H        GLY   8  14.027  -3.031  -5.514
   59    HA2  GLY   8           HA2      GLY   8  13.542  -5.319  -3.773
   60    HA3  GLY   8           HA3      GLY   8  12.397  -4.605  -4.898
   61    H    GLY   9           H        GLY   9  15.173  -4.892  -6.601
   62    HA2  GLY   9           HA2      GLY   9  16.014  -6.432  -8.096
   63    HA3  GLY   9           HA3      GLY   9  15.201  -7.690  -7.176
   64    H    CYS  10           H        CYS  10  14.006  -4.874  -9.002
   65    HA   CYS  10           HA       CYS  10  11.932  -6.518 -10.181
   66    HB2  CYS  10           HB2      CYS  10  11.007  -4.474 -11.020
   67    HB3  CYS  10           HB3      CYS  10  11.533  -4.173  -9.366
   68    H    LYS  11           H        LYS  11  11.494  -5.872 -12.629
   69    HA   LYS  11           HA       LYS  11  14.026  -6.099 -14.111
   70    HB2  LYS  11           HB2      LYS  11  11.506  -7.653 -14.724
   71    HB3  LYS  11           HB3      LYS  11  13.033  -7.754 -15.590
   72    HG2  LYS  11           HG2      LYS  11  12.736  -8.460 -12.683
   73    HG3  LYS  11           HG3      LYS  11  12.565  -9.629 -13.995
   74    HD2  LYS  11           HD2      LYS  11  14.853  -9.039 -14.751
   75    HD3  LYS  11           HD3      LYS  11  15.011  -7.984 -13.345
   76    HE2  LYS  11           HE2      LYS  11  16.036  -9.964 -12.668
   77    HE3  LYS  11           HE3      LYS  11  14.422 -10.072 -11.969
   78    HZ1  LYS  11           HZ1      LYS  11  15.532 -12.026 -13.370
   79    HZ2  LYS  11           HZ2      LYS  11  14.752 -11.205 -14.627
   80    HZ3  LYS  11           HZ3      LYS  11  13.860 -11.777 -13.309
   81    H    THR  12           H        THR  12  10.632  -5.171 -14.123
   82    HA   THR  12           HA       THR  12  11.233  -3.268 -16.281
   83    HB   THR  12           HB       THR  12   8.799  -3.668 -17.043
   84    HG1  THR  12           HG1      THR  12   7.802  -5.382 -16.264
   85   HG21  THR  12          HG21      THR  12  10.766  -5.900 -17.543
   86   HG22  THR  12          HG22      THR  12  10.885  -4.304 -18.286
   87   HG23  THR  12          HG23      THR  12   9.489  -5.330 -18.618
   88    H    THR  13           H        THR  13   9.624  -1.494 -16.414
   89    HA   THR  13           HA       THR  13   9.304  -0.210 -13.958
   90    HB   THR  13           HB       THR  13   7.603   0.385 -16.375
   91    HG1  THR  13           HG1      THR  13   9.612   0.380 -17.241
   92   HG21  THR  13          HG21      THR  13   8.706   2.665 -15.056
   93   HG22  THR  13          HG22      THR  13   7.952   1.620 -13.853
   94   HG23  THR  13          HG23      THR  13   7.013   2.199 -15.228
   95    H    ALA  14           H        ALA  14   7.136  -2.302 -15.748
   96    HA   ALA  14           HA       ALA  14   4.756  -1.738 -14.365
   97    HB1  ALA  14           HB1      ALA  14   3.839  -3.541 -15.463
   98    HB2  ALA  14           HB2      ALA  14   5.196  -3.145 -16.519
   99    HB3  ALA  14           HB3      ALA  14   5.327  -4.485 -15.381
  100    H    ASP  15           H        ASP  15   7.545  -3.604 -13.503
  101    HA   ASP  15           HA       ASP  15   6.364  -5.239 -11.518
  102    HB2  ASP  15           HB2      ASP  15   9.215  -4.272 -11.819
  103    HB3  ASP  15           HB3      ASP  15   8.696  -5.523 -10.694
  104    H    CYS  16           H        CYS  16   7.469  -1.943 -11.547
  105    HA   CYS  16           HA       CYS  16   6.940  -1.747  -8.656
  106    HB2  CYS  16           HB2      CYS  16   8.451   0.320 -10.232
  107    HB3  CYS  16           HB3      CYS  16   8.489   0.009  -8.500
  108    H    CYS  17           H        CYS  17   6.236   0.583  -8.052
  109    HA   CYS  17           HA       CYS  17   3.890   1.180  -9.684
  110    HB2  CYS  17           HB2      CYS  17   3.189   2.556  -7.734
  111    HB3  CYS  17           HB3      CYS  17   3.480   0.869  -7.319
  112    H    LYS  18           H        LYS  18   3.278   3.606  -9.685
  113    HA   LYS  18           HA       LYS  18   4.997   4.990 -11.336
  114    HB2  LYS  18           HB2      LYS  18   3.671   7.019 -10.737
  115    HB3  LYS  18           HB3      LYS  18   2.685   5.629 -11.173
  116    HG2  LYS  18           HG2      LYS  18   2.545   5.180  -8.654
  117    HG3  LYS  18           HG3      LYS  18   3.139   6.832  -8.468
  118    HD2  LYS  18           HD2      LYS  18   1.238   7.531  -9.999
  119    HD3  LYS  18           HD3      LYS  18   0.592   5.904  -9.776
  120    HE2  LYS  18           HE2      LYS  18  -0.515   7.055  -8.121
  121    HE3  LYS  18           HE3      LYS  18   0.887   6.452  -7.238
  122    HZ1  LYS  18           HZ1      LYS  18   0.093   9.030  -7.323
  123    HZ2  LYS  18           HZ2      LYS  18   1.316   9.007  -8.492
  124    HZ3  LYS  18           HZ3      LYS  18   1.649   8.509  -6.910
  125    H    HIS  19           H        HIS  19   4.693   5.205  -7.815
  126    HA   HIS  19           HA       HIS  19   6.381   7.338  -7.316
  127    HB2  HIS  19           HB2      HIS  19   6.120   4.823  -5.655
  128    HB3  HIS  19           HB3      HIS  19   6.714   6.381  -5.090
  129    HD1  HIS  19           HD1      HIS  19   4.311   5.076  -3.721
  130    HD2  HIS  19           HD2      HIS  19   3.997   7.792  -6.848
  131    HE1  HIS  19           HE1      HIS  19   2.008   6.067  -3.522
  132    H    LEU  20           H        LEU  20   7.162   4.041  -8.172
  133    HA   LEU  20           HA       LEU  20  10.027   4.636  -7.887
  134    HB2  LEU  20           HB2      LEU  20   8.747   1.949  -8.339
  135    HB3  LEU  20           HB3      LEU  20  10.418   2.277  -7.887
  136    HG   LEU  20           HG       LEU  20   8.292   3.185  -6.024
  137   HD11  LEU  20          HD11      LEU  20   9.103   0.297  -6.322
  138   HD12  LEU  20          HD12      LEU  20   7.502   0.968  -6.630
  139   HD13  LEU  20          HD13      LEU  20   8.158   0.968  -4.994
  140   HD21  LEU  20          HD21      LEU  20  10.393   1.759  -4.792
  141   HD22  LEU  20          HD22      LEU  20  10.099   3.499  -4.777
  142   HD23  LEU  20          HD23      LEU  20  11.116   2.785  -6.029
  143    H    GLY  21           H        GLY  21  11.424   3.524  -9.589
  144    HA2  GLY  21           HA2      GLY  21  10.135   3.457 -12.224
  145    HA3  GLY  21           HA3      GLY  21  11.453   4.592 -11.971
  146    H    CYS  22           H        CYS  22  10.578   1.207 -12.189
  147    HA   CYS  22           HA       CYS  22  12.968  -0.044 -11.668
  148    HB2  CYS  22           HB2      CYS  22  10.691  -1.051 -12.342
  149    HB3  CYS  22           HB3      CYS  22  11.254  -0.866 -14.000
  150    H    ARG  23           H        ARG  23  14.938   0.285 -12.435
  151    HA   ARG  23           HA       ARG  23  15.341   1.647 -14.954
  152    HB2  ARG  23           HB2      ARG  23  17.082   0.819 -12.673
  153    HB3  ARG  23           HB3      ARG  23  17.832   1.151 -14.228
  154    HG2  ARG  23           HG2      ARG  23  16.659   3.382 -14.185
  155    HG3  ARG  23           HG3      ARG  23  16.243   3.028 -12.506
  156    HD2  ARG  23           HD2      ARG  23  18.189   4.128 -12.130
  157    HD3  ARG  23           HD3      ARG  23  18.860   2.520 -12.402
  158    HE   ARG  23           HE       ARG  23  18.851   3.568 -14.878
  159   HH11  ARG  23          HH11      ARG  23  20.002   4.774 -11.822
  160   HH12  ARG  23          HH12      ARG  23  21.272   5.720 -12.524
  161   HH21  ARG  23          HH21      ARG  23  20.520   4.809 -15.815
  162   HH22  ARG  23          HH22      ARG  23  21.565   5.739 -14.797
  163    H    THR  24           H        THR  24  16.377   0.825 -16.763
  164    HA   THR  24           HA       THR  24  16.084  -2.024 -17.146
  165    HB   THR  24           HB       THR  24  16.674  -1.593 -19.480
  166    HG1  THR  24           HG1      THR  24  17.401   0.918 -18.424
  167   HG21  THR  24          HG21      THR  24  14.457  -1.201 -19.487
  168   HG22  THR  24          HG22      THR  24  14.923   0.489 -19.674
  169   HG23  THR  24          HG23      THR  24  14.541  -0.149 -18.075
  170    H    ASP  25           H        ASP  25  18.629   0.206 -16.467
  171    HA   ASP  25           HA       ASP  25  20.697  -1.715 -17.223
  172    HB2  ASP  25           HB2      ASP  25  20.764   0.863 -17.644
  173    HB3  ASP  25           HB3      ASP  25  21.257   0.945 -15.954
  174    H    LEU  26           H        LEU  26  19.319  -0.147 -14.387
  175    HA   LEU  26           HA       LEU  26  21.169  -1.520 -12.611
  176    HB2  LEU  26           HB2      LEU  26  19.003   0.514 -12.225
  177    HB3  LEU  26           HB3      LEU  26  19.686  -0.355 -10.852
  178    HG   LEU  26           HG       LEU  26  20.733   1.804 -11.046
  179   HD11  LEU  26          HD11      LEU  26  22.682  -0.258 -12.049
  180   HD12  LEU  26          HD12      LEU  26  22.087  -0.197 -10.391
  181   HD13  LEU  26          HD13      LEU  26  23.020   1.150 -11.042
  182   HD21  LEU  26          HD21      LEU  26  20.292   1.740 -13.651
  183   HD22  LEU  26          HD22      LEU  26  21.956   1.153 -13.676
  184   HD23  LEU  26          HD23      LEU  26  21.583   2.719 -12.956
  185    H    TYR  27           H        TYR  27  17.802  -1.645 -13.593
  186    HA   TYR  27           HA       TYR  27  16.179  -3.210 -13.298
  187    HB2  TYR  27           HB2      TYR  27  18.693  -4.728 -12.974
  188    HB3  TYR  27           HB3      TYR  27  17.258  -5.492 -12.298
  189    HD1  TYR  27           HD1      TYR  27  17.383  -3.341 -15.315
  190    HD2  TYR  27           HD2      TYR  27  16.985  -7.295 -13.795
  191    HE1  TYR  27           HE1      TYR  27  16.755  -4.134 -17.557
  192    HE2  TYR  27           HE2      TYR  27  16.358  -8.099 -16.033
  193    HH   TYR  27           HH       TYR  27  16.272  -5.898 -18.818
  194    H    TYR  28           H        TYR  28  16.082  -1.441 -11.386
  195    HA   TYR  28           HA       TYR  28  15.175  -2.937  -9.099
  196    HB2  TYR  28           HB2      TYR  28  16.653  -2.206  -7.487
  197    HB3  TYR  28           HB3      TYR  28  17.739  -2.376  -8.862
  198    HD1  TYR  28           HD1      TYR  28  17.684  -0.098 -10.404
  199    HD2  TYR  28           HD2      TYR  28  17.021  -0.333  -6.208
  200    HE1  TYR  28           HE1      TYR  28  18.353   2.258 -10.173
  201    HE2  TYR  28           HE2      TYR  28  17.687   2.023  -5.965
  202    HH   TYR  28           HH       TYR  28  19.153   3.791  -8.530
  203    H    CYS  29           H        CYS  29  13.696  -1.812  -7.851
  204    HA   CYS  29           HA       CYS  29  12.372   0.352  -9.119
  205    HB2  CYS  29           HB2      CYS  29  12.035  -0.723  -6.310
  206    HB3  CYS  29           HB3      CYS  29  10.911   0.347  -7.140
  207    H    ALA  30           H        ALA  30  13.020   2.391  -9.138
  208    HA   ALA  30           HA       ALA  30  14.689   3.392  -6.946
  209    HB1  ALA  30           HB1      ALA  30  15.308   5.194  -8.437
  210    HB2  ALA  30           HB2      ALA  30  15.532   3.643  -9.247
  211    HB3  ALA  30           HB3      ALA  30  14.132   4.645  -9.632
  212    H    TRP  31           H        TRP  31  13.392   4.067  -5.326
  213    HA   TRP  31           HA       TRP  31  10.850   5.248  -5.671
  214    HB2  TRP  31           HB2      TRP  31  11.564   4.142  -3.581
  215    HB3  TRP  31           HB3      TRP  31  12.720   5.441  -3.299
  216    HD1  TRP  31           HD1      TRP  31  11.544   7.972  -2.981
  217    HE1  TRP  31           HE1      TRP  31   9.371   8.566  -1.738
  218    HE3  TRP  31           HE3      TRP  31   9.348   3.355  -2.933
  219    HZ2  TRP  31           HZ2      TRP  31   7.034   7.252  -0.853
  220    HZ3  TRP  31           HZ3      TRP  31   7.144   3.109  -1.867
  221    HH2  TRP  31           HH2      TRP  31   6.012   5.018  -0.849
  222    H    ASP  32           H        ASP  32  10.542   7.118  -6.688
  223    HA   ASP  32           HA       ASP  32  12.009   9.467  -5.773
  224    HB2  ASP  32           HB2      ASP  32  13.177   8.509  -7.814
  225    HB3  ASP  32           HB3      ASP  32  11.722   8.904  -8.726
  226    H    GLY  33           H        GLY  33   9.604   8.404  -8.191
  227    HA2  GLY  33           HA2      GLY  33   7.319   8.997  -8.172
  228    HA3  GLY  33           HA3      GLY  33   7.686  10.282  -7.032
  229    H    THR  34           H        THR  34  10.002  11.078  -8.816
  230    HA   THR  34           HA       THR  34   8.416  12.424 -10.906
  231    HB   THR  34           HB       THR  34  10.037  14.339 -10.686
  232    HG1  THR  34           HG1      THR  34  10.993  14.322  -8.430
  233   HG21  THR  34          HG21      THR  34   9.017  14.735  -8.152
  234   HG22  THR  34          HG22      THR  34   7.892  13.579  -8.865
  235   HG23  THR  34          HG23      THR  34   8.201  15.119  -9.666
  236    H    PHE  35           H        PHE  35   9.210  12.405 -12.937
  237    HA   PHE  35           HA       PHE  35  11.919  11.318 -13.335
  238    HB2  PHE  35           HB2      PHE  35   9.421  10.708 -14.928
  239    HB3  PHE  35           HB3      PHE  35  11.045  10.216 -15.399
  240    HD1  PHE  35           HD1      PHE  35  11.945   8.221 -14.620
  241    HD2  PHE  35           HD2      PHE  35   8.543   9.885 -12.677
  242    HE1  PHE  35           HE1      PHE  35  11.715   6.174 -13.274
  243    HE2  PHE  35           HE2      PHE  35   8.309   7.842 -11.327
  244    HZ   PHE  35           HZ       PHE  35   9.896   5.982 -11.626
  Start of MODEL    4
    1    H1   SER   1           H        SER   1   0.455   1.508  -2.510
    2    HA   SER   1           HA       SER   1  -0.395  -0.357  -4.545
    3    HB2  SER   1           HB2      SER   1   0.588   1.534  -5.852
    4    HB3  SER   1           HB3      SER   1   2.116   1.270  -5.011
    5    HG   SER   1           HG       SER   1   0.765  -0.687  -6.562
    6    H    GLU   2           H        GLU   2   0.870  -2.258  -4.608
    7    HA   GLU   2           HA       GLU   2   2.446  -2.660  -2.174
    8    HB2  GLU   2           HB2      GLU   2   0.443  -4.151  -3.050
    9    HB3  GLU   2           HB3      GLU   2   1.714  -4.902  -4.005
   10    HG2  GLU   2           HG2      GLU   2   2.963  -5.079  -1.742
   11    HG3  GLU   2           HG3      GLU   2   1.362  -4.844  -1.043
   12    H    CYS   3           H        CYS   3   3.373  -1.368  -4.747
   13    HA   CYS   3           HA       CYS   3   5.077  -2.942  -6.227
   14    HB2  CYS   3           HB2      CYS   3   6.480  -0.820  -6.450
   15    HB3  CYS   3           HB3      CYS   3   4.788  -0.701  -6.922
   16    H    ARG   4           H        ARG   4   7.427  -3.154  -6.154
   17    HA   ARG   4           HA       ARG   4   8.291  -4.032  -3.559
   18    HB2  ARG   4           HB2      ARG   4  10.035  -3.836  -6.004
   19    HB3  ARG   4           HB3      ARG   4  10.169  -4.955  -4.654
   20    HG2  ARG   4           HG2      ARG   4   8.167  -6.110  -5.369
   21    HG3  ARG   4           HG3      ARG   4   7.939  -4.948  -6.678
   22    HD2  ARG   4           HD2      ARG   4   9.067  -6.435  -7.920
   23    HD3  ARG   4           HD3      ARG   4  10.494  -5.781  -7.120
   24    HE   ARG   4           HE       ARG   4  10.754  -7.799  -6.102
   25   HH11  ARG   4          HH11      ARG   4   7.417  -7.461  -7.032
   26   HH12  ARG   4          HH12      ARG   4   6.976  -9.056  -6.516
   27   HH21  ARG   4          HH21      ARG   4  10.187  -9.900  -5.419
   28   HH22  ARG   4          HH22      ARG   4   8.552 -10.442  -5.598
   29    H    TYR   5           H        TYR   5   9.515  -2.979  -2.127
   30    HA   TYR   5           HA       TYR   5  10.024  -0.235  -2.343
   31    HB2  TYR   5           HB2      TYR   5  10.636  -2.375  -0.423
   32    HB3  TYR   5           HB3      TYR   5  11.791  -1.048  -0.415
   33    HD1  TYR   5           HD1      TYR   5   8.876  -2.214   1.049
   34    HD2  TYR   5           HD2      TYR   5  10.576   1.365  -0.502
   35    HE1  TYR   5           HE1      TYR   5   7.331  -0.889   2.430
   36    HE2  TYR   5           HE2      TYR   5   9.035   2.700   0.875
   37    HH   TYR   5           HH       TYR   5   7.651   1.946   3.343
   38    H    LEU   6           H        LEU   6  12.295   0.698  -1.966
   39    HA   LEU   6           HA       LEU   6  13.806   0.591  -4.210
   40    HB2  LEU   6           HB2      LEU   6  14.003   2.080  -2.104
   41    HB3  LEU   6           HB3      LEU   6  15.168   0.876  -1.560
   42    HG   LEU   6           HG       LEU   6  16.199   1.408  -3.972
   43   HD11  LEU   6          HD11      LEU   6  15.985   4.121  -3.753
   44   HD12  LEU   6          HD12      LEU   6  14.340   3.590  -3.403
   45   HD13  LEU   6          HD13      LEU   6  15.116   3.121  -4.917
   46   HD21  LEU   6          HD21      LEU   6  17.067   1.657  -1.505
   47   HD22  LEU   6          HD22      LEU   6  16.797   3.372  -1.814
   48   HD23  LEU   6          HD23      LEU   6  17.897   2.453  -2.842
   49    H    PHE   7           H        PHE   7  15.362  -0.663  -5.093
   50    HA   PHE   7           HA       PHE   7  16.654  -2.489  -5.493
   51    HB2  PHE   7           HB2      PHE   7  17.011  -2.198  -2.517
   52    HB3  PHE   7           HB3      PHE   7  17.818  -3.473  -3.425
   53    HD1  PHE   7           HD1      PHE   7  17.871  -0.024  -2.464
   54    HD2  PHE   7           HD2      PHE   7  19.371  -2.820  -5.301
   55    HE1  PHE   7           HE1      PHE   7  19.677   1.541  -3.046
   56    HE2  PHE   7           HE2      PHE   7  21.180  -1.260  -5.887
   57    HZ   PHE   7           HZ       PHE   7  21.334   0.925  -4.761
   58    H    GLY   8           H        GLY   8  13.944  -2.976  -5.444
   59    HA2  GLY   8           HA2      GLY   8  13.449  -5.338  -3.828
   60    HA3  GLY   8           HA3      GLY   8  12.315  -4.567  -4.926
   61    H    GLY   9           H        GLY   9  15.272  -4.984  -6.441
   62    HA2  GLY   9           HA2      GLY   9  16.018  -6.423  -8.066
   63    HA3  GLY   9           HA3      GLY   9  15.207  -7.700  -7.172
   64    H    CYS  10           H        CYS  10  14.030  -4.845  -8.951
   65    HA   CYS  10           HA       CYS  10  11.928  -6.444 -10.137
   66    HB2  CYS  10           HB2      CYS  10  11.019  -4.390 -10.934
   67    HB3  CYS  10           HB3      CYS  10  11.609  -4.076  -9.305
   68    H    LYS  11           H        LYS  11  11.495  -5.766 -12.583
   69    HA   LYS  11           HA       LYS  11  14.016  -6.014 -14.077
   70    HB2  LYS  11           HB2      LYS  11  11.509  -7.655 -14.462
   71    HB3  LYS  11           HB3      LYS  11  12.833  -7.603 -15.619
   72    HG2  LYS  11           HG2      LYS  11  14.344  -8.439 -13.828
   73    HG3  LYS  11           HG3      LYS  11  12.929  -8.630 -12.791
   74    HD2  LYS  11           HD2      LYS  11  13.056 -10.740 -13.662
   75    HD3  LYS  11           HD3      LYS  11  12.027  -9.980 -14.879
   76    HE2  LYS  11           HE2      LYS  11  14.285  -9.419 -16.044
   77    HE3  LYS  11           HE3      LYS  11  14.924 -10.710 -15.030
   78    HZ1  LYS  11           HZ1      LYS  11  14.264 -12.027 -16.689
   79    HZ2  LYS  11           HZ2      LYS  11  13.226 -10.868 -17.353
   80    HZ3  LYS  11           HZ3      LYS  11  12.705 -11.830 -16.062
   81    H    THR  12           H        THR  12  10.603  -5.139 -14.101
   82    HA   THR  12           HA       THR  12  11.186  -3.213 -16.243
   83    HB   THR  12           HB       THR  12   9.009  -3.637 -17.278
   84    HG1  THR  12           HG1      THR  12   8.802  -5.837 -15.476
   85   HG21  THR  12          HG21      THR  12  11.012  -4.882 -18.050
   86   HG22  THR  12          HG22      THR  12   9.510  -5.766 -18.309
   87   HG23  THR  12          HG23      THR  12  10.570  -6.203 -16.970
   88    H    THR  13           H        THR  13   9.677  -1.409 -16.336
   89    HA   THR  13           HA       THR  13   9.275  -0.162 -13.898
   90    HB   THR  13           HB       THR  13   7.686   0.361 -16.417
   91    HG1  THR  13           HG1      THR  13  10.296   1.089 -15.609
   92   HG21  THR  13          HG21      THR  13   6.651   1.813 -15.041
   93   HG22  THR  13          HG22      THR  13   8.125   2.765 -15.208
   94   HG23  THR  13          HG23      THR  13   7.915   1.703 -13.816
   95    H    ALA  14           H        ALA  14   7.127  -2.266 -15.709
   96    HA   ALA  14           HA       ALA  14   4.746  -1.745 -14.317
   97    HB1  ALA  14           HB1      ALA  14   5.245  -3.158 -16.478
   98    HB2  ALA  14           HB2      ALA  14   5.309  -4.489 -15.322
   99    HB3  ALA  14           HB3      ALA  14   3.847  -3.512 -15.462
  100    H    ASP  15           H        ASP  15   7.550  -3.609 -13.484
  101    HA   ASP  15           HA       ASP  15   6.385  -5.256 -11.500
  102    HB2  ASP  15           HB2      ASP  15   9.236  -4.285 -11.792
  103    HB3  ASP  15           HB3      ASP  15   8.712  -5.568 -10.705
  104    H    CYS  16           H        CYS  16   7.484  -1.958 -11.521
  105    HA   CYS  16           HA       CYS  16   6.988  -1.780  -8.622
  106    HB2  CYS  16           HB2      CYS  16   8.493   0.271 -10.233
  107    HB3  CYS  16           HB3      CYS  16   8.512   0.018  -8.491
  108    H    CYS  17           H        CYS  17   6.288   0.549  -8.000
  109    HA   CYS  17           HA       CYS  17   3.920   1.147  -9.602
  110    HB2  CYS  17           HB2      CYS  17   3.243   2.516  -7.633
  111    HB3  CYS  17           HB3      CYS  17   3.525   0.822  -7.241
  112    H    LYS  18           H        LYS  18   3.299   3.563  -9.605
  113    HA   LYS  18           HA       LYS  18   5.007   4.963 -11.252
  114    HB2  LYS  18           HB2      LYS  18   3.674   6.993 -10.593
  115    HB3  LYS  18           HB3      LYS  18   2.716   5.616 -11.121
  116    HG2  LYS  18           HG2      LYS  18   2.429   5.042  -8.678
  117    HG3  LYS  18           HG3      LYS  18   3.121   6.627  -8.322
  118    HD2  LYS  18           HD2      LYS  18   1.326   7.579  -9.856
  119    HD3  LYS  18           HD3      LYS  18   0.566   5.987  -9.776
  120    HE2  LYS  18           HE2      LYS  18   0.076   6.193  -7.523
  121    HE3  LYS  18           HE3      LYS  18   1.327   7.407  -7.258
  122    HZ1  LYS  18           HZ1      LYS  18  -1.118   7.897  -8.863
  123    HZ2  LYS  18           HZ2      LYS  18   0.016   9.041  -8.349
  124    HZ3  LYS  18           HZ3      LYS  18  -0.985   8.277  -7.220
  125    H    HIS  19           H        HIS  19   4.690   5.191  -7.729
  126    HA   HIS  19           HA       HIS  19   6.376   7.325  -7.235
  127    HB2  HIS  19           HB2      HIS  19   6.030   4.813  -5.586
  128    HB3  HIS  19           HB3      HIS  19   6.750   6.312  -5.007
  129    HD1  HIS  19           HD1      HIS  19   5.187   7.959  -3.992
  130    HD2  HIS  19           HD2      HIS  19   3.204   5.152  -6.326
  131    HE1  HIS  19           HE1      HIS  19   2.737   8.408  -3.647
  132    H    LEU  20           H        LEU  20   7.162   4.029  -8.082
  133    HA   LEU  20           HA       LEU  20  10.024   4.604  -7.754
  134    HB2  LEU  20           HB2      LEU  20   8.685   1.954  -8.264
  135    HB3  LEU  20           HB3      LEU  20  10.383   2.219  -7.872
  136    HG   LEU  20           HG       LEU  20   8.334   3.123  -5.912
  137   HD11  LEU  20          HD11      LEU  20   8.205   0.906  -4.922
  138   HD12  LEU  20          HD12      LEU  20   9.162   0.243  -6.246
  139   HD13  LEU  20          HD13      LEU  20   7.554   0.896  -6.560
  140   HD21  LEU  20          HD21      LEU  20  11.181   2.544  -6.018
  141   HD22  LEU  20          HD22      LEU  20  10.381   1.776  -4.647
  142   HD23  LEU  20          HD23      LEU  20  10.265   3.522  -4.870
  143    H    GLY  21           H        GLY  21  11.440   3.517  -9.462
  144    HA2  GLY  21           HA2      GLY  21  10.198   3.554 -12.120
  145    HA3  GLY  21           HA3      GLY  21  11.535   4.651 -11.808
  146    H    CYS  22           H        CYS  22  10.592   1.285 -12.105
  147    HA   CYS  22           HA       CYS  22  12.966  -0.013 -11.602
  148    HB2  CYS  22           HB2      CYS  22  10.675  -0.982 -12.269
  149    HB3  CYS  22           HB3      CYS  22  11.216  -0.776 -13.931
  150    H    ARG  23           H        ARG  23  14.936   0.299 -12.375
  151    HA   ARG  23           HA       ARG  23  15.342   1.672 -14.890
  152    HB2  ARG  23           HB2      ARG  23  17.099   0.806 -12.628
  153    HB3  ARG  23           HB3      ARG  23  17.829   1.181 -14.183
  154    HG2  ARG  23           HG2      ARG  23  16.589   3.399 -14.052
  155    HG3  ARG  23           HG3      ARG  23  16.292   2.998 -12.359
  156    HD2  ARG  23           HD2      ARG  23  18.235   4.177 -12.142
  157    HD3  ARG  23           HD3      ARG  23  18.890   2.555 -12.366
  158    HE   ARG  23           HE       ARG  23  18.786   3.490 -14.885
  159   HH11  ARG  23          HH11      ARG  23  20.062   4.827 -11.935
  160   HH12  ARG  23          HH12      ARG  23  21.305   5.734 -12.730
  161   HH21  ARG  23          HH21      ARG  23  20.420   4.678 -15.943
  162   HH22  ARG  23          HH22      ARG  23  21.508   5.649 -15.010
  163    H    THR  24           H        THR  24  16.348   0.846 -16.708
  164    HA   THR  24           HA       THR  24  16.047  -2.003 -17.090
  165    HB   THR  24           HB       THR  24  16.579  -1.583 -19.425
  166    HG1  THR  24           HG1      THR  24  17.351   0.951 -18.424
  167   HG21  THR  24          HG21      THR  24  14.818   0.699 -18.568
  168   HG22  THR  24          HG22      THR  24  14.300  -0.979 -18.409
  169   HG23  THR  24          HG23      THR  24  14.684  -0.323 -19.999
  170    H    ASP  25           H        ASP  25  18.601   0.221 -16.430
  171    HA   ASP  25           HA       ASP  25  20.658  -1.702 -17.211
  172    HB2  ASP  25           HB2      ASP  25  20.742   1.181 -16.339
  173    HB3  ASP  25           HB3      ASP  25  22.202   0.201 -16.443
  174    H    LEU  26           H        LEU  26  19.323  -0.125 -14.358
  175    HA   LEU  26           HA       LEU  26  21.184  -1.508 -12.602
  176    HB2  LEU  26           HB2      LEU  26  19.026   0.531 -12.191
  177    HB3  LEU  26           HB3      LEU  26  19.725  -0.339 -10.827
  178    HG   LEU  26           HG       LEU  26  20.774   1.818 -11.032
  179   HD11  LEU  26          HD11      LEU  26  23.072   0.469 -12.062
  180   HD12  LEU  26          HD12      LEU  26  22.141  -0.642 -11.059
  181   HD13  LEU  26          HD13      LEU  26  22.685   0.898 -10.394
  182   HD21  LEU  26          HD21      LEU  26  21.985   1.185 -13.665
  183   HD22  LEU  26          HD22      LEU  26  21.572   2.743 -12.950
  184   HD23  LEU  26          HD23      LEU  26  20.307   1.728 -13.645
  185    H    TYR  27           H        TYR  27  17.813  -1.632 -13.561
  186    HA   TYR  27           HA       TYR  27  16.191  -3.196 -13.254
  187    HB2  TYR  27           HB2      TYR  27  18.705  -4.712 -12.924
  188    HB3  TYR  27           HB3      TYR  27  17.271  -5.473 -12.245
  189    HD1  TYR  27           HD1      TYR  27  17.357  -3.329 -15.263
  190    HD2  TYR  27           HD2      TYR  27  17.036  -7.290 -13.741
  191    HE1  TYR  27           HE1      TYR  27  16.730  -4.132 -17.502
  192    HE2  TYR  27           HE2      TYR  27  16.408  -8.104 -15.976
  193    HH   TYR  27           HH       TYR  27  16.655  -6.119 -18.792
  194    H    TYR  28           H        TYR  28  16.091  -1.419 -11.355
  195    HA   TYR  28           HA       TYR  28  15.192  -2.898  -9.056
  196    HB2  TYR  28           HB2      TYR  28  16.675  -2.163  -7.452
  197    HB3  TYR  28           HB3      TYR  28  17.757  -2.339  -8.829
  198    HD1  TYR  28           HD1      TYR  28  17.753  -0.083 -10.371
  199    HD2  TYR  28           HD2      TYR  28  16.993  -0.269  -6.189
  200    HE1  TYR  28           HE1      TYR  28  18.425   2.273 -10.150
  201    HE2  TYR  28           HE2      TYR  28  17.661   2.086  -5.957
  202    HH   TYR  28           HH       TYR  28  18.232   4.115  -8.716
  203    H    CYS  29           H        CYS  29  13.672  -1.795  -7.867
  204    HA   CYS  29           HA       CYS  29  12.338   0.345  -9.122
  205    HB2  CYS  29           HB2      CYS  29  12.088  -0.648  -6.274
  206    HB3  CYS  29           HB3      CYS  29  10.937   0.400  -7.096
  207    H    ALA  30           H        ALA  30  12.972   2.387  -9.224
  208    HA   ALA  30           HA       ALA  30  14.714   3.466  -7.132
  209    HB1  ALA  30           HB1      ALA  30  15.504   4.992  -8.664
  210    HB2  ALA  30           HB2      ALA  30  15.142   3.611  -9.701
  211    HB3  ALA  30           HB3      ALA  30  14.020   4.968  -9.616
  212    H    TRP  31           H        TRP  31  13.472   4.139  -5.463
  213    HA   TRP  31           HA       TRP  31  10.907   5.301  -5.725
  214    HB2  TRP  31           HB2      TRP  31  11.735   4.196  -3.659
  215    HB3  TRP  31           HB3      TRP  31  12.841   5.543  -3.411
  216    HD1  TRP  31           HD1      TRP  31  11.594   8.012  -3.018
  217    HE1  TRP  31           HE1      TRP  31   9.419   8.521  -1.739
  218    HE3  TRP  31           HE3      TRP  31   9.535   3.333  -3.021
  219    HZ2  TRP  31           HZ2      TRP  31   7.134   7.125  -0.848
  220    HZ3  TRP  31           HZ3      TRP  31   7.352   3.004  -1.933
  221    HH2  TRP  31           HH2      TRP  31   6.178   4.862  -0.870
  222    H    ASP  32           H        ASP  32  10.524   7.183  -6.684
  223    HA   ASP  32           HA       ASP  32  11.953   9.549  -5.806
  224    HB2  ASP  32           HB2      ASP  32  13.236   8.611  -7.777
  225    HB3  ASP  32           HB3      ASP  32  11.812   8.937  -8.761
  226    H    GLY  33           H        GLY  33   9.621   8.332  -8.216
  227    HA2  GLY  33           HA2      GLY  33   7.331   8.893  -8.272
  228    HA3  GLY  33           HA3      GLY  33   7.663  10.256  -7.212
  229    H    THR  34           H        THR  34   9.996  10.967  -9.011
  230    HA   THR  34           HA       THR  34   8.524  11.960 -11.349
  231    HB   THR  34           HB       THR  34   9.514  14.195 -11.095
  232    HG1  THR  34           HG1      THR  34  10.606  14.716  -9.179
  233   HG21  THR  34          HG21      THR  34   7.991  15.003  -9.510
  234   HG22  THR  34          HG22      THR  34   8.122  13.556  -8.511
  235   HG23  THR  34          HG23      THR  34   7.269  13.489 -10.052
  236    H    PHE  35           H        PHE  35   9.592  11.406 -13.120
  237    HA   PHE  35           HA       PHE  35  12.307  11.988 -13.573
  238    HB2  PHE  35           HB2      PHE  35  13.179   9.661 -13.742
  239    HB3  PHE  35           HB3      PHE  35  12.788  10.136 -12.092
  240    HD1  PHE  35           HD1      PHE  35  11.226   8.930 -10.823
  241    HD2  PHE  35           HD2      PHE  35  11.578   8.199 -15.001
  242    HE1  PHE  35           HE1      PHE  35   9.790   6.946 -10.594
  243    HE2  PHE  35           HE2      PHE  35  10.142   6.215 -14.778
  244    HZ   PHE  35           HZ       PHE  35   9.246   5.584 -12.573
  Start of MODEL    5
    1    H1   SER   1           H        SER   1   1.080   0.586   0.333
    2    HA   SER   1           HA       SER   1   2.158   0.814  -2.144
    3    HB2  SER   1           HB2      SER   1   3.290  -0.448   0.345
    4    HB3  SER   1           HB3      SER   1   4.251  -0.296  -1.125
    5    HG   SER   1           HG       SER   1   3.654   2.007  -1.018
    6    H    GLU   2           H        GLU   2   1.435  -0.433  -3.794
    7    HA   GLU   2           HA       GLU   2   1.520  -3.346  -3.510
    8    HB2  GLU   2           HB2      GLU   2  -0.456  -1.958  -4.518
    9    HB3  GLU   2           HB3      GLU   2   0.542  -1.933  -5.965
   10    HG2  GLU   2           HG2      GLU   2   0.436  -4.254  -6.220
   11    HG3  GLU   2           HG3      GLU   2  -0.134  -4.496  -4.570
   12    H    CYS   3           H        CYS   3   3.878  -1.484  -3.868
   13    HA   CYS   3           HA       CYS   3   5.029  -2.853  -6.208
   14    HB2  CYS   3           HB2      CYS   3   6.508  -0.749  -6.383
   15    HB3  CYS   3           HB3      CYS   3   4.848  -0.638  -6.957
   16    H    ARG   4           H        ARG   4   7.437  -2.966  -6.126
   17    HA   ARG   4           HA       ARG   4   8.247  -3.942  -3.539
   18    HB2  ARG   4           HB2      ARG   4  10.019  -3.676  -5.961
   19    HB3  ARG   4           HB3      ARG   4  10.160  -4.814  -4.628
   20    HG2  ARG   4           HG2      ARG   4   8.220  -6.017  -5.376
   21    HG3  ARG   4           HG3      ARG   4   7.910  -4.812  -6.627
   22    HD2  ARG   4           HD2      ARG   4   8.976  -6.447  -7.841
   23    HD3  ARG   4           HD3      ARG   4  10.335  -5.418  -7.393
   24    HE   ARG   4           HE       ARG   4  10.294  -7.208  -5.393
   25   HH11  ARG   4          HH11      ARG   4  10.194  -7.568  -8.854
   26   HH12  ARG   4          HH12      ARG   4  10.994  -9.104  -8.848
   27   HH21  ARG   4          HH21      ARG   4  11.349  -9.231  -5.372
   28   HH22  ARG   4          HH22      ARG   4  11.650 -10.049  -6.867
   29    H    TYR   5           H        TYR   5   9.650  -3.037  -2.126
   30    HA   TYR   5           HA       TYR   5  10.081  -0.245  -2.216
   31    HB2  TYR   5           HB2      TYR   5  10.698  -2.455  -0.378
   32    HB3  TYR   5           HB3      TYR   5  11.854  -1.129  -0.325
   33    HD1  TYR   5           HD1      TYR   5   8.944  -2.345   1.107
   34    HD2  TYR   5           HD2      TYR   5  10.640   1.286  -0.323
   35    HE1  TYR   5           HE1      TYR   5   7.405  -1.069   2.539
   36    HE2  TYR   5           HE2      TYR   5   9.106   2.571   1.107
   37    HH   TYR   5           HH       TYR   5   7.675   1.620   3.592
   38    H    LEU   6           H        LEU   6  12.351   0.677  -1.813
   39    HA   LEU   6           HA       LEU   6  13.857   0.648  -4.065
   40    HB2  LEU   6           HB2      LEU   6  14.052   2.065  -1.904
   41    HB3  LEU   6           HB3      LEU   6  15.230   0.849  -1.413
   42    HG   LEU   6           HG       LEU   6  16.279   1.455  -3.775
   43   HD11  LEU   6          HD11      LEU   6  14.375   3.620  -3.202
   44   HD12  LEU   6          HD12      LEU   6  15.084   3.101  -4.731
   45   HD13  LEU   6          HD13      LEU   6  16.002   4.139  -3.641
   46   HD21  LEU   6          HD21      LEU   6  16.751   3.432  -1.593
   47   HD22  LEU   6          HD22      LEU   6  17.911   2.592  -2.622
   48   HD23  LEU   6          HD23      LEU   6  17.108   1.729  -1.309
   49    H    PHE   7           H        PHE   7  15.313  -0.633  -5.033
   50    HA   PHE   7           HA       PHE   7  16.593  -2.454  -5.501
   51    HB2  PHE   7           HB2      PHE   7  17.123  -2.073  -2.571
   52    HB3  PHE   7           HB3      PHE   7  17.811  -3.451  -3.423
   53    HD1  PHE   7           HD1      PHE   7  17.941   0.140  -2.917
   54    HD2  PHE   7           HD2      PHE   7  19.449  -3.110  -5.214
   55    HE1  PHE   7           HE1      PHE   7  19.794   1.557  -3.700
   56    HE2  PHE   7           HE2      PHE   7  21.305  -1.700  -5.999
   57    HZ   PHE   7           HZ       PHE   7  21.479   0.638  -5.244
   58    H    GLY   8           H        GLY   8  14.000  -3.059  -5.514
   59    HA2  GLY   8           HA2      GLY   8  13.519  -5.359  -3.786
   60    HA3  GLY   8           HA3      GLY   8  12.370  -4.636  -4.902
   61    H    GLY   9           H        GLY   9  15.168  -4.926  -6.590
   62    HA2  GLY   9           HA2      GLY   9  15.999  -6.451  -8.104
   63    HA3  GLY   9           HA3      GLY   9  15.179  -7.713  -7.196
   64    H    CYS  10           H        CYS  10  14.002  -4.878  -9.003
   65    HA   CYS  10           HA       CYS  10  11.922  -6.502 -10.199
   66    HB2  CYS  10           HB2      CYS  10  11.005  -4.451 -11.019
   67    HB3  CYS  10           HB3      CYS  10  11.543  -4.154  -9.369
   68    H    LYS  11           H        LYS  11  11.494  -5.825 -12.646
   69    HA   LYS  11           HA       LYS  11  14.028  -6.056 -14.123
   70    HB2  LYS  11           HB2      LYS  11  11.552  -7.745 -14.389
   71    HB3  LYS  11           HB3      LYS  11  12.691  -7.574 -15.719
   72    HG2  LYS  11           HG2      LYS  11  14.442  -8.274 -13.900
   73    HG3  LYS  11           HG3      LYS  11  13.021  -8.952 -13.103
   74    HD2  LYS  11           HD2      LYS  11  13.896  -9.553 -15.928
   75    HD3  LYS  11           HD3      LYS  11  14.164 -10.599 -14.531
   76    HE2  LYS  11           HE2      LYS  11  11.518  -9.787 -15.727
   77    HE3  LYS  11           HE3      LYS  11  12.244 -11.393 -15.736
   78    HZ1  LYS  11           HZ1      LYS  11  10.708 -10.098 -13.692
   79    HZ2  LYS  11           HZ2      LYS  11  12.156 -10.743 -13.100
   80    HZ3  LYS  11           HZ3      LYS  11  11.053 -11.741 -13.905
   81    H    THR  12           H        THR  12  10.628  -5.144 -14.149
   82    HA   THR  12           HA       THR  12  11.233  -3.227 -16.296
   83    HB   THR  12           HB       THR  12   8.999  -3.604 -17.273
   84    HG1  THR  12           HG1      THR  12   7.713  -5.254 -16.532
   85   HG21  THR  12          HG21      THR  12  11.021  -4.811 -18.111
   86   HG22  THR  12          HG22      THR  12   9.503  -5.658 -18.412
   87   HG23  THR  12          HG23      THR  12  10.559  -6.181 -17.101
   88    H    THR  13           H        THR  13   9.637  -1.446 -16.420
   89    HA   THR  13           HA       THR  13   9.317  -0.169 -13.962
   90    HB   THR  13           HB       THR  13   7.635   0.426 -16.394
   91    HG1  THR  13           HG1      THR  13  10.360   1.029 -15.851
   92   HG21  THR  13          HG21      THR  13   7.146   2.386 -15.408
   93   HG22  THR  13          HG22      THR  13   8.791   2.603 -14.810
   94   HG23  THR  13          HG23      THR  13   7.655   1.591 -13.919
   95    H    ALA  14           H        ALA  14   7.141  -2.249 -15.759
   96    HA   ALA  14           HA       ALA  14   4.765  -1.683 -14.369
   97    HB1  ALA  14           HB1      ALA  14   3.887  -3.673 -15.325
   98    HB2  ALA  14           HB2      ALA  14   4.975  -2.963 -16.519
   99    HB3  ALA  14           HB3      ALA  14   5.500  -4.348 -15.560
  100    H    ASP  15           H        ASP  15   7.549  -3.561 -13.520
  101    HA   ASP  15           HA       ASP  15   6.366  -5.204 -11.542
  102    HB2  ASP  15           HB2      ASP  15   9.219  -4.240 -11.833
  103    HB3  ASP  15           HB3      ASP  15   8.694  -5.505 -10.725
  104    H    CYS  16           H        CYS  16   7.478  -1.909 -11.556
  105    HA   CYS  16           HA       CYS  16   6.955  -1.728  -8.662
  106    HB2  CYS  16           HB2      CYS  16   8.469   0.340 -10.235
  107    HB3  CYS  16           HB3      CYS  16   8.504   0.031  -8.503
  108    H    CYS  17           H        CYS  17   6.255   0.600  -8.046
  109    HA   CYS  17           HA       CYS  17   3.906   1.206  -9.665
  110    HB2  CYS  17           HB2      CYS  17   3.225   2.589  -7.708
  111    HB3  CYS  17           HB3      CYS  17   3.499   0.897  -7.303
  112    H    LYS  18           H        LYS  18   3.298   3.639  -9.649
  113    HA   LYS  18           HA       LYS  18   5.013   5.020 -11.312
  114    HB2  LYS  18           HB2      LYS  18   3.696   7.059 -10.665
  115    HB3  LYS  18           HB3      LYS  18   2.721   5.683 -11.169
  116    HG2  LYS  18           HG2      LYS  18   2.484   5.144  -8.696
  117    HG3  LYS  18           HG3      LYS  18   3.145   6.753  -8.397
  118    HD2  LYS  18           HD2      LYS  18   1.331   7.756  -9.669
  119    HD3  LYS  18           HD3      LYS  18   0.690   6.157 -10.051
  120    HE2  LYS  18           HE2      LYS  18   0.477   5.788  -7.561
  121    HE3  LYS  18           HE3      LYS  18   0.834   7.504  -7.362
  122    HZ1  LYS  18           HZ1      LYS  18  -1.149   7.406  -9.252
  123    HZ2  LYS  18           HZ2      LYS  18  -1.329   7.844  -7.628
  124    HZ3  LYS  18           HZ3      LYS  18  -1.610   6.247  -8.110
  125    H    HIS  19           H        HIS  19   4.711   5.250  -7.789
  126    HA   HIS  19           HA       HIS  19   6.412   7.373  -7.300
  127    HB2  HIS  19           HB2      HIS  19   6.055   4.863  -5.650
  128    HB3  HIS  19           HB3      HIS  19   6.786   6.357  -5.073
  129    HD1  HIS  19           HD1      HIS  19   5.238   8.005  -4.041
  130    HD2  HIS  19           HD2      HIS  19   3.229   5.229  -6.391
  131    HE1  HIS  19           HE1      HIS  19   2.792   8.473  -3.689
  132    H    LEU  20           H        LEU  20   7.172   4.070  -8.144
  133    HA   LEU  20           HA       LEU  20  10.040   4.642  -7.849
  134    HB2  LEU  20           HB2      LEU  20   8.734   1.971  -8.320
  135    HB3  LEU  20           HB3      LEU  20  10.410   2.276  -7.869
  136    HG   LEU  20           HG       LEU  20   8.280   3.184  -6.003
  137   HD11  LEU  20          HD11      LEU  20   9.133   0.305  -6.284
  138   HD12  LEU  20          HD12      LEU  20   7.528   0.951  -6.622
  139   HD13  LEU  20          HD13      LEU  20   8.157   0.973  -4.975
  140   HD21  LEU  20          HD21      LEU  20  10.117   3.563  -4.814
  141   HD22  LEU  20          HD22      LEU  20  11.123   2.740  -6.006
  142   HD23  LEU  20          HD23      LEU  20  10.352   1.819  -4.714
  143    H    GLY  21           H        GLY  21  11.437   3.532  -9.551
  144    HA2  GLY  21           HA2      GLY  21  10.161   3.488 -12.193
  145    HA3  GLY  21           HA3      GLY  21  11.484   4.615 -11.928
  146    H    CYS  22           H        CYS  22  10.592   1.238 -12.175
  147    HA   CYS  22           HA       CYS  22  12.972  -0.032 -11.646
  148    HB2  CYS  22           HB2      CYS  22  10.694  -1.022 -12.340
  149    HB3  CYS  22           HB3      CYS  22  11.264  -0.827 -13.994
  150    H    ARG  23           H        ARG  23  14.948   0.292 -12.399
  151    HA   ARG  23           HA       ARG  23  15.374   1.670 -14.905
  152    HB2  ARG  23           HB2      ARG  23  17.090   0.817 -12.616
  153    HB3  ARG  23           HB3      ARG  23  17.859   1.137 -14.165
  154    HG2  ARG  23           HG2      ARG  23  16.546   3.370 -14.070
  155    HG3  ARG  23           HG3      ARG  23  16.419   3.015 -12.346
  156    HD2  ARG  23           HD2      ARG  23  18.355   4.269 -12.435
  157    HD3  ARG  23           HD3      ARG  23  18.982   2.623 -12.507
  158    HE   ARG  23           HE       ARG  23  19.690   3.013 -14.659
  159   HH11  ARG  23          HH11      ARG  23  17.561   5.574 -13.643
  160   HH12  ARG  23          HH12      ARG  23  17.899   6.577 -15.015
  161   HH21  ARG  23          HH21      ARG  23  20.144   4.325 -16.469
  162   HH22  ARG  23          HH22      ARG  23  19.370   5.864 -16.622
  163    H    THR  24           H        THR  24  16.398   0.855 -16.719
  164    HA   THR  24           HA       THR  24  16.097  -1.990 -17.124
  165    HB   THR  24           HB       THR  24  16.682  -1.545 -19.454
  166    HG1  THR  24           HG1      THR  24  17.105   1.139 -18.582
  167   HG21  THR  24          HG21      THR  24  14.890   0.742 -18.831
  168   HG22  THR  24          HG22      THR  24  14.389  -0.859 -18.288
  169   HG23  THR  24          HG23      THR  24  14.694  -0.564 -20.000
  170    H    ASP  25           H        ASP  25  18.648   0.225 -16.425
  171    HA   ASP  25           HA       ASP  25  20.710  -1.695 -17.200
  172    HB2  ASP  25           HB2      ASP  25  20.781   0.889 -17.593
  173    HB3  ASP  25           HB3      ASP  25  21.286   0.948 -15.907
  174    H    LEU  26           H        LEU  26  19.350  -0.136 -14.348
  175    HA   LEU  26           HA       LEU  26  21.191  -1.535 -12.586
  176    HB2  LEU  26           HB2      LEU  26  19.051   0.522 -12.198
  177    HB3  LEU  26           HB3      LEU  26  19.689  -0.378 -10.822
  178    HG   LEU  26           HG       LEU  26  20.773   1.775 -10.985
  179   HD11  LEU  26          HD11      LEU  26  23.043   1.071 -10.897
  180   HD12  LEU  26          HD12      LEU  26  22.712  -0.332 -11.912
  181   HD13  LEU  26          HD13      LEU  26  22.059  -0.254 -10.276
  182   HD21  LEU  26          HD21      LEU  26  22.208   1.209 -13.478
  183   HD22  LEU  26          HD22      LEU  26  21.514   2.718 -12.881
  184   HD23  LEU  26          HD23      LEU  26  20.484   1.529 -13.680
  185    H    TYR  27           H        TYR  27  17.829  -1.646 -13.575
  186    HA   TYR  27           HA       TYR  27  16.201  -3.208 -13.293
  187    HB2  TYR  27           HB2      TYR  27  18.710  -4.732 -12.958
  188    HB3  TYR  27           HB3      TYR  27  17.269  -5.496 -12.296
  189    HD1  TYR  27           HD1      TYR  27  17.386  -3.328 -15.296
  190    HD2  TYR  27           HD2      TYR  27  17.035  -7.299 -13.809
  191    HE1  TYR  27           HE1      TYR  27  16.772  -4.110 -17.545
  192    HE2  TYR  27           HE2      TYR  27  16.420  -8.092 -16.054
  193    HH   TYR  27           HH       TYR  27  16.654  -7.424 -18.370
  194    H    TYR  28           H        TYR  28  16.096  -1.445 -11.377
  195    HA   TYR  28           HA       TYR  28  15.176  -2.945  -9.098
  196    HB2  TYR  28           HB2      TYR  28  16.649  -2.225  -7.477
  197    HB3  TYR  28           HB3      TYR  28  17.740  -2.394  -8.848
  198    HD1  TYR  28           HD1      TYR  28  17.684  -0.105 -10.384
  199    HD2  TYR  28           HD2      TYR  28  17.030  -0.362  -6.188
  200    HE1  TYR  28           HE1      TYR  28  18.361   2.247 -10.140
  201    HE2  TYR  28           HE2      TYR  28  17.705   1.990  -5.932
  202    HH   TYR  28           HH       TYR  28  18.167   4.074  -8.654
  203    H    CYS  29           H        CYS  29  13.705  -1.812  -7.840
  204    HA   CYS  29           HA       CYS  29  12.387   0.355  -9.111
  205    HB2  CYS  29           HB2      CYS  29  12.047  -0.723  -6.304
  206    HB3  CYS  29           HB3      CYS  29  10.926   0.356  -7.131
  207    H    ALA  30           H        ALA  30  13.043   2.392  -9.129
  208    HA   ALA  30           HA       ALA  30  14.722   3.385  -6.943
  209    HB1  ALA  30           HB1      ALA  30  15.374   5.161  -8.419
  210    HB2  ALA  30           HB2      ALA  30  15.507   3.630  -9.288
  211    HB3  ALA  30           HB3      ALA  30  14.138   4.701  -9.590
  212    H    TRP  31           H        TRP  31  13.447   4.066  -5.309
  213    HA   TRP  31           HA       TRP  31  10.901   5.253  -5.637
  214    HB2  TRP  31           HB2      TRP  31  11.627   4.115  -3.562
  215    HB3  TRP  31           HB3      TRP  31  12.770   5.421  -3.262
  216    HD1  TRP  31           HD1      TRP  31  11.585   7.929  -2.885
  217    HE1  TRP  31           HE1      TRP  31   9.397   8.491  -1.652
  218    HE3  TRP  31           HE3      TRP  31   9.396   3.311  -2.971
  219    HZ2  TRP  31           HZ2      TRP  31   7.054   7.153  -0.824
  220    HZ3  TRP  31           HZ3      TRP  31   7.181   3.035  -1.936
  221    HH2  TRP  31           HH2      TRP  31   6.036   4.918  -0.885
  222    H    ASP  32           H        ASP  32  10.600   7.137  -6.628
  223    HA   ASP  32           HA       ASP  32  12.078   9.467  -5.687
  224    HB2  ASP  32           HB2      ASP  32  13.249   8.531  -7.733
  225    HB3  ASP  32           HB3      ASP  32  11.798   8.937  -8.646
  226    H    GLY  33           H        GLY  33   9.662   8.426  -8.101
  227    HA2  GLY  33           HA2      GLY  33   7.416   9.054  -8.204
  228    HA3  GLY  33           HA3      GLY  33   7.701  10.200  -6.903
  229    H    THR  34           H        THR  34   9.831  10.209  -9.625
  230    HA   THR  34           HA       THR  34   8.428  12.534 -10.756
  231    HB   THR  34           HB       THR  34  10.613  13.639 -11.137
  232    HG1  THR  34           HG1      THR  34  12.431  12.812 -10.010
  233   HG21  THR  34          HG21      THR  34  10.453  13.096  -8.200
  234   HG22  THR  34          HG22      THR  34   9.106  13.891  -9.014
  235   HG23  THR  34          HG23      THR  34  10.711  14.621  -9.045
  236    H    PHE  35           H        PHE  35   7.874  12.010 -12.761
  237    HA   PHE  35           HA       PHE  35   9.895  10.941 -14.562
  238    HB2  PHE  35           HB2      PHE  35   7.208   9.603 -14.189
  239    HB3  PHE  35           HB3      PHE  35   8.400   9.181 -15.414
  240    HD1  PHE  35           HD1      PHE  35  10.348   7.905 -14.865
  241    HD2  PHE  35           HD2      PHE  35   7.602   9.088 -11.836
  242    HE1  PHE  35           HE1      PHE  35  11.403   6.328 -13.298
  243    HE2  PHE  35           HE2      PHE  35   8.652   7.513 -10.265
  244    HZ   PHE  35           HZ       PHE  35  10.555   6.131 -10.994
  Start of MODEL    6
    1    H1   SER   1           H        SER   1  -1.766  -0.095  -4.126
    2    HA   SER   1           HA       SER   1   0.849   0.504  -4.922
    3    HB2  SER   1           HB2      SER   1   0.887   1.688  -2.589
    4    HB3  SER   1           HB3      SER   1  -0.221   2.263  -3.834
    5    HG   SER   1           HG       SER   1  -0.942   0.374  -1.847
    6    H    GLU   2           H        GLU   2   0.975  -2.174  -4.633
    7    HA   GLU   2           HA       GLU   2   2.451  -2.624  -2.128
    8    HB2  GLU   2           HB2      GLU   2   2.100  -5.008  -2.505
    9    HB3  GLU   2           HB3      GLU   2   0.566  -4.150  -2.510
   10    HG2  GLU   2           HG2      GLU   2   1.001  -4.092  -5.108
   11    HG3  GLU   2           HG3      GLU   2   1.993  -5.499  -4.734
   12    H    CYS   3           H        CYS   3   3.366  -1.345  -4.712
   13    HA   CYS   3           HA       CYS   3   5.048  -2.937  -6.199
   14    HB2  CYS   3           HB2      CYS   3   6.462  -0.824  -6.442
   15    HB3  CYS   3           HB3      CYS   3   4.767  -0.697  -6.900
   16    H    ARG   4           H        ARG   4   7.409  -3.133  -6.145
   17    HA   ARG   4           HA       ARG   4   8.285  -4.034  -3.563
   18    HB2  ARG   4           HB2      ARG   4  10.015  -3.801  -6.017
   19    HB3  ARG   4           HB3      ARG   4  10.172  -4.925  -4.674
   20    HG2  ARG   4           HG2      ARG   4   8.193  -6.111  -5.379
   21    HG3  ARG   4           HG3      ARG   4   7.913  -4.934  -6.665
   22    HD2  ARG   4           HD2      ARG   4   9.037  -6.391  -7.948
   23    HD3  ARG   4           HD3      ARG   4  10.469  -5.701  -7.184
   24    HE   ARG   4           HE       ARG   4  10.805  -7.701  -6.144
   25   HH11  ARG   4          HH11      ARG   4   7.475  -7.514  -7.139
   26   HH12  ARG   4          HH12      ARG   4   7.105  -9.138  -6.662
   27   HH21  ARG   4          HH21      ARG   4  10.331  -9.840  -5.511
   28   HH22  ARG   4          HH22      ARG   4   8.730 -10.460  -5.734
   29    H    TYR   5           H        TYR   5   9.535  -3.006  -2.129
   30    HA   TYR   5           HA       TYR   5  10.021  -0.251  -2.310
   31    HB2  TYR   5           HB2      TYR   5  10.649  -2.412  -0.419
   32    HB3  TYR   5           HB3      TYR   5  11.799  -1.079  -0.400
   33    HD1  TYR   5           HD1      TYR   5   8.872  -2.275   1.038
   34    HD2  TYR   5           HD2      TYR   5  10.591   1.329  -0.432
   35    HE1  TYR   5           HE1      TYR   5   7.327  -0.973   2.441
   36    HE2  TYR   5           HE2      TYR   5   9.052   2.640   0.968
   37    HH   TYR   5           HH       TYR   5   7.106   2.513   2.182
   38    H    LEU   6           H        LEU   6  12.289   0.688  -1.933
   39    HA   LEU   6           HA       LEU   6  13.792   0.605  -4.187
   40    HB2  LEU   6           HB2      LEU   6  13.988   2.105  -2.104
   41    HB3  LEU   6           HB3      LEU   6  15.130   0.896  -1.519
   42    HG   LEU   6           HG       LEU   6  16.240   1.377  -3.895
   43   HD11  LEU   6          HD11      LEU   6  14.391   3.612  -3.420
   44   HD12  LEU   6          HD12      LEU   6  15.108   3.026  -4.920
   45   HD13  LEU   6          HD13      LEU   6  16.041   4.069  -3.846
   46   HD21  LEU   6          HD21      LEU   6  16.785   1.978  -1.244
   47   HD22  LEU   6          HD22      LEU   6  16.970   3.517  -2.086
   48   HD23  LEU   6          HD23      LEU   6  17.898   2.109  -2.604
   49    H    PHE   7           H        PHE   7  15.327  -0.649  -5.091
   50    HA   PHE   7           HA       PHE   7  16.629  -2.467  -5.504
   51    HB2  PHE   7           HB2      PHE   7  17.046  -2.074  -2.558
   52    HB3  PHE   7           HB3      PHE   7  17.770  -3.454  -3.379
   53    HD1  PHE   7           HD1      PHE   7  17.933   0.103  -2.787
   54    HD2  PHE   7           HD2      PHE   7  19.410  -3.077  -5.200
   55    HE1  PHE   7           HE1      PHE   7  19.811   1.523  -3.505
   56    HE2  PHE   7           HE2      PHE   7  21.291  -1.663  -5.920
   57    HZ   PHE   7           HZ       PHE   7  21.492   0.641  -5.073
   58    H    GLY   8           H        GLY   8  13.948  -2.996  -5.461
   59    HA2  GLY   8           HA2      GLY   8  13.476  -5.343  -3.811
   60    HA3  GLY   8           HA3      GLY   8  12.330  -4.593  -4.912
   61    H    GLY   9           H        GLY   9  15.249  -4.962  -6.478
   62    HA2  GLY   9           HA2      GLY   9  16.020  -6.422  -8.073
   63    HA3  GLY   9           HA3      GLY   9  15.217  -7.699  -7.171
   64    H    CYS  10           H        CYS  10  14.020  -4.861  -8.963
   65    HA   CYS  10           HA       CYS  10  11.927  -6.478 -10.139
   66    HB2  CYS  10           HB2      CYS  10  11.013  -4.429 -10.958
   67    HB3  CYS  10           HB3      CYS  10  11.577  -4.120  -9.320
   68    H    LYS  11           H        LYS  11  11.486  -5.831 -12.586
   69    HA   LYS  11           HA       LYS  11  14.010  -6.079 -14.079
   70    HB2  LYS  11           HB2      LYS  11  11.475  -7.631 -14.641
   71    HB3  LYS  11           HB3      LYS  11  12.970  -7.718 -15.564
   72    HG2  LYS  11           HG2      LYS  11  13.066  -8.322 -12.655
   73    HG3  LYS  11           HG3      LYS  11  12.371  -9.519 -13.750
   74    HD2  LYS  11           HD2      LYS  11  15.081  -8.268 -14.158
   75    HD3  LYS  11           HD3      LYS  11  14.830  -9.782 -13.288
   76    HE2  LYS  11           HE2      LYS  11  13.658 -10.633 -15.353
   77    HE3  LYS  11           HE3      LYS  11  14.239  -9.189 -16.181
   78    HZ1  LYS  11           HZ1      LYS  11  16.448 -10.254 -14.943
   79    HZ2  LYS  11           HZ2      LYS  11  16.085 -10.318 -16.593
   80    HZ3  LYS  11           HZ3      LYS  11  15.630 -11.592 -15.578
   81    H    THR  12           H        THR  12  10.611  -5.154 -14.095
   82    HA   THR  12           HA       THR  12  11.215  -3.243 -16.246
   83    HB   THR  12           HB       THR  12   8.961  -3.625 -17.206
   84    HG1  THR  12           HG1      THR  12   8.008  -4.584 -15.331
   85   HG21  THR  12          HG21      THR  12  10.361  -6.274 -17.176
   86   HG22  THR  12          HG22      THR  12  11.140  -4.865 -17.896
   87   HG23  THR  12          HG23      THR  12   9.592  -5.432 -18.521
   88    H    THR  13           H        THR  13   9.625  -1.463 -16.373
   89    HA   THR  13           HA       THR  13   9.291  -0.182 -13.921
   90    HB   THR  13           HB       THR  13   7.523   0.437 -16.273
   91    HG1  THR  13           HG1      THR  13  10.200   1.351 -16.028
   92   HG21  THR  13          HG21      THR  13   8.251   1.727 -13.811
   93   HG22  THR  13          HG22      THR  13   7.063   2.219 -15.017
   94   HG23  THR  13          HG23      THR  13   8.746   2.720 -15.181
   95    H    ALA  14           H        ALA  14   7.112  -2.265 -15.719
   96    HA   ALA  14           HA       ALA  14   4.744  -1.713 -14.312
   97    HB1  ALA  14           HB1      ALA  14   5.400  -4.416 -15.437
   98    HB2  ALA  14           HB2      ALA  14   3.835  -3.604 -15.343
   99    HB3  ALA  14           HB3      ALA  14   5.057  -3.035 -16.481
  100    H    ASP  15           H        ASP  15   7.536  -3.591 -13.488
  101    HA   ASP  15           HA       ASP  15   6.368  -5.244 -11.511
  102    HB2  ASP  15           HB2      ASP  15   9.221  -4.273 -11.787
  103    HB3  ASP  15           HB3      ASP  15   8.691  -5.569 -10.719
  104    H    CYS  16           H        CYS  16   7.472  -1.947 -11.518
  105    HA   CYS  16           HA       CYS  16   6.972  -1.779  -8.620
  106    HB2  CYS  16           HB2      CYS  16   8.473   0.286 -10.212
  107    HB3  CYS  16           HB3      CYS  16   8.505   0.004  -8.475
  108    H    CYS  17           H        CYS  17   6.273   0.547  -7.989
  109    HA   CYS  17           HA       CYS  17   3.903   1.149  -9.584
  110    HB2  CYS  17           HB2      CYS  17   3.240   2.526  -7.615
  111    HB3  CYS  17           HB3      CYS  17   3.518   0.833  -7.220
  112    H    LYS  18           H        LYS  18   3.285   3.566  -9.588
  113    HA   LYS  18           HA       LYS  18   4.985   4.960 -11.249
  114    HB2  LYS  18           HB2      LYS  18   3.658   6.992 -10.593
  115    HB3  LYS  18           HB3      LYS  18   2.693   5.613 -11.102
  116    HG2  LYS  18           HG2      LYS  18   2.435   5.057  -8.648
  117    HG3  LYS  18           HG3      LYS  18   3.121   6.648  -8.317
  118    HD2  LYS  18           HD2      LYS  18   1.264   7.420 -10.028
  119    HD3  LYS  18           HD3      LYS  18   0.493   5.917  -9.512
  120    HE2  LYS  18           HE2      LYS  18   0.319   6.629  -7.298
  121    HE3  LYS  18           HE3      LYS  18   1.540   7.883  -7.506
  122    HZ1  LYS  18           HZ1      LYS  18  -0.843   8.646  -7.380
  123    HZ2  LYS  18           HZ2      LYS  18  -1.065   7.961  -8.911
  124    HZ3  LYS  18           HZ3      LYS  18   0.047   9.220  -8.700
  125    H    HIS  19           H        HIS  19   4.692   5.194  -7.725
  126    HA   HIS  19           HA       HIS  19   6.384   7.327  -7.246
  127    HB2  HIS  19           HB2      HIS  19   6.044   4.819  -5.590
  128    HB3  HIS  19           HB3      HIS  19   6.770   6.318  -5.018
  129    HD1  HIS  19           HD1      HIS  19   5.217   7.965  -3.991
  130    HD2  HIS  19           HD2      HIS  19   3.214   5.164  -6.317
  131    HE1  HIS  19           HE1      HIS  19   2.770   8.420  -3.633
  132    H    LEU  20           H        LEU  20   7.159   4.028  -8.091
  133    HA   LEU  20           HA       LEU  20  10.024   4.606  -7.792
  134    HB2  LEU  20           HB2      LEU  20   8.704   1.943  -8.277
  135    HB3  LEU  20           HB3      LEU  20  10.392   2.231  -7.861
  136    HG   LEU  20           HG       LEU  20   8.301   3.128  -5.943
  137   HD11  LEU  20          HD11      LEU  20   8.212   0.910  -4.926
  138   HD12  LEU  20          HD12      LEU  20   9.168   0.257  -6.256
  139   HD13  LEU  20          HD13      LEU  20   7.552   0.893  -6.563
  140   HD21  LEU  20          HD21      LEU  20  10.358   1.814  -4.645
  141   HD22  LEU  20          HD22      LEU  20  10.198   3.558  -4.858
  142   HD23  LEU  20          HD23      LEU  20  11.155   2.613  -6.000
  143    H    GLY  21           H        GLY  21  11.425   3.507  -9.502
  144    HA2  GLY  21           HA2      GLY  21  10.156   3.500 -12.147
  145    HA3  GLY  21           HA3      GLY  21  11.483   4.618 -11.865
  146    H    CYS  22           H        CYS  22  10.578   1.241 -12.128
  147    HA   CYS  22           HA       CYS  22  12.963  -0.031 -11.621
  148    HB2  CYS  22           HB2      CYS  22  10.679  -1.020 -12.290
  149    HB3  CYS  22           HB3      CYS  22  11.228  -0.823 -13.951
  150    H    ARG  23           H        ARG  23  14.931   0.291 -12.395
  151    HA   ARG  23           HA       ARG  23  15.328   1.662 -14.913
  152    HB2  ARG  23           HB2      ARG  23  17.082   0.823 -12.641
  153    HB3  ARG  23           HB3      ARG  23  17.820   1.180 -14.197
  154    HG2  ARG  23           HG2      ARG  23  16.535   3.393 -14.085
  155    HG3  ARG  23           HG3      ARG  23  16.305   3.012 -12.377
  156    HD2  ARG  23           HD2      ARG  23  18.238   4.258 -12.307
  157    HD3  ARG  23           HD3      ARG  23  18.885   2.621 -12.414
  158    HE   ARG  23           HE       ARG  23  18.749   3.358 -14.996
  159   HH11  ARG  23          HH11      ARG  23  20.068   4.917 -12.176
  160   HH12  ARG  23          HH12      ARG  23  21.304   5.754 -13.056
  161   HH21  ARG  23          HH21      ARG  23  20.370   4.455 -16.166
  162   HH22  ARG  23          HH22      ARG  23  21.474   5.491 -15.325
  163    H    THR  24           H        THR  24  16.346   0.839 -16.726
  164    HA   THR  24           HA       THR  24  16.063  -2.011 -17.105
  165    HB   THR  24           HB       THR  24  16.484  -1.620 -19.424
  166    HG1  THR  24           HG1      THR  24  17.101   1.096 -18.935
  167   HG21  THR  24          HG21      THR  24  14.991   0.837 -18.536
  168   HG22  THR  24          HG22      THR  24  14.306  -0.782 -18.397
  169   HG23  THR  24          HG23      THR  24  14.733  -0.139 -19.982
  170    H    ASP  25           H        ASP  25  18.603   0.228 -16.441
  171    HA   ASP  25           HA       ASP  25  20.673  -1.686 -17.211
  172    HB2  ASP  25           HB2      ASP  25  20.684   1.213 -16.431
  173    HB3  ASP  25           HB3      ASP  25  22.171   0.270 -16.354
  174    H    LEU  26           H        LEU  26  19.331  -0.101 -14.363
  175    HA   LEU  26           HA       LEU  26  21.191  -1.471 -12.600
  176    HB2  LEU  26           HB2      LEU  26  19.017   0.554 -12.204
  177    HB3  LEU  26           HB3      LEU  26  19.709  -0.312 -10.833
  178    HG   LEU  26           HG       LEU  26  20.746   1.854 -11.036
  179   HD11  LEU  26          HD11      LEU  26  22.126  -0.600 -11.038
  180   HD12  LEU  26          HD12      LEU  26  22.654   0.945 -10.372
  181   HD13  LEU  26          HD13      LEU  26  23.064   0.515 -12.033
  182   HD21  LEU  26          HD21      LEU  26  20.320   1.711 -13.670
  183   HD22  LEU  26          HD22      LEU  26  22.020   1.240 -13.634
  184   HD23  LEU  26          HD23      LEU  26  21.518   2.787 -12.950
  185    H    TYR  27           H        TYR  27  17.826  -1.628 -13.575
  186    HA   TYR  27           HA       TYR  27  16.217  -3.206 -13.271
  187    HB2  TYR  27           HB2      TYR  27  18.743  -4.699 -12.925
  188    HB3  TYR  27           HB3      TYR  27  17.312  -5.470 -12.249
  189    HD1  TYR  27           HD1      TYR  27  17.377  -3.333 -15.271
  190    HD2  TYR  27           HD2      TYR  27  17.116  -7.296 -13.744
  191    HE1  TYR  27           HE1      TYR  27  16.767  -4.148 -17.509
  192    HE2  TYR  27           HE2      TYR  27  16.506  -8.123 -15.979
  193    HH   TYR  27           HH       TYR  27  15.964  -7.557 -18.067
  194    H    TYR  28           H        TYR  28  16.095  -1.423 -11.377
  195    HA   TYR  28           HA       TYR  28  15.190  -2.902  -9.080
  196    HB2  TYR  28           HB2      TYR  28  16.663  -2.160  -7.468
  197    HB3  TYR  28           HB3      TYR  28  17.753  -2.337  -8.838
  198    HD1  TYR  28           HD1      TYR  28  17.709  -0.069 -10.391
  199    HD2  TYR  28           HD2      TYR  28  17.012  -0.278  -6.199
  200    HE1  TYR  28           HE1      TYR  28  18.375   2.288 -10.170
  201    HE2  TYR  28           HE2      TYR  28  17.675   2.079  -5.966
  202    HH   TYR  28           HH       TYR  28  18.091   3.997  -7.103
  203    H    CYS  29           H        CYS  29  13.697  -1.776  -7.857
  204    HA   CYS  29           HA       CYS  29  12.358   0.359  -9.136
  205    HB2  CYS  29           HB2      CYS  29  12.073  -0.642  -6.294
  206    HB3  CYS  29           HB3      CYS  29  10.928   0.397  -7.135
  207    H    ALA  30           H        ALA  30  12.994   2.402  -9.218
  208    HA   ALA  30           HA       ALA  30  14.716   3.463  -7.102
  209    HB1  ALA  30           HB1      ALA  30  14.017   4.829  -9.688
  210    HB2  ALA  30           HB2      ALA  30  15.384   5.142  -8.618
  211    HB3  ALA  30           HB3      ALA  30  15.321   3.649  -9.555
  212    H    TRP  31           H        TRP  31  13.463   4.124  -5.438
  213    HA   TRP  31           HA       TRP  31  10.899   5.282  -5.703
  214    HB2  TRP  31           HB2      TRP  31  11.709   4.174  -3.639
  215    HB3  TRP  31           HB3      TRP  31  12.829   5.509  -3.383
  216    HD1  TRP  31           HD1      TRP  31  11.607   7.990  -2.987
  217    HE1  TRP  31           HE1      TRP  31   9.438   8.518  -1.705
  218    HE3  TRP  31           HE3      TRP  31   9.503   3.331  -3.000
  219    HZ2  TRP  31           HZ2      TRP  31   7.139   7.142  -0.818
  220    HZ3  TRP  31           HZ3      TRP  31   7.316   3.021  -1.913
  221    HH2  TRP  31           HH2      TRP  31   6.162   4.888  -0.844
  222    H    ASP  32           H        ASP  32  10.528   7.159  -6.681
  223    HA   ASP  32           HA       ASP  32  11.941   9.529  -5.782
  224    HB2  ASP  32           HB2      ASP  32  13.232   8.598  -7.752
  225    HB3  ASP  32           HB3      ASP  32  11.810   8.928  -8.738
  226    H    GLY  33           H        GLY  33   9.656   8.361  -8.264
  227    HA2  GLY  33           HA2      GLY  33   7.362   8.904  -8.348
  228    HA3  GLY  33           HA3      GLY  33   7.657  10.225  -7.227
  229    H    THR  34           H        THR  34  10.021  11.031  -8.943
  230    HA   THR  34           HA       THR  34   8.526  12.204 -11.192
  231    HB   THR  34           HB       THR  34   9.970  14.275 -10.859
  232    HG1  THR  34           HG1      THR  34  11.478  13.676  -9.388
  233   HG21  THR  34          HG21      THR  34   8.410  15.280  -9.387
  234   HG22  THR  34          HG22      THR  34   8.068  13.747  -8.584
  235   HG23  THR  34          HG23      THR  34   7.523  14.017 -10.239
  236    H    PHE  35           H        PHE  35   9.399  11.466 -13.008
  237    HA   PHE  35           HA       PHE  35  12.128  10.546 -13.111
  238    HB2  PHE  35           HB2      PHE  35   9.752  10.420 -14.860
  239    HB3  PHE  35           HB3      PHE  35  11.302  10.460 -15.694
  240    HD1  PHE  35           HD1      PHE  35  11.911   8.366 -16.393
  241    HD2  PHE  35           HD2      PHE  35  10.089   8.813 -12.572
  242    HE1  PHE  35           HE1      PHE  35  12.193   5.958 -15.980
  243    HE2  PHE  35           HE2      PHE  35  10.370   6.405 -12.152
  244    HZ   PHE  35           HZ       PHE  35  11.422   4.973 -13.858
  Start of MODEL    7
    1    H1   SER   1           H        SER   1   0.451   0.016  -0.040
    2    HA   SER   1           HA       SER   1   2.443   0.771  -2.056
    3    HB2  SER   1           HB2      SER   1   2.605  -0.441   0.680
    4    HB3  SER   1           HB3      SER   1   3.919  -0.711  -0.464
    5    HG   SER   1           HG       SER   1   3.878   1.261   1.035
    6    H    GLU   2           H        GLU   2   1.493  -0.427  -3.770
    7    HA   GLU   2           HA       GLU   2   1.526  -3.345  -3.469
    8    HB2  GLU   2           HB2      GLU   2   0.239  -3.414  -5.537
    9    HB3  GLU   2           HB3      GLU   2  -0.532  -2.352  -4.369
   10    HG2  GLU   2           HG2      GLU   2   0.355  -0.406  -5.515
   11    HG3  GLU   2           HG3      GLU   2   1.192  -1.449  -6.664
   12    H    CYS   3           H        CYS   3   3.885  -1.485  -3.837
   13    HA   CYS   3           HA       CYS   3   5.028  -2.861  -6.177
   14    HB2  CYS   3           HB2      CYS   3   6.504  -0.756  -6.368
   15    HB3  CYS   3           HB3      CYS   3   4.842  -0.652  -6.938
   16    H    ARG   4           H        ARG   4   7.446  -2.946  -6.104
   17    HA   ARG   4           HA       ARG   4   8.265  -3.914  -3.515
   18    HB2  ARG   4           HB2      ARG   4  10.024  -3.662  -5.948
   19    HB3  ARG   4           HB3      ARG   4  10.175  -4.789  -4.606
   20    HG2  ARG   4           HG2      ARG   4   8.232  -6.001  -5.333
   21    HG3  ARG   4           HG3      ARG   4   7.917  -4.808  -6.596
   22    HD2  ARG   4           HD2      ARG   4   8.979  -6.458  -7.794
   23    HD3  ARG   4           HD3      ARG   4  10.338  -5.419  -7.367
   24    HE   ARG   4           HE       ARG   4  10.312  -7.184  -5.343
   25   HH11  ARG   4          HH11      ARG   4  10.199  -7.587  -8.799
   26   HH12  ARG   4          HH12      ARG   4  11.006  -9.119  -8.779
   27   HH21  ARG   4          HH21      ARG   4  11.376  -9.202  -5.303
   28   HH22  ARG   4          HH22      ARG   4  11.675 -10.037  -6.790
   29    H    TYR   5           H        TYR   5   9.676  -2.998  -2.115
   30    HA   TYR   5           HA       TYR   5  10.102  -0.205  -2.230
   31    HB2  TYR   5           HB2      TYR   5  10.732  -2.399  -0.376
   32    HB3  TYR   5           HB3      TYR   5  11.880  -1.066  -0.336
   33    HD1  TYR   5           HD1      TYR   5   8.975  -2.289   1.104
   34    HD2  TYR   5           HD2      TYR   5  10.657   1.341  -0.342
   35    HE1  TYR   5           HE1      TYR   5   7.431  -1.013   2.531
   36    HE2  TYR   5           HE2      TYR   5   9.118   2.628   1.083
   37    HH   TYR   5           HH       TYR   5   7.825   2.121   3.321
   38    H    LEU   6           H        LEU   6  12.372   0.723  -1.842
   39    HA   LEU   6           HA       LEU   6  13.871   0.677  -4.100
   40    HB2  LEU   6           HB2      LEU   6  14.070   2.101  -1.934
   41    HB3  LEU   6           HB3      LEU   6  15.269   0.898  -1.464
   42    HG   LEU   6           HG       LEU   6  16.258   1.526  -3.856
   43   HD11  LEU   6          HD11      LEU   6  14.351   3.663  -3.216
   44   HD12  LEU   6          HD12      LEU   6  15.054   3.189  -4.762
   45   HD13  LEU   6          HD13      LEU   6  15.968   4.214  -3.655
   46   HD21  LEU   6          HD21      LEU   6  17.870   2.817  -2.742
   47   HD22  LEU   6          HD22      LEU   6  17.263   1.698  -1.522
   48   HD23  LEU   6          HD23      LEU   6  16.714   3.374  -1.532
   49    H    PHE   7           H        PHE   7  15.330  -0.608  -5.059
   50    HA   PHE   7           HA       PHE   7  16.611  -2.430  -5.516
   51    HB2  PHE   7           HB2      PHE   7  17.109  -2.234  -2.541
   52    HB3  PHE   7           HB3      PHE   7  17.959  -3.361  -3.595
   53    HD1  PHE   7           HD1      PHE   7  17.968  -0.124  -2.193
   54    HD2  PHE   7           HD2      PHE   7  19.175  -2.317  -5.635
   55    HE1  PHE   7           HE1      PHE   7  19.611   1.628  -2.728
   56    HE2  PHE   7           HE2      PHE   7  20.821  -0.570  -6.175
   57    HZ   PHE   7           HZ       PHE   7  21.041   1.406  -4.721
   58    H    GLY   8           H        GLY   8  14.013  -3.033  -5.515
   59    HA2  GLY   8           HA2      GLY   8  13.537  -5.323  -3.774
   60    HA3  GLY   8           HA3      GLY   8  12.387  -4.609  -4.896
   61    H    GLY   9           H        GLY   9  15.172  -4.902  -6.594
   62    HA2  GLY   9           HA2      GLY   9  16.007  -6.438  -8.094
   63    HA3  GLY   9           HA3      GLY   9  15.196  -7.696  -7.174
   64    H    CYS  10           H        CYS  10  14.001  -4.880  -9.000
   65    HA   CYS  10           HA       CYS  10  11.923  -6.522 -10.175
   66    HB2  CYS  10           HB2      CYS  10  11.001  -4.478 -11.017
   67    HB3  CYS  10           HB3      CYS  10  11.527  -4.176  -9.364
   68    H    LYS  11           H        LYS  11  11.486  -5.857 -12.627
   69    HA   LYS  11           HA       LYS  11  14.016  -6.099 -14.109
   70    HB2  LYS  11           HB2      LYS  11  11.521  -7.764 -14.403
   71    HB3  LYS  11           HB3      LYS  11  12.713  -7.631 -15.690
   72    HG2  LYS  11           HG2      LYS  11  14.425  -8.418 -13.994
   73    HG3  LYS  11           HG3      LYS  11  13.056  -8.825 -12.957
   74    HD2  LYS  11           HD2      LYS  11  12.337 -10.519 -14.340
   75    HD3  LYS  11           HD3      LYS  11  13.084  -9.808 -15.774
   76    HE2  LYS  11           HE2      LYS  11  14.343 -11.745 -15.219
   77    HE3  LYS  11           HE3      LYS  11  15.315 -10.348 -14.758
   78    HZ1  LYS  11           HZ1      LYS  11  13.970 -12.320 -13.058
   79    HZ2  LYS  11           HZ2      LYS  11  14.135 -10.742 -12.473
   80    HZ3  LYS  11           HZ3      LYS  11  15.508 -11.633 -12.901
   81    H    THR  12           H        THR  12  10.622  -5.167 -14.125
   82    HA   THR  12           HA       THR  12  11.227  -3.264 -16.282
   83    HB   THR  12           HB       THR  12   8.894  -3.637 -17.156
   84    HG1  THR  12           HG1      THR  12   9.002  -6.123 -15.804
   85   HG21  THR  12          HG21      THR  12   9.677  -6.143 -17.922
   86   HG22  THR  12          HG22      THR  12  11.204  -5.420 -17.417
   87   HG23  THR  12          HG23      THR  12  10.229  -4.641 -18.662
   88    H    THR  13           H        THR  13   9.621  -1.486 -16.414
   89    HA   THR  13           HA       THR  13   9.310  -0.199 -13.956
   90    HB   THR  13           HB       THR  13   7.653   0.379 -16.415
   91    HG1  THR  13           HG1      THR  13  10.303   1.224 -15.777
   92   HG21  THR  13          HG21      THR  13   8.613   2.678 -15.018
   93   HG22  THR  13          HG22      THR  13   7.834   1.594 -13.866
   94   HG23  THR  13          HG23      THR  13   6.948   2.161 -15.281
   95    H    ALA  14           H        ALA  14   7.132  -2.283 -15.747
   96    HA   ALA  14           HA       ALA  14   4.757  -1.709 -14.356
   97    HB1  ALA  14           HB1      ALA  14   3.912  -3.785 -15.251
   98    HB2  ALA  14           HB2      ALA  14   4.862  -2.957 -16.485
   99    HB3  ALA  14           HB3      ALA  14   5.548  -4.330 -15.618
  100    H    ASP  15           H        ASP  15   7.540  -3.585 -13.504
  101    HA   ASP  15           HA       ASP  15   6.358  -5.225 -11.524
  102    HB2  ASP  15           HB2      ASP  15   9.210  -4.259 -11.816
  103    HB3  ASP  15           HB3      ASP  15   8.687  -5.521 -10.704
  104    H    CYS  16           H        CYS  16   7.468  -1.930 -11.542
  105    HA   CYS  16           HA       CYS  16   6.943  -1.744  -8.649
  106    HB2  CYS  16           HB2      CYS  16   8.449   0.330 -10.220
  107    HB3  CYS  16           HB3      CYS  16   8.493   0.011  -8.490
  108    H    CYS  17           H        CYS  17   6.240   0.584  -8.036
  109    HA   CYS  17           HA       CYS  17   3.887   1.182  -9.653
  110    HB2  CYS  17           HB2      CYS  17   3.209   2.572  -7.701
  111    HB3  CYS  17           HB3      CYS  17   3.486   0.882  -7.290
  112    H    LYS  18           H        LYS  18   3.275   3.611  -9.655
  113    HA   LYS  18           HA       LYS  18   4.981   4.988 -11.325
  114    HB2  LYS  18           HB2      LYS  18   3.667   7.030 -10.673
  115    HB3  LYS  18           HB3      LYS  18   2.695   5.656 -11.182
  116    HG2  LYS  18           HG2      LYS  18   2.439   5.105  -8.722
  117    HG3  LYS  18           HG3      LYS  18   3.119   6.701  -8.401
  118    HD2  LYS  18           HD2      LYS  18   1.263   7.461 -10.111
  119    HD3  LYS  18           HD3      LYS  18   0.498   5.952  -9.603
  120    HE2  LYS  18           HE2      LYS  18   1.104   6.896  -7.202
  121    HE3  LYS  18           HE3      LYS  18   1.038   8.435  -8.059
  122    HZ1  LYS  18           HZ1      LYS  18  -1.173   6.610  -8.539
  123    HZ2  LYS  18           HZ2      LYS  18  -1.179   8.289  -8.331
  124    HZ3  LYS  18           HZ3      LYS  18  -1.090   7.271  -6.983
  125    H    HIS  19           H        HIS  19   4.693   5.233  -7.802
  126    HA   HIS  19           HA       HIS  19   6.395   7.360  -7.331
  127    HB2  HIS  19           HB2      HIS  19   6.049   4.857  -5.666
  128    HB3  HIS  19           HB3      HIS  19   6.779   6.356  -5.101
  129    HD1  HIS  19           HD1      HIS  19   5.230   8.011  -4.078
  130    HD2  HIS  19           HD2      HIS  19   3.218   5.207  -6.392
  131    HE1  HIS  19           HE1      HIS  19   2.785   8.472  -3.719
  132    H    LEU  20           H        LEU  20   7.155   4.054  -8.163
  133    HA   LEU  20           HA       LEU  20  10.023   4.628  -7.882
  134    HB2  LEU  20           HB2      LEU  20   8.714   1.956  -8.335
  135    HB3  LEU  20           HB3      LEU  20  10.394   2.262  -7.896
  136    HG   LEU  20           HG       LEU  20   8.275   3.176  -6.020
  137   HD11  LEU  20          HD11      LEU  20   9.125   0.298  -6.308
  138   HD12  LEU  20          HD12      LEU  20   7.513   0.945  -6.613
  139   HD13  LEU  20          HD13      LEU  20   8.175   0.964  -4.979
  140   HD21  LEU  20          HD21      LEU  20  10.391   1.793  -4.780
  141   HD22  LEU  20          HD22      LEU  20  10.092   3.530  -4.800
  142   HD23  LEU  20          HD23      LEU  20  11.108   2.795  -6.041
  143    H    GLY  21           H        GLY  21  11.414   3.510  -9.585
  144    HA2  GLY  21           HA2      GLY  21  10.129   3.448 -12.220
  145    HA3  GLY  21           HA3      GLY  21  11.444   4.586 -11.968
  146    H    CYS  22           H        CYS  22  10.576   1.200 -12.187
  147    HA   CYS  22           HA       CYS  22  12.967  -0.049 -11.662
  148    HB2  CYS  22           HB2      CYS  22  10.692  -1.056 -12.345
  149    HB3  CYS  22           HB3      CYS  22  11.259  -0.871 -14.001
  150    H    ARG  23           H        ARG  23  14.938   0.282 -12.426
  151    HA   ARG  23           HA       ARG  23  15.346   1.651 -14.939
  152    HB2  ARG  23           HB2      ARG  23  17.076   0.821 -12.653
  153    HB3  ARG  23           HB3      ARG  23  17.837   1.137 -14.206
  154    HG2  ARG  23           HG2      ARG  23  16.517   3.363 -14.123
  155    HG3  ARG  23           HG3      ARG  23  16.385   3.017 -12.397
  156    HD2  ARG  23           HD2      ARG  23  18.315   4.279 -12.483
  157    HD3  ARG  23           HD3      ARG  23  18.951   2.636 -12.548
  158    HE   ARG  23           HE       ARG  23  19.661   3.022 -14.699
  159   HH11  ARG  23          HH11      ARG  23  17.520   5.577 -13.697
  160   HH12  ARG  23          HH12      ARG  23  17.859   6.577 -15.070
  161   HH21  ARG  23          HH21      ARG  23  20.117   4.330 -16.512
  162   HH22  ARG  23          HH22      ARG  23  19.336   5.866 -16.672
  163    H    THR  24           H        THR  24  16.383   0.834 -16.749
  164    HA   THR  24           HA       THR  24  16.088  -2.013 -17.144
  165    HB   THR  24           HB       THR  24  16.561  -1.607 -19.463
  166    HG1  THR  24           HG1      THR  24  17.371   0.992 -18.610
  167   HG21  THR  24          HG21      THR  24  14.326  -0.965 -18.728
  168   HG22  THR  24          HG22      THR  24  14.884   0.109 -20.011
  169   HG23  THR  24          HG23      THR  24  14.905   0.652 -18.334
  170    H    ASP  25           H        ASP  25  18.634   0.214 -16.456
  171    HA   ASP  25           HA       ASP  25  20.701  -1.707 -17.214
  172    HB2  ASP  25           HB2      ASP  25  20.767   0.875 -17.625
  173    HB3  ASP  25           HB3      ASP  25  21.267   0.947 -15.938
  174    H    LEU  26           H        LEU  26  19.345  -0.125 -14.374
  175    HA   LEU  26           HA       LEU  26  21.186  -1.507 -12.600
  176    HB2  LEU  26           HB2      LEU  26  19.032   0.538 -12.228
  177    HB3  LEU  26           HB3      LEU  26  19.672  -0.350 -10.846
  178    HG   LEU  26           HG       LEU  26  20.743   1.809 -11.020
  179   HD11  LEU  26          HD11      LEU  26  22.735   0.995 -10.421
  180   HD12  LEU  26          HD12      LEU  26  22.990   0.212 -11.981
  181   HD13  LEU  26          HD13      LEU  26  22.028  -0.589 -10.741
  182   HD21  LEU  26          HD21      LEU  26  20.462   1.544 -13.713
  183   HD22  LEU  26          HD22      LEU  26  22.186   1.235 -13.506
  184   HD23  LEU  26          HD23      LEU  26  21.485   2.744 -12.919
  185    H    TYR  27           H        TYR  27  17.824  -1.644 -13.593
  186    HA   TYR  27           HA       TYR  27  16.207  -3.216 -13.303
  187    HB2  TYR  27           HB2      TYR  27  18.724  -4.723 -12.964
  188    HB3  TYR  27           HB3      TYR  27  17.290  -5.491 -12.294
  189    HD1  TYR  27           HD1      TYR  27  17.386  -3.339 -15.306
  190    HD2  TYR  27           HD2      TYR  27  17.069  -7.305 -13.797
  191    HE1  TYR  27           HE1      TYR  27  16.772  -4.138 -17.550
  192    HE2  TYR  27           HE2      TYR  27  16.455  -8.115 -16.036
  193    HH   TYR  27           HH       TYR  27  15.949  -5.883 -18.723
  194    H    TYR  28           H        TYR  28  16.091  -1.444 -11.395
  195    HA   TYR  28           HA       TYR  28  15.178  -2.938  -9.110
  196    HB2  TYR  28           HB2      TYR  28  16.647  -2.203  -7.491
  197    HB3  TYR  28           HB3      TYR  28  17.740  -2.374  -8.861
  198    HD1  TYR  28           HD1      TYR  28  17.658  -0.088 -10.410
  199    HD2  TYR  28           HD2      TYR  28  17.034  -0.338  -6.208
  200    HE1  TYR  28           HE1      TYR  28  18.323   2.268 -10.177
  201    HE2  TYR  28           HE2      TYR  28  17.696   2.019  -5.964
  202    HH   TYR  28           HH       TYR  28  19.377   3.676  -7.981
  203    H    CYS  29           H        CYS  29  13.712  -1.800  -7.845
  204    HA   CYS  29           HA       CYS  29  12.379   0.352  -9.129
  205    HB2  CYS  29           HB2      CYS  29  12.045  -0.716  -6.317
  206    HB3  CYS  29           HB3      CYS  29  10.919   0.354  -7.148
  207    H    ALA  30           H        ALA  30  13.025   2.393  -9.156
  208    HA   ALA  30           HA       ALA  30  14.699   3.403  -6.973
  209    HB1  ALA  30           HB1      ALA  30  15.467   3.629  -9.335
  210    HB2  ALA  30           HB2      ALA  30  14.113   4.724  -9.616
  211    HB3  ALA  30           HB3      ALA  30  15.368   5.154  -8.455
  212    H    TRP  31           H        TRP  31  13.411   4.079  -5.346
  213    HA   TRP  31           HA       TRP  31  10.863   5.254  -5.682
  214    HB2  TRP  31           HB2      TRP  31  11.571   4.141  -3.598
  215    HB3  TRP  31           HB3      TRP  31  12.739   5.429  -3.314
  216    HD1  TRP  31           HD1      TRP  31  11.591   7.966  -2.973
  217    HE1  TRP  31           HE1      TRP  31   9.425   8.576  -1.723
  218    HE3  TRP  31           HE3      TRP  31   9.346   3.374  -2.956
  219    HZ2  TRP  31           HZ2      TRP  31   7.076   7.279  -0.845
  220    HZ3  TRP  31           HZ3      TRP  31   7.140   3.143  -1.890
  221    HH2  TRP  31           HH2      TRP  31   6.031   5.057  -0.857
  222    H    ASP  32           H        ASP  32  10.551   7.130  -6.687
  223    HA   ASP  32           HA       ASP  32  12.027   9.473  -5.771
  224    HB2  ASP  32           HB2      ASP  32  13.171   8.522  -7.829
  225    HB3  ASP  32           HB3      ASP  32  11.709   8.929  -8.723
  226    H    GLY  33           H        GLY  33   9.594   8.424  -8.166
  227    HA2  GLY  33           HA2      GLY  33   7.296   9.016  -8.047
  228    HA3  GLY  33           HA3      GLY  33   7.726  10.364  -7.004
  229    H    THR  34           H        THR  34   9.977  11.013  -8.926
  230    HA   THR  34           HA       THR  34   8.380  12.108 -11.139
  231    HB   THR  34           HB       THR  34   9.728  14.227 -10.961
  232    HG1  THR  34           HG1      THR  34  11.389  13.877  -9.633
  233   HG21  THR  34          HG21      THR  34   8.169  13.824  -8.432
  234   HG22  THR  34          HG22      THR  34   7.361  13.785  -9.999
  235   HG23  THR  34          HG23      THR  34   8.230  15.232  -9.491
  236    H    PHE  35           H        PHE  35   9.333  12.033 -13.097
  237    HA   PHE  35           HA       PHE  35  12.213  11.505 -13.251
  238    HB2  PHE  35           HB2      PHE  35  10.063   9.875 -14.617
  239    HB3  PHE  35           HB3      PHE  35  11.777   9.771 -15.001
  240    HD1  PHE  35           HD1      PHE  35  13.094   9.772 -12.451
  241    HD2  PHE  35           HD2      PHE  35   9.428   7.927 -13.579
  242    HE1  PHE  35           HE1      PHE  35  13.392   8.100 -10.671
  243    HE2  PHE  35           HE2      PHE  35   9.719   6.253 -11.801
  244    HZ   PHE  35           HZ       PHE  35  11.704   6.336 -10.344
  Start of MODEL    8
    1    H1   SER   1           H        SER   1   0.961  -0.039   0.454
    2    HA   SER   1           HA       SER   1   2.257   0.883  -2.005
    3    HB2  SER   1           HB2      SER   1   3.605   1.151  -0.023
    4    HB3  SER   1           HB3      SER   1   3.345  -0.531   0.440
    5    HG   SER   1           HG       SER   1   5.361  -0.294  -0.554
    6    H    GLU   2           H        GLU   2   1.569  -0.347  -3.669
    7    HA   GLU   2           HA       GLU   2   1.549  -3.264  -3.343
    8    HB2  GLU   2           HB2      GLU   2   0.201  -1.386  -5.252
    9    HB3  GLU   2           HB3      GLU   2   0.435  -3.070  -5.699
   10    HG2  GLU   2           HG2      GLU   2  -0.687  -3.597  -3.443
   11    HG3  GLU   2           HG3      GLU   2  -1.230  -1.921  -3.498
   12    H    CYS   3           H        CYS   3   3.925  -1.441  -3.771
   13    HA   CYS   3           HA       CYS   3   4.999  -2.842  -6.129
   14    HB2  CYS   3           HB2      CYS   3   6.514  -0.760  -6.337
   15    HB3  CYS   3           HB3      CYS   3   4.847  -0.633  -6.891
   16    H    ARG   4           H        ARG   4   7.425  -2.947  -6.102
   17    HA   ARG   4           HA       ARG   4   8.274  -3.935  -3.526
   18    HB2  ARG   4           HB2      ARG   4   9.982  -3.731  -5.998
   19    HB3  ARG   4           HB3      ARG   4  10.144  -4.852  -4.653
   20    HG2  ARG   4           HG2      ARG   4   8.162  -6.031  -5.325
   21    HG3  ARG   4           HG3      ARG   4   7.841  -4.842  -6.590
   22    HD2  ARG   4           HD2      ARG   4   8.924  -6.285  -7.924
   23    HD3  ARG   4           HD3      ARG   4  10.379  -5.603  -7.198
   24    HE   ARG   4           HE       ARG   4  10.723  -7.587  -6.112
   25   HH11  ARG   4          HH11      ARG   4   7.450  -7.486  -7.293
   26   HH12  ARG   4          HH12      ARG   4   7.116  -9.139  -6.892
   27   HH21  ARG   4          HH21      ARG   4  10.295  -9.763  -5.578
   28   HH22  ARG   4          HH22      ARG   4   8.734 -10.432  -5.915
   29    H    TYR   5           H        TYR   5   9.578  -2.953  -2.104
   30    HA   TYR   5           HA       TYR   5  10.110  -0.202  -2.276
   31    HB2  TYR   5           HB2      TYR   5  10.716  -2.385  -0.400
   32    HB3  TYR   5           HB3      TYR   5  11.884  -1.070  -0.383
   33    HD1  TYR   5           HD1      TYR   5   8.978  -2.230   1.099
   34    HD2  TYR   5           HD2      TYR   5  10.691   1.357  -0.418
   35    HE1  TYR   5           HE1      TYR   5   7.462  -0.912   2.520
   36    HE2  TYR   5           HE2      TYR   5   9.181   2.684   0.999
   37    HH   TYR   5           HH       TYR   5   6.705   1.133   3.003
   38    H    LEU   6           H        LEU   6  12.398   0.690  -1.917
   39    HA   LEU   6           HA       LEU   6  13.881   0.572  -4.188
   40    HB2  LEU   6           HB2      LEU   6  14.109   2.066  -2.085
   41    HB3  LEU   6           HB3      LEU   6  15.270   0.853  -1.550
   42    HG   LEU   6           HG       LEU   6  16.296   1.366  -3.961
   43   HD11  LEU   6          HD11      LEU   6  16.100   4.065  -3.832
   44   HD12  LEU   6          HD12      LEU   6  14.462   3.584  -3.391
   45   HD13  LEU   6          HD13      LEU   6  15.157   3.045  -4.919
   46   HD21  LEU   6          HD21      LEU   6  16.899   3.371  -1.848
   47   HD22  LEU   6          HD22      LEU   6  17.995   2.416  -2.846
   48   HD23  LEU   6          HD23      LEU   6  17.154   1.664  -1.489
   49    H    PHE   7           H        PHE   7  15.416  -0.695  -5.082
   50    HA   PHE   7           HA       PHE   7  16.688  -2.534  -5.491
   51    HB2  PHE   7           HB2      PHE   7  17.089  -2.202  -2.528
   52    HB3  PHE   7           HB3      PHE   7  17.847  -3.526  -3.407
   53    HD1  PHE   7           HD1      PHE   7  17.965  -0.023  -2.605
   54    HD2  PHE   7           HD2      PHE   7  19.441  -3.005  -5.261
   55    HE1  PHE   7           HE1      PHE   7  19.810   1.471  -3.253
   56    HE2  PHE   7           HE2      PHE   7  21.288  -1.516  -5.912
   57    HZ   PHE   7           HZ       PHE   7  21.475   0.725  -4.907
   58    H    GLY   8           H        GLY   8  13.986  -3.011  -5.430
   59    HA2  GLY   8           HA2      GLY   8  13.467  -5.342  -3.781
   60    HA3  GLY   8           HA3      GLY   8  12.348  -4.589  -4.908
   61    H    GLY   9           H        GLY   9  15.178  -4.934  -6.545
   62    HA2  GLY   9           HA2      GLY   9  15.982  -6.448  -8.079
   63    HA3  GLY   9           HA3      GLY   9  15.164  -7.709  -7.168
   64    H    CYS  10           H        CYS  10  13.986  -4.875  -8.979
   65    HA   CYS  10           HA       CYS  10  11.898  -6.496 -10.160
   66    HB2  CYS  10           HB2      CYS  10  10.984  -4.446 -10.985
   67    HB3  CYS  10           HB3      CYS  10  11.533  -4.142  -9.340
   68    H    LYS  11           H        LYS  11  11.462  -5.849 -12.606
   69    HA   LYS  11           HA       LYS  11  13.991  -6.089 -14.092
   70    HB2  LYS  11           HB2      LYS  11  11.468  -7.621 -14.739
   71    HB3  LYS  11           HB3      LYS  11  13.024  -7.757 -15.548
   72    HG2  LYS  11           HG2      LYS  11  12.554  -8.457 -12.659
   73    HG3  LYS  11           HG3      LYS  11  12.519  -9.619 -13.988
   74    HD2  LYS  11           HD2      LYS  11  14.804  -9.363 -14.422
   75    HD3  LYS  11           HD3      LYS  11  14.895  -7.841 -13.532
   76    HE2  LYS  11           HE2      LYS  11  14.293  -9.219 -11.468
   77    HE3  LYS  11           HE3      LYS  11  14.662 -10.635 -12.450
   78    HZ1  LYS  11           HZ1      LYS  11  16.467  -8.553 -11.441
   79    HZ2  LYS  11           HZ2      LYS  11  16.855  -9.328 -12.895
   80    HZ3  LYS  11           HZ3      LYS  11  16.674 -10.232 -11.476
   81    H    THR  12           H        THR  12  10.594  -5.163 -14.111
   82    HA   THR  12           HA       THR  12  11.198  -3.260 -16.269
   83    HB   THR  12           HB       THR  12   8.905  -3.633 -17.183
   84    HG1  THR  12           HG1      THR  12   8.032  -5.792 -16.539
   85   HG21  THR  12          HG21      THR  12   9.444  -5.706 -18.364
   86   HG22  THR  12          HG22      THR  12  10.690  -6.071 -17.171
   87   HG23  THR  12          HG23      THR  12  10.865  -4.672 -18.231
   88    H    THR  13           H        THR  13   9.587  -1.484 -16.403
   89    HA   THR  13           HA       THR  13   9.283  -0.191 -13.950
   90    HB   THR  13           HB       THR  13   7.609   0.381 -16.397
   91    HG1  THR  13           HG1      THR  13   9.350   1.625 -17.115
   92   HG21  THR  13          HG21      THR  13   6.916   2.158 -15.250
   93   HG22  THR  13          HG22      THR  13   8.585   2.689 -15.040
   94   HG23  THR  13          HG23      THR  13   7.845   1.613 -13.854
   95    H    ALA  14           H        ALA  14   7.094  -2.274 -15.732
   96    HA   ALA  14           HA       ALA  14   4.728  -1.701 -14.327
   97    HB1  ALA  14           HB1      ALA  14   4.963  -3.000 -16.483
   98    HB2  ALA  14           HB2      ALA  14   5.422  -4.385 -15.492
   99    HB3  ALA  14           HB3      ALA  14   3.827  -3.655 -15.302
  100    H    ASP  15           H        ASP  15   7.514  -3.580 -13.493
  101    HA   ASP  15           HA       ASP  15   6.342  -5.222 -11.508
  102    HB2  ASP  15           HB2      ASP  15   9.195  -4.258 -11.804
  103    HB3  ASP  15           HB3      ASP  15   8.670  -5.533 -10.706
  104    H    CYS  16           H        CYS  16   7.453  -1.928 -11.529
  105    HA   CYS  16           HA       CYS  16   6.951  -1.746  -8.632
  106    HB2  CYS  16           HB2      CYS  16   8.447   0.320 -10.230
  107    HB3  CYS  16           HB3      CYS  16   8.488   0.031  -8.493
  108    H    CYS  17           H        CYS  17   6.247   0.580  -8.010
  109    HA   CYS  17           HA       CYS  17   3.877   1.172  -9.604
  110    HB2  CYS  17           HB2      CYS  17   3.208   2.553  -7.646
  111    HB3  CYS  17           HB3      CYS  17   3.510   0.868  -7.233
  112    H    LYS  18           H        LYS  18   3.260   3.601  -9.593
  113    HA   LYS  18           HA       LYS  18   4.949   4.983 -11.281
  114    HB2  LYS  18           HB2      LYS  18   3.626   7.008 -10.671
  115    HB3  LYS  18           HB3      LYS  18   2.637   5.613 -11.083
  116    HG2  LYS  18           HG2      LYS  18   2.526   5.175  -8.568
  117    HG3  LYS  18           HG3      LYS  18   3.139   6.821  -8.387
  118    HD2  LYS  18           HD2      LYS  18   1.223   7.549  -9.878
  119    HD3  LYS  18           HD3      LYS  18   0.567   5.924  -9.669
  120    HE2  LYS  18           HE2      LYS  18   1.224   7.819  -7.416
  121    HE3  LYS  18           HE3      LYS  18  -0.387   7.592  -8.098
  122    HZ1  LYS  18           HZ1      LYS  18  -0.497   6.118  -6.401
  123    HZ2  LYS  18           HZ2      LYS  18   1.168   5.822  -6.374
  124    HZ3  LYS  18           HZ3      LYS  18   0.198   5.088  -7.550
  125    H    HIS  19           H        HIS  19   4.698   5.209  -7.756
  126    HA   HIS  19           HA       HIS  19   6.386   7.349  -7.290
  127    HB2  HIS  19           HB2      HIS  19   6.151   4.836  -5.620
  128    HB3  HIS  19           HB3      HIS  19   6.763   6.391  -5.067
  129    HD1  HIS  19           HD1      HIS  19   4.385   5.110  -3.645
  130    HD2  HIS  19           HD2      HIS  19   4.014   7.801  -6.787
  131    HE1  HIS  19           HE1      HIS  19   2.088   6.107  -3.408
  132    H    LEU  20           H        LEU  20   7.166   4.052  -8.150
  133    HA   LEU  20           HA       LEU  20  10.032   4.664  -7.919
  134    HB2  LEU  20           HB2      LEU  20   8.759   1.966  -8.319
  135    HB3  LEU  20           HB3      LEU  20  10.438   2.307  -7.902
  136    HG   LEU  20           HG       LEU  20   8.364   3.241  -6.002
  137   HD11  LEU  20          HD11      LEU  20   7.563   1.003  -6.645
  138   HD12  LEU  20          HD12      LEU  20   8.128   1.065  -4.976
  139   HD13  LEU  20          HD13      LEU  20   9.140   0.336  -6.224
  140   HD21  LEU  20          HD21      LEU  20  10.488   1.755  -4.846
  141   HD22  LEU  20          HD22      LEU  20  10.184   3.491  -4.761
  142   HD23  LEU  20          HD23      LEU  20  11.171   2.830  -6.066
  143    H    GLY  21           H        GLY  21  11.404   3.546  -9.635
  144    HA2  GLY  21           HA2      GLY  21  10.067   3.437 -12.244
  145    HA3  GLY  21           HA3      GLY  21  11.376   4.591 -12.030
  146    H    CYS  22           H        CYS  22  10.535   1.195 -12.197
  147    HA   CYS  22           HA       CYS  22  12.950  -0.025 -11.705
  148    HB2  CYS  22           HB2      CYS  22  10.669  -1.061 -12.329
  149    HB3  CYS  22           HB3      CYS  22  11.205  -0.894 -13.998
  150    H    ARG  23           H        ARG  23  14.901   0.319 -12.513
  151    HA   ARG  23           HA       ARG  23  15.210   1.593 -15.107
  152    HB2  ARG  23           HB2      ARG  23  17.046   0.995 -12.812
  153    HB3  ARG  23           HB3      ARG  23  17.713   1.392 -14.391
  154    HG2  ARG  23           HG2      ARG  23  16.374   3.499 -14.341
  155    HG3  ARG  23           HG3      ARG  23  15.938   3.110 -12.676
  156    HD2  ARG  23           HD2      ARG  23  17.759   4.444 -12.310
  157    HD3  ARG  23           HD3      ARG  23  18.545   2.869 -12.403
  158    HE   ARG  23           HE       ARG  23  18.642   3.714 -14.954
  159   HH11  ARG  23          HH11      ARG  23  19.505   5.231 -11.942
  160   HH12  ARG  23          HH12      ARG  23  20.761   6.199 -12.639
  161   HH21  ARG  23          HH21      ARG  23  20.292   4.985 -15.884
  162   HH22  ARG  23          HH22      ARG  23  21.207   6.060 -14.881
  163    H    THR  24           H        THR  24  16.296   0.717 -16.856
  164    HA   THR  24           HA       THR  24  16.207  -2.166 -17.033
  165    HB   THR  24           HB       THR  24  15.448  -0.663 -18.897
  166    HG1  THR  24           HG1      THR  24  15.812  -2.399 -20.035
  167   HG21  THR  24          HG21      THR  24  18.408  -0.275 -19.352
  168   HG22  THR  24          HG22      THR  24  17.323   0.958 -18.711
  169   HG23  THR  24          HG23      THR  24  17.094   0.347 -20.349
  170    H    ASP  25           H        ASP  25  18.571   0.257 -16.452
  171    HA   ASP  25           HA       ASP  25  20.791  -1.498 -17.164
  172    HB2  ASP  25           HB2      ASP  25  20.519   1.395 -16.473
  173    HB3  ASP  25           HB3      ASP  25  22.072   0.609 -16.198
  174    H    LEU  26           H        LEU  26  19.217  -0.110 -14.349
  175    HA   LEU  26           HA       LEU  26  21.158  -1.364 -12.563
  176    HB2  LEU  26           HB2      LEU  26  18.883   0.550 -12.126
  177    HB3  LEU  26           HB3      LEU  26  19.724  -0.233 -10.790
  178    HG   LEU  26           HG       LEU  26  20.615   1.964 -11.036
  179   HD11  LEU  26          HD11      LEU  26  22.156  -0.131 -10.801
  180   HD12  LEU  26          HD12      LEU  26  22.858   1.466 -11.060
  181   HD13  LEU  26          HD13      LEU  26  22.706   0.340 -12.409
  182   HD21  LEU  26          HD21      LEU  26  19.879   1.934 -13.575
  183   HD22  LEU  26          HD22      LEU  26  21.569   1.491 -13.811
  184   HD23  LEU  26          HD23      LEU  26  21.158   3.000 -12.996
  185    H    TYR  27           H        TYR  27  17.806  -1.611 -13.562
  186    HA   TYR  27           HA       TYR  27  16.235  -3.228 -13.264
  187    HB2  TYR  27           HB2      TYR  27  18.796  -4.658 -12.901
  188    HB3  TYR  27           HB3      TYR  27  17.375  -5.467 -12.249
  189    HD1  TYR  27           HD1      TYR  27  17.484  -3.316 -15.266
  190    HD2  TYR  27           HD2      TYR  27  17.192  -7.281 -13.748
  191    HE1  TYR  27           HE1      TYR  27  16.922  -4.132 -17.519
  192    HE2  TYR  27           HE2      TYR  27  16.630  -8.106 -15.997
  193    HH   TYR  27           HH       TYR  27  15.650  -6.166 -18.475
  194    H    TYR  28           H        TYR  28  16.062  -1.451 -11.365
  195    HA   TYR  28           HA       TYR  28  15.154  -2.944  -9.088
  196    HB2  TYR  28           HB2      TYR  28  16.619  -2.234  -7.455
  197    HB3  TYR  28           HB3      TYR  28  17.719  -2.403  -8.819
  198    HD1  TYR  28           HD1      TYR  28  17.674  -0.107 -10.350
  199    HD2  TYR  28           HD2      TYR  28  17.009  -0.380  -6.156
  200    HE1  TYR  28           HE1      TYR  28  18.357   2.242 -10.095
  201    HE2  TYR  28           HE2      TYR  28  17.688   1.969  -5.889
  202    HH   TYR  28           HH       TYR  28  19.384   3.644  -8.014
  203    H    CYS  29           H        CYS  29  13.681  -1.809  -7.834
  204    HA   CYS  29           HA       CYS  29  12.367   0.355  -9.106
  205    HB2  CYS  29           HB2      CYS  29  12.037  -0.703  -6.290
  206    HB3  CYS  29           HB3      CYS  29  10.914   0.369  -7.120
  207    H    ALA  30           H        ALA  30  13.024   2.391  -9.138
  208    HA   ALA  30           HA       ALA  30  14.711   3.397  -6.964
  209    HB1  ALA  30           HB1      ALA  30  15.845   4.031  -8.810
  210    HB2  ALA  30           HB2      ALA  30  14.402   4.042  -9.825
  211    HB3  ALA  30           HB3      ALA  30  14.736   5.401  -8.752
  212    H    TRP  31           H        TRP  31  13.436   4.086  -5.334
  213    HA   TRP  31           HA       TRP  31  10.892   5.271  -5.657
  214    HB2  TRP  31           HB2      TRP  31  11.633   4.166  -3.572
  215    HB3  TRP  31           HB3      TRP  31  12.782   5.474  -3.302
  216    HD1  TRP  31           HD1      TRP  31  11.595   7.994  -2.970
  217    HE1  TRP  31           HE1      TRP  31   9.423   8.577  -1.717
  218    HE3  TRP  31           HE3      TRP  31   9.420   3.369  -2.922
  219    HZ2  TRP  31           HZ2      TRP  31   7.096   7.251  -0.827
  220    HZ3  TRP  31           HZ3      TRP  31   7.220   3.111  -1.850
  221    HH2  TRP  31           HH2      TRP  31   6.084   5.013  -0.824
  222    H    ASP  32           H        ASP  32  10.586   7.135  -6.687
  223    HA   ASP  32           HA       ASP  32  12.056   9.486  -5.784
  224    HB2  ASP  32           HB2      ASP  32  13.209   8.496  -7.832
  225    HB3  ASP  32           HB3      ASP  32  11.765   8.940  -8.738
  226    H    GLY  33           H        GLY  33   9.653   8.412  -8.200
  227    HA2  GLY  33           HA2      GLY  33   7.351   9.001  -8.103
  228    HA3  GLY  33           HA3      GLY  33   7.773  10.370  -7.085
  229    H    THR  34           H        THR  34  10.040  10.979  -9.003
  230    HA   THR  34           HA       THR  34   8.451  12.049 -11.235
  231    HB   THR  34           HB       THR  34   9.903  14.128 -11.097
  232    HG1  THR  34           HG1      THR  34  11.482  13.773  -9.681
  233   HG21  THR  34          HG21      THR  34   8.277  13.963  -8.606
  234   HG22  THR  34          HG22      THR  34   7.471  13.707 -10.154
  235   HG23  THR  34          HG23      THR  34   8.323  15.219  -9.843
  236    H    PHE  35           H        PHE  35   9.350  11.803 -13.189
  237    HA   PHE  35           HA       PHE  35  12.231  11.298 -13.380
  238    HB2  PHE  35           HB2      PHE  35  10.085   9.581 -14.643
  239    HB3  PHE  35           HB3      PHE  35  11.808   9.446 -14.977
  240    HD1  PHE  35           HD1      PHE  35  13.133   9.511 -12.491
  241    HD2  PHE  35           HD2      PHE  35   9.343   7.805 -13.407
  242    HE1  PHE  35           HE1      PHE  35  13.379   7.958 -10.598
  243    HE2  PHE  35           HE2      PHE  35   9.582   6.250 -11.515
  244    HZ   PHE  35           HZ       PHE  35  11.602   6.326 -10.107
  Start of MODEL    9
    1    H1   SER   1           H        SER   1   1.021   0.029   0.563
    2    HA   SER   1           HA       SER   1   2.223   0.884  -1.952
    3    HB2  SER   1           HB2      SER   1   3.259  -0.225   0.621
    4    HB3  SER   1           HB3      SER   1   4.222  -0.454  -0.838
    5    HG   SER   1           HG       SER   1   4.583   1.651  -0.955
    6    H    GLU   2           H        GLU   2   1.583  -0.346  -3.623
    7    HA   GLU   2           HA       GLU   2   1.542  -3.263  -3.289
    8    HB2  GLU   2           HB2      GLU   2   0.178  -3.343  -5.289
    9    HB3  GLU   2           HB3      GLU   2  -0.519  -2.202  -4.149
   10    HG2  GLU   2           HG2      GLU   2   0.502  -0.354  -5.410
   11    HG3  GLU   2           HG3      GLU   2   1.119  -1.520  -6.578
   12    H    CYS   3           H        CYS   3   3.918  -1.444  -3.732
   13    HA   CYS   3           HA       CYS   3   4.976  -2.847  -6.095
   14    HB2  CYS   3           HB2      CYS   3   6.494  -0.767  -6.309
   15    HB3  CYS   3           HB3      CYS   3   4.826  -0.638  -6.857
   16    H    ARG   4           H        ARG   4   7.422  -2.906  -6.082
   17    HA   ARG   4           HA       ARG   4   8.277  -3.912  -3.509
   18    HB2  ARG   4           HB2      ARG   4   9.967  -3.716  -5.995
   19    HB3  ARG   4           HB3      ARG   4  10.140  -4.831  -4.647
   20    HG2  ARG   4           HG2      ARG   4   8.155  -6.015  -5.300
   21    HG3  ARG   4           HG3      ARG   4   7.820  -4.830  -6.563
   22    HD2  ARG   4           HD2      ARG   4   8.890  -6.280  -7.901
   23    HD3  ARG   4           HD3      ARG   4  10.350  -5.585  -7.199
   24    HE   ARG   4           HE       ARG   4  10.753  -7.601  -6.225
   25   HH11  ARG   4          HH11      ARG   4   7.348  -7.376  -6.915
   26   HH12  ARG   4          HH12      ARG   4   7.003  -8.991  -6.392
   27   HH21  ARG   4          HH21      ARG   4  10.311  -9.729  -5.533
   28   HH22  ARG   4          HH22      ARG   4   8.689 -10.328  -5.604
   29    H    TYR   5           H        TYR   5   9.599  -2.933  -2.101
   30    HA   TYR   5           HA       TYR   5  10.133  -0.180  -2.287
   31    HB2  TYR   5           HB2      TYR   5  10.744  -2.357  -0.402
   32    HB3  TYR   5           HB3      TYR   5  11.907  -1.037  -0.393
   33    HD1  TYR   5           HD1      TYR   5   8.997  -2.203   1.088
   34    HD2  TYR   5           HD2      TYR   5  10.716   1.385  -0.424
   35    HE1  TYR   5           HE1      TYR   5   7.479  -0.885   2.506
   36    HE2  TYR   5           HE2      TYR   5   9.204   2.712   0.991
   37    HH   TYR   5           HH       TYR   5   7.561   1.520   3.550
   38    H    LEU   6           H        LEU   6  12.425   0.705  -1.938
   39    HA   LEU   6           HA       LEU   6  13.901   0.571  -4.213
   40    HB2  LEU   6           HB2      LEU   6  14.138   2.069  -2.109
   41    HB3  LEU   6           HB3      LEU   6  15.309   0.860  -1.588
   42    HG   LEU   6           HG       LEU   6  16.334   1.363  -3.983
   43   HD11  LEU   6          HD11      LEU   6  14.423   3.528  -3.516
   44   HD12  LEU   6          HD12      LEU   6  15.197   2.995  -5.008
   45   HD13  LEU   6          HD13      LEU   6  16.056   4.071  -3.905
   46   HD21  LEU   6          HD21      LEU   6  17.939   2.718  -2.920
   47   HD22  LEU   6          HD22      LEU   6  17.322   1.647  -1.661
   48   HD23  LEU   6          HD23      LEU   6  16.771   3.321  -1.744
   49    H    PHE   7           H        PHE   7  15.426  -0.709  -5.106
   50    HA   PHE   7           HA       PHE   7  16.696  -2.552  -5.506
   51    HB2  PHE   7           HB2      PHE   7  17.073  -2.376  -2.513
   52    HB3  PHE   7           HB3      PHE   7  17.960  -3.494  -3.543
   53    HD1  PHE   7           HD1      PHE   7  17.938  -0.282  -2.094
   54    HD2  PHE   7           HD2      PHE   7  19.250  -2.424  -5.531
   55    HE1  PHE   7           HE1      PHE   7  19.609   1.467  -2.542
   56    HE2  PHE   7           HE2      PHE   7  20.924  -0.679  -5.984
   57    HZ   PHE   7           HZ       PHE   7  21.106   1.269  -4.488
   58    H    GLY   8           H        GLY   8  13.990  -3.018  -5.439
   59    HA2  GLY   8           HA2      GLY   8  13.461  -5.339  -3.780
   60    HA3  GLY   8           HA3      GLY   8  12.349  -4.589  -4.914
   61    H    GLY   9           H        GLY   9  15.155  -4.937  -6.568
   62    HA2  GLY   9           HA2      GLY   9  15.961  -6.466  -8.088
   63    HA3  GLY   9           HA3      GLY   9  15.146  -7.721  -7.166
   64    H    CYS  10           H        CYS  10  13.962  -4.898  -8.989
   65    HA   CYS  10           HA       CYS  10  11.872  -6.528 -10.158
   66    HB2  CYS  10           HB2      CYS  10  10.967  -4.474 -11.008
   67    HB3  CYS  10           HB3      CYS  10  11.483  -4.183  -9.351
   68    H    LYS  11           H        LYS  11  11.432  -5.861 -12.609
   69    HA   LYS  11           HA       LYS  11  13.957  -6.134 -14.095
   70    HB2  LYS  11           HB2      LYS  11  11.405  -7.684 -14.564
   71    HB3  LYS  11           HB3      LYS  11  12.798  -7.704 -15.637
   72    HG2  LYS  11           HG2      LYS  11  14.123  -8.497 -13.597
   73    HG3  LYS  11           HG3      LYS  11  12.549  -8.819 -12.866
   74    HD2  LYS  11           HD2      LYS  11  11.985 -10.252 -14.799
   75    HD3  LYS  11           HD3      LYS  11  13.602  -9.975 -15.449
   76    HE2  LYS  11           HE2      LYS  11  13.656 -12.067 -14.327
   77    HE3  LYS  11           HE3      LYS  11  14.511 -10.915 -13.303
   78    HZ1  LYS  11           HZ1      LYS  11  12.692 -12.537 -12.345
   79    HZ2  LYS  11           HZ2      LYS  11  11.652 -11.293 -12.825
   80    HZ3  LYS  11           HZ3      LYS  11  12.899 -10.976 -11.726
   81    H    THR  12           H        THR  12  10.582  -5.138 -14.101
   82    HA   THR  12           HA       THR  12  11.220  -3.233 -16.246
   83    HB   THR  12           HB       THR  12   8.938  -3.572 -17.192
   84    HG1  THR  12           HG1      THR  12   7.809  -4.567 -15.584
   85   HG21  THR  12          HG21      THR  12   9.478  -5.966 -18.079
   86   HG22  THR  12          HG22      THR  12  10.987  -5.752 -17.189
   87   HG23  THR  12          HG23      THR  12  10.554  -4.625 -18.474
   88    H    THR  13           H        THR  13   9.608  -1.449 -16.382
   89    HA   THR  13           HA       THR  13   9.306  -0.168 -13.918
   90    HB   THR  13           HB       THR  13   7.598   0.465 -16.319
   91    HG1  THR  13           HG1      THR  13  10.372   0.841 -15.918
   92   HG21  THR  13          HG21      THR  13   8.420   1.835 -13.843
   93   HG22  THR  13          HG22      THR  13   6.977   2.052 -14.834
   94   HG23  THR  13          HG23      THR  13   8.495   2.814 -15.307
   95    H    ALA  14           H        ALA  14   7.110  -2.216 -15.731
   96    HA   ALA  14           HA       ALA  14   4.742  -1.634 -14.333
   97    HB1  ALA  14           HB1      ALA  14   5.480  -4.269 -15.596
   98    HB2  ALA  14           HB2      ALA  14   3.858  -3.652 -15.278
   99    HB3  ALA  14           HB3      ALA  14   4.876  -2.871 -16.486
  100    H    ASP  15           H        ASP  15   7.508  -3.542 -13.502
  101    HA   ASP  15           HA       ASP  15   6.312  -5.201 -11.546
  102    HB2  ASP  15           HB2      ASP  15   9.173  -4.247 -11.804
  103    HB3  ASP  15           HB3      ASP  15   8.631  -5.537 -10.733
  104    H    CYS  16           H        CYS  16   7.441  -1.912 -11.519
  105    HA   CYS  16           HA       CYS  16   6.921  -1.762  -8.624
  106    HB2  CYS  16           HB2      CYS  16   8.429   0.325 -10.176
  107    HB3  CYS  16           HB3      CYS  16   8.471  -0.008  -8.448
  108    H    CYS  17           H        CYS  17   6.225   0.560  -7.979
  109    HA   CYS  17           HA       CYS  17   3.862   1.178  -9.574
  110    HB2  CYS  17           HB2      CYS  17   3.197   2.549  -7.610
  111    HB3  CYS  17           HB3      CYS  17   3.500   0.864  -7.199
  112    H    LYS  18           H        LYS  18   3.257   3.603  -9.569
  113    HA   LYS  18           HA       LYS  18   4.953   4.983 -11.246
  114    HB2  LYS  18           HB2      LYS  18   3.638   7.009 -10.643
  115    HB3  LYS  18           HB3      LYS  18   2.639   5.616 -11.037
  116    HG2  LYS  18           HG2      LYS  18   2.636   5.224  -8.469
  117    HG3  LYS  18           HG3      LYS  18   3.111   6.922  -8.395
  118    HD2  LYS  18           HD2      LYS  18   1.130   7.540  -9.683
  119    HD3  LYS  18           HD3      LYS  18   0.663   5.841  -9.792
  120    HE2  LYS  18           HE2      LYS  18   0.876   7.500  -7.282
  121    HE3  LYS  18           HE3      LYS  18  -0.607   6.932  -8.047
  122    HZ1  LYS  18           HZ1      LYS  18   1.405   5.401  -6.542
  123    HZ2  LYS  18           HZ2      LYS  18   0.451   4.617  -7.699
  124    HZ3  LYS  18           HZ3      LYS  18  -0.279   5.394  -6.386
  125    H    HIS  19           H        HIS  19   4.701   5.203  -7.720
  126    HA   HIS  19           HA       HIS  19   6.402   7.332  -7.250
  127    HB2  HIS  19           HB2      HIS  19   6.166   4.824  -5.576
  128    HB3  HIS  19           HB3      HIS  19   6.753   6.390  -5.025
  129    HD1  HIS  19           HD1      HIS  19   4.389   5.102  -3.601
  130    HD2  HIS  19           HD2      HIS  19   3.991   7.738  -6.787
  131    HE1  HIS  19           HE1      HIS  19   2.076   6.067  -3.391
  132    H    LEU  20           H        LEU  20   7.158   4.032  -8.111
  133    HA   LEU  20           HA       LEU  20  10.029   4.611  -7.857
  134    HB2  LEU  20           HB2      LEU  20   8.728   1.935  -8.310
  135    HB3  LEU  20           HB3      LEU  20  10.406   2.250  -7.873
  136    HG   LEU  20           HG       LEU  20   8.292   3.149  -5.988
  137   HD11  LEU  20          HD11      LEU  20   7.517   0.929  -6.573
  138   HD12  LEU  20          HD12      LEU  20   8.216   0.923  -4.953
  139   HD13  LEU  20          HD13      LEU  20   9.133   0.271  -6.312
  140   HD21  LEU  20          HD21      LEU  20  10.387   1.777  -4.731
  141   HD22  LEU  20          HD22      LEU  20  10.130   3.520  -4.801
  142   HD23  LEU  20          HD23      LEU  20  11.131   2.726  -6.018
  143    H    GLY  21           H        GLY  21  11.401   3.498  -9.579
  144    HA2  GLY  21           HA2      GLY  21  10.089   3.436 -12.200
  145    HA3  GLY  21           HA3      GLY  21  11.398   4.584 -11.959
  146    H    CYS  22           H        CYS  22  10.553   1.188 -12.162
  147    HA   CYS  22           HA       CYS  22  12.967  -0.034 -11.674
  148    HB2  CYS  22           HB2      CYS  22  10.686  -1.065 -12.306
  149    HB3  CYS  22           HB3      CYS  22  11.225  -0.892 -13.973
  150    H    ARG  23           H        ARG  23  14.918   0.315 -12.479
  151    HA   ARG  23           HA       ARG  23  15.226   1.600 -15.068
  152    HB2  ARG  23           HB2      ARG  23  17.086   0.977 -12.794
  153    HB3  ARG  23           HB3      ARG  23  17.719   1.441 -14.367
  154    HG2  ARG  23           HG2      ARG  23  16.392   3.526 -14.237
  155    HG3  ARG  23           HG3      ARG  23  15.898   3.066 -12.606
  156    HD2  ARG  23           HD2      ARG  23  17.692   4.424 -12.150
  157    HD3  ARG  23           HD3      ARG  23  18.476   2.846 -12.216
  158    HE   ARG  23           HE       ARG  23  18.713   3.708 -14.749
  159   HH11  ARG  23          HH11      ARG  23  19.407   5.215 -11.689
  160   HH12  ARG  23          HH12      ARG  23  20.697   6.190 -12.312
  161   HH21  ARG  23          HH21      ARG  23  20.410   4.986 -15.583
  162   HH22  ARG  23          HH22      ARG  23  21.266   6.059 -14.527
  163    H    THR  24           H        THR  24  16.275   0.723 -16.829
  164    HA   THR  24           HA       THR  24  16.222  -2.160 -16.997
  165    HB   THR  24           HB       THR  24  16.583  -1.910 -19.342
  166    HG1  THR  24           HG1      THR  24  17.289   0.788 -18.745
  167   HG21  THR  24          HG21      THR  24  14.341  -1.301 -18.597
  168   HG22  THR  24          HG22      THR  24  14.818  -0.323 -19.985
  169   HG23  THR  24          HG23      THR  24  14.858   0.368 -18.363
  170    H    ASP  25           H        ASP  25  18.551   0.257 -16.362
  171    HA   ASP  25           HA       ASP  25  20.793  -1.437 -17.152
  172    HB2  ASP  25           HB2      ASP  25  20.585   1.171 -17.445
  173    HB3  ASP  25           HB3      ASP  25  21.137   1.195 -15.772
  174    H    LEU  26           H        LEU  26  19.297  -0.066 -14.267
  175    HA   LEU  26           HA       LEU  26  21.230  -1.413 -12.549
  176    HB2  LEU  26           HB2      LEU  26  19.054   0.591 -12.099
  177    HB3  LEU  26           HB3      LEU  26  19.726  -0.318 -10.746
  178    HG   LEU  26           HG       LEU  26  22.006   0.602 -11.734
  179   HD11  LEU  26          HD11      LEU  26  20.015   2.020 -13.231
  180   HD12  LEU  26          HD12      LEU  26  21.772   2.088 -13.361
  181   HD13  LEU  26          HD13      LEU  26  20.932   3.144 -12.227
  182   HD21  LEU  26          HD21      LEU  26  20.570   1.067  -9.521
  183   HD22  LEU  26          HD22      LEU  26  20.492   2.668 -10.258
  184   HD23  LEU  26          HD23      LEU  26  22.057   1.934  -9.906
  185    H    TYR  27           H        TYR  27  17.888  -1.629 -13.554
  186    HA   TYR  27           HA       TYR  27  16.307  -3.241 -13.282
  187    HB2  TYR  27           HB2      TYR  27  18.857  -4.681 -12.888
  188    HB3  TYR  27           HB3      TYR  27  17.428  -5.483 -12.245
  189    HD1  TYR  27           HD1      TYR  27  17.590  -3.347 -15.273
  190    HD2  TYR  27           HD2      TYR  27  17.228  -7.298 -13.736
  191    HE1  TYR  27           HE1      TYR  27  17.045  -4.168 -17.527
  192    HE2  TYR  27           HE2      TYR  27  16.682  -8.129 -15.984
  193    HH   TYR  27           HH       TYR  27  15.713  -6.249 -18.455
  194    H    TYR  28           H        TYR  28  16.107  -1.465 -11.388
  195    HA   TYR  28           HA       TYR  28  15.171  -2.959  -9.120
  196    HB2  TYR  28           HB2      TYR  28  16.607  -2.231  -7.469
  197    HB3  TYR  28           HB3      TYR  28  17.727  -2.398  -8.816
  198    HD1  TYR  28           HD1      TYR  28  17.627  -0.091 -10.367
  199    HD2  TYR  28           HD2      TYR  28  17.026  -0.385  -6.166
  200    HE1  TYR  28           HE1      TYR  28  18.290   2.263 -10.113
  201    HE2  TYR  28           HE2      TYR  28  17.686   1.970  -5.900
  202    HH   TYR  28           HH       TYR  28  18.605   3.750  -6.925
  203    H    CYS  29           H        CYS  29  13.718  -1.797  -7.837
  204    HA   CYS  29           HA       CYS  29  12.375   0.330  -9.150
  205    HB2  CYS  29           HB2      CYS  29  12.060  -0.694  -6.320
  206    HB3  CYS  29           HB3      CYS  29  10.931   0.368  -7.153
  207    H    ALA  30           H        ALA  30  13.019   2.370  -9.218
  208    HA   ALA  30           HA       ALA  30  14.718   3.421  -7.077
  209    HB1  ALA  30           HB1      ALA  30  15.019   5.347  -8.693
  210    HB2  ALA  30           HB2      ALA  30  15.669   3.789  -9.204
  211    HB3  ALA  30           HB3      ALA  30  14.144   4.370  -9.871
  212    H    TRP  31           H        TRP  31  13.445   4.083  -5.429
  213    HA   TRP  31           HA       TRP  31  10.887   5.247  -5.723
  214    HB2  TRP  31           HB2      TRP  31  11.638   4.148  -3.648
  215    HB3  TRP  31           HB3      TRP  31  12.806   5.441  -3.391
  216    HD1  TRP  31           HD1      TRP  31  11.643   7.981  -3.062
  217    HE1  TRP  31           HE1      TRP  31   9.501   8.586  -1.767
  218    HE3  TRP  31           HE3      TRP  31   9.443   3.368  -2.932
  219    HZ2  TRP  31           HZ2      TRP  31   7.187   7.278  -0.816
  220    HZ3  TRP  31           HZ3      TRP  31   7.266   3.130  -1.810
  221    HH2  TRP  31           HH2      TRP  31   6.164   5.046  -0.773
  222    H    ASP  32           H        ASP  32  10.533   7.119  -6.715
  223    HA   ASP  32           HA       ASP  32  11.964   9.486  -5.816
  224    HB2  ASP  32           HB2      ASP  32  13.195   8.522  -7.825
  225    HB3  ASP  32           HB3      ASP  32  11.765   8.922  -8.773
  226    H    GLY  33           H        GLY  33   9.644   8.363  -8.288
  227    HA2  GLY  33           HA2      GLY  33   7.353   8.917  -8.346
  228    HA3  GLY  33           HA3      GLY  33   7.659  10.210  -7.195
  229    H    THR  34           H        THR  34  10.015  11.050  -8.906
  230    HA   THR  34           HA       THR  34   8.469  12.361 -11.049
  231    HB   THR  34           HB       THR  34  10.080  14.300 -10.769
  232    HG1  THR  34           HG1      THR  34  11.667  13.382  -9.490
  233   HG21  THR  34          HG21      THR  34   7.970  13.529  -8.804
  234   HG22  THR  34          HG22      THR  34   7.972  14.820 -10.006
  235   HG23  THR  34          HG23      THR  34   8.906  14.996  -8.521
  236    H    PHE  35           H        PHE  35   9.443  12.593 -13.034
  237    HA   PHE  35           HA       PHE  35  12.197  11.674 -13.360
  238    HB2  PHE  35           HB2      PHE  35   9.766  10.344 -14.464
  239    HB3  PHE  35           HB3      PHE  35  11.203  10.415 -15.480
  240    HD1  PHE  35           HD1      PHE  35  13.434   9.888 -13.926
  241    HD2  PHE  35           HD2      PHE  35   9.505   8.336 -13.407
  242    HE1  PHE  35           HE1      PHE  35  14.364   7.935 -12.751
  243    HE2  PHE  35           HE2      PHE  35  10.428   6.381 -12.232
  244    HZ   PHE  35           HZ       PHE  35  12.860   6.179 -11.902
  Start of MODEL   10
    1    H1   SER   1           H        SER   1   1.179   0.406   0.542
    2    HA   SER   1           HA       SER   1   2.388   0.898  -1.972
    3    HB2  SER   1           HB2      SER   1   3.628  -0.779   0.202
    4    HB3  SER   1           HB3      SER   1   4.428   0.288  -0.952
    5    HG   SER   1           HG       SER   1   4.368   1.527   0.796
    6    H    GLU   2           H        GLU   2   1.502  -0.347  -3.581
    7    HA   GLU   2           HA       GLU   2   1.547  -3.257  -3.274
    8    HB2  GLU   2           HB2      GLU   2  -0.463  -1.928  -4.195
    9    HB3  GLU   2           HB3      GLU   2   0.490  -1.769  -5.665
   10    HG2  GLU   2           HG2      GLU   2   0.393  -4.029  -6.132
   11    HG3  GLU   2           HG3      GLU   2   0.027  -4.463  -4.463
   12    H    CYS   3           H        CYS   3   3.924  -1.441  -3.726
   13    HA   CYS   3           HA       CYS   3   4.973  -2.845  -6.093
   14    HB2  CYS   3           HB2      CYS   3   6.499  -0.769  -6.304
   15    HB3  CYS   3           HB3      CYS   3   4.830  -0.635  -6.851
   16    H    ARG   4           H        ARG   4   7.421  -2.906  -6.086
   17    HA   ARG   4           HA       ARG   4   8.279  -3.925  -3.520
   18    HB2  ARG   4           HB2      ARG   4   9.962  -3.724  -6.010
   19    HB3  ARG   4           HB3      ARG   4  10.138  -4.843  -4.665
   20    HG2  ARG   4           HG2      ARG   4   8.148  -6.021  -5.313
   21    HG3  ARG   4           HG3      ARG   4   7.813  -4.833  -6.575
   22    HD2  ARG   4           HD2      ARG   4   8.887  -6.260  -7.927
   23    HD3  ARG   4           HD3      ARG   4  10.353  -5.606  -7.197
   24    HE   ARG   4           HE       ARG   4  10.695  -7.633  -6.214
   25   HH11  ARG   4          HH11      ARG   4   7.334  -7.377  -7.082
   26   HH12  ARG   4          HH12      ARG   4   6.956  -9.004  -6.624
   27   HH21  ARG   4          HH21      ARG   4  10.211  -9.777  -5.607
   28   HH22  ARG   4          HH22      ARG   4   8.594 -10.369  -5.784
   29    H    TYR   5           H        TYR   5   9.575  -2.934  -2.101
   30    HA   TYR   5           HA       TYR   5  10.124  -0.190  -2.283
   31    HB2  TYR   5           HB2      TYR   5  10.725  -2.370  -0.404
   32    HB3  TYR   5           HB3      TYR   5  11.903  -1.063  -0.396
   33    HD1  TYR   5           HD1      TYR   5   8.994  -2.199   1.100
   34    HD2  TYR   5           HD2      TYR   5  10.728   1.371  -0.430
   35    HE1  TYR   5           HE1      TYR   5   7.495  -0.868   2.525
   36    HE2  TYR   5           HE2      TYR   5   9.235   2.714   0.990
   37    HH   TYR   5           HH       TYR   5   7.229   1.257   3.436
   38    H    LEU   6           H        LEU   6  12.417   0.694  -1.935
   39    HA   LEU   6           HA       LEU   6  13.890   0.562  -4.212
   40    HB2  LEU   6           HB2      LEU   6  14.129   2.059  -2.109
   41    HB3  LEU   6           HB3      LEU   6  15.300   0.849  -1.587
   42    HG   LEU   6           HG       LEU   6  16.312   1.357  -3.995
   43   HD11  LEU   6          HD11      LEU   6  14.417   3.522  -3.497
   44   HD12  LEU   6          HD12      LEU   6  15.206   3.022  -4.992
   45   HD13  LEU   6          HD13      LEU   6  16.052   4.073  -3.857
   46   HD21  LEU   6          HD21      LEU   6  16.802   3.305  -1.764
   47   HD22  LEU   6          HD22      LEU   6  17.952   2.643  -2.925
   48   HD23  LEU   6          HD23      LEU   6  17.296   1.615  -1.649
   49    H    PHE   7           H        PHE   7  15.422  -0.713  -5.104
   50    HA   PHE   7           HA       PHE   7  16.691  -2.556  -5.508
   51    HB2  PHE   7           HB2      PHE   7  17.064  -2.375  -2.514
   52    HB3  PHE   7           HB3      PHE   7  17.944  -3.507  -3.536
   53    HD1  PHE   7           HD1      PHE   7  17.935  -0.276  -2.120
   54    HD2  PHE   7           HD2      PHE   7  19.259  -2.471  -5.518
   55    HE1  PHE   7           HE1      PHE   7  19.621   1.457  -2.578
   56    HE2  PHE   7           HE2      PHE   7  20.948  -0.742  -5.980
   57    HZ   PHE   7           HZ       PHE   7  21.129   1.225  -4.510
   58    H    GLY   8           H        GLY   8  13.977  -3.014  -5.431
   59    HA2  GLY   8           HA2      GLY   8  13.451  -5.342  -3.784
   60    HA3  GLY   8           HA3      GLY   8  12.337  -4.588  -4.916
   61    H    GLY   9           H        GLY   9  15.154  -4.940  -6.560
   62    HA2  GLY   9           HA2      GLY   9  15.956  -6.461  -8.089
   63    HA3  GLY   9           HA3      GLY   9  15.142  -7.718  -7.170
   64    H    CYS  10           H        CYS  10  13.958  -4.893  -8.989
   65    HA   CYS  10           HA       CYS  10  11.865  -6.518 -10.157
   66    HB2  CYS  10           HB2      CYS  10  10.964  -4.463 -11.007
   67    HB3  CYS  10           HB3      CYS  10  11.482  -4.173  -9.349
   68    H    LYS  11           H        LYS  11  11.425  -5.852 -12.608
   69    HA   LYS  11           HA       LYS  11  13.950  -6.128 -14.095
   70    HB2  LYS  11           HB2      LYS  11  11.392  -7.643 -14.651
   71    HB3  LYS  11           HB3      LYS  11  12.868  -7.732 -15.603
   72    HG2  LYS  11           HG2      LYS  11  12.949  -8.393 -12.695
   73    HG3  LYS  11           HG3      LYS  11  12.325  -9.573 -13.849
   74    HD2  LYS  11           HD2      LYS  11  14.375  -9.711 -14.984
   75    HD3  LYS  11           HD3      LYS  11  14.977  -8.221 -14.253
   76    HE2  LYS  11           HE2      LYS  11  14.275 -10.488 -12.460
   77    HE3  LYS  11           HE3      LYS  11  15.755 -10.607 -13.411
   78    HZ1  LYS  11           HZ1      LYS  11  15.604  -9.422 -11.025
   79    HZ2  LYS  11           HZ2      LYS  11  15.369  -8.087 -12.036
   80    HZ3  LYS  11           HZ3      LYS  11  16.762  -9.033 -12.194
   81    H    THR  12           H        THR  12  10.579  -5.124 -14.097
   82    HA   THR  12           HA       THR  12  11.218  -3.221 -16.243
   83    HB   THR  12           HB       THR  12   8.987  -3.560 -17.239
   84    HG1  THR  12           HG1      THR  12   8.826  -5.773 -15.445
   85   HG21  THR  12          HG21      THR  12  10.937  -4.772 -18.134
   86   HG22  THR  12          HG22      THR  12   9.443  -5.690 -18.325
   87   HG23  THR  12          HG23      THR  12  10.583  -6.117 -17.050
   88    H    THR  13           H        THR  13   9.607  -1.435 -16.379
   89    HA   THR  13           HA       THR  13   9.307  -0.154 -13.916
   90    HB   THR  13           HB       THR  13   7.583   0.490 -16.299
   91    HG1  THR  13           HG1      THR  13  10.306   1.246 -15.909
   92   HG21  THR  13          HG21      THR  13   8.551   2.826 -15.299
   93   HG22  THR  13          HG22      THR  13   8.448   1.845 -13.838
   94   HG23  THR  13          HG23      THR  13   7.014   2.102 -14.831
   95    H    ALA  14           H        ALA  14   7.104  -2.195 -15.731
   96    HA   ALA  14           HA       ALA  14   4.739  -1.614 -14.329
   97    HB1  ALA  14           HB1      ALA  14   4.945  -2.876 -16.498
   98    HB2  ALA  14           HB2      ALA  14   5.423  -4.280 -15.544
   99    HB3  ALA  14           HB3      ALA  14   3.827  -3.565 -15.319
  100    H    ASP  15           H        ASP  15   7.503  -3.528 -13.504
  101    HA   ASP  15           HA       ASP  15   6.307  -5.189 -11.550
  102    HB2  ASP  15           HB2      ASP  15   9.168  -4.238 -11.805
  103    HB3  ASP  15           HB3      ASP  15   8.624  -5.533 -10.741
  104    H    CYS  16           H        CYS  16   7.439  -1.902 -11.518
  105    HA   CYS  16           HA       CYS  16   6.922  -1.756  -8.622
  106    HB2  CYS  16           HB2      CYS  16   8.432   0.330 -10.174
  107    HB3  CYS  16           HB3      CYS  16   8.473  -0.001  -8.446
  108    H    CYS  17           H        CYS  17   6.229   0.565  -7.972
  109    HA   CYS  17           HA       CYS  17   3.864   1.187  -9.562
  110    HB2  CYS  17           HB2      CYS  17   3.206   2.559  -7.596
  111    HB3  CYS  17           HB3      CYS  17   3.504   0.872  -7.189
  112    H    LYS  18           H        LYS  18   3.261   3.615  -9.550
  113    HA   LYS  18           HA       LYS  18   4.957   4.995 -11.230
  114    HB2  LYS  18           HB2      LYS  18   3.643   7.021 -10.625
  115    HB3  LYS  18           HB3      LYS  18   2.641   5.628 -11.016
  116    HG2  LYS  18           HG2      LYS  18   2.654   5.239  -8.444
  117    HG3  LYS  18           HG3      LYS  18   3.114   6.942  -8.380
  118    HD2  LYS  18           HD2      LYS  18   1.105   7.334  -9.932
  119    HD3  LYS  18           HD3      LYS  18   0.598   5.711  -9.460
  120    HE2  LYS  18           HE2      LYS  18   0.855   6.510  -7.055
  121    HE3  LYS  18           HE3      LYS  18   0.954   8.139  -7.722
  122    HZ1  LYS  18           HZ1      LYS  18  -1.298   6.340  -8.378
  123    HZ2  LYS  18           HZ2      LYS  18  -1.219   8.025  -8.512
  124    HZ3  LYS  18           HZ3      LYS  18  -1.317   7.301  -6.986
  125    H    HIS  19           H        HIS  19   4.707   5.214  -7.703
  126    HA   HIS  19           HA       HIS  19   6.411   7.340  -7.233
  127    HB2  HIS  19           HB2      HIS  19   6.159   4.830  -5.564
  128    HB3  HIS  19           HB3      HIS  19   6.772   6.386  -5.010
  129    HD1  HIS  19           HD1      HIS  19   4.399   5.136  -3.574
  130    HD2  HIS  19           HD2      HIS  19   4.019   7.773  -6.762
  131    HE1  HIS  19           HE1      HIS  19   2.102   6.133  -3.351
  132    H    LEU  20           H        LEU  20   7.163   4.040  -8.096
  133    HA   LEU  20           HA       LEU  20  10.034   4.615  -7.843
  134    HB2  LEU  20           HB2      LEU  20   8.729   1.940  -8.299
  135    HB3  LEU  20           HB3      LEU  20  10.408   2.251  -7.864
  136    HG   LEU  20           HG       LEU  20   8.295   3.149  -5.976
  137   HD11  LEU  20          HD11      LEU  20   9.142   0.275  -6.294
  138   HD12  LEU  20          HD12      LEU  20   7.527   0.926  -6.570
  139   HD13  LEU  20          HD13      LEU  20   8.212   0.927  -4.945
  140   HD21  LEU  20          HD21      LEU  20  11.138   2.710  -6.008
  141   HD22  LEU  20          HD22      LEU  20  10.382   1.788  -4.708
  142   HD23  LEU  20          HD23      LEU  20  10.143   3.534  -4.808
  143    H    GLY  21           H        GLY  21  11.405   3.504  -9.567
  144    HA2  GLY  21           HA2      GLY  21  10.092   3.448 -12.189
  145    HA3  GLY  21           HA3      GLY  21  11.403   4.594 -11.946
  146    H    CYS  22           H        CYS  22  10.554   1.200 -12.157
  147    HA   CYS  22           HA       CYS  22  12.968  -0.025 -11.671
  148    HB2  CYS  22           HB2      CYS  22  10.685  -1.055 -12.301
  149    HB3  CYS  22           HB3      CYS  22  11.222  -0.880 -13.969
  150    H    ARG  23           H        ARG  23  14.918   0.325 -12.480
  151    HA   ARG  23           HA       ARG  23  15.221   1.607 -15.071
  152    HB2  ARG  23           HB2      ARG  23  17.040   1.046 -12.759
  153    HB3  ARG  23           HB3      ARG  23  17.731   1.395 -14.338
  154    HG2  ARG  23           HG2      ARG  23  16.235   3.483 -14.303
  155    HG3  ARG  23           HG3      ARG  23  16.087   3.165 -12.573
  156    HD2  ARG  23           HD2      ARG  23  17.880   4.725 -12.924
  157    HD3  ARG  23           HD3      ARG  23  18.561   3.182 -12.411
  158    HE   ARG  23           HE       ARG  23  18.690   3.002 -15.088
  159   HH11  ARG  23          HH11      ARG  23  19.666   5.491 -12.858
  160   HH12  ARG  23          HH12      ARG  23  20.971   6.050 -13.851
  161   HH21  ARG  23          HH21      ARG  23  20.405   3.730 -16.404
  162   HH22  ARG  23          HH22      ARG  23  21.390   5.048 -15.868
  163    H    THR  24           H        THR  24  16.274   0.729 -16.829
  164    HA   THR  24           HA       THR  24  16.230  -2.155 -16.988
  165    HB   THR  24           HB       THR  24  16.621  -1.903 -19.340
  166    HG1  THR  24           HG1      THR  24  16.915   0.891 -19.120
  167   HG21  THR  24          HG21      THR  24  14.356  -1.347 -18.551
  168   HG22  THR  24          HG22      THR  24  14.790  -0.430 -19.994
  169   HG23  THR  24          HG23      THR  24  14.830   0.345 -18.410
  170    H    ASP  25           H        ASP  25  18.549   0.269 -16.355
  171    HA   ASP  25           HA       ASP  25  20.798  -1.415 -17.145
  172    HB2  ASP  25           HB2      ASP  25  20.934   1.303 -15.840
  173    HB3  ASP  25           HB3      ASP  25  22.190   0.483 -16.761
  174    H    LEU  26           H        LEU  26  19.299  -0.053 -14.257
  175    HA   LEU  26           HA       LEU  26  21.234  -1.403 -12.542
  176    HB2  LEU  26           HB2      LEU  26  19.056   0.600 -12.086
  177    HB3  LEU  26           HB3      LEU  26  19.730  -0.310 -10.736
  178    HG   LEU  26           HG       LEU  26  22.009   0.613 -11.724
  179   HD11  LEU  26          HD11      LEU  26  20.579   3.096 -12.233
  180   HD12  LEU  26          HD12      LEU  26  20.238   1.846 -13.427
  181   HD13  LEU  26          HD13      LEU  26  21.902   2.344 -13.124
  182   HD21  LEU  26          HD21      LEU  26  22.058   1.979  -9.911
  183   HD22  LEU  26          HD22      LEU  26  20.610   1.059  -9.501
  184   HD23  LEU  26          HD23      LEU  26  20.462   2.656 -10.236
  185    H    TYR  27           H        TYR  27  17.894  -1.620 -13.550
  186    HA   TYR  27           HA       TYR  27  16.314  -3.234 -13.282
  187    HB2  TYR  27           HB2      TYR  27  18.865  -4.671 -12.884
  188    HB3  TYR  27           HB3      TYR  27  17.435  -5.475 -12.244
  189    HD1  TYR  27           HD1      TYR  27  17.600  -3.338 -15.271
  190    HD2  TYR  27           HD2      TYR  27  17.243  -7.290 -13.736
  191    HE1  TYR  27           HE1      TYR  27  17.058  -4.158 -17.525
  192    HE2  TYR  27           HE2      TYR  27  16.702  -8.122 -15.985
  193    HH   TYR  27           HH       TYR  27  16.867  -7.551 -18.248
  194    H    TYR  28           H        TYR  28  16.109  -1.458 -11.388
  195    HA   TYR  28           HA       TYR  28  15.170  -2.953  -9.122
  196    HB2  TYR  28           HB2      TYR  28  16.603  -2.228  -7.468
  197    HB3  TYR  28           HB3      TYR  28  17.725  -2.396  -8.812
  198    HD1  TYR  28           HD1      TYR  28  17.627  -0.086 -10.362
  199    HD2  TYR  28           HD2      TYR  28  17.022  -0.384  -6.161
  200    HE1  TYR  28           HE1      TYR  28  18.294   2.267 -10.105
  201    HE2  TYR  28           HE2      TYR  28  17.685   1.968  -5.892
  202    HH   TYR  28           HH       TYR  28  17.662   4.145  -8.069
  203    H    CYS  29           H        CYS  29  13.719  -1.789  -7.837
  204    HA   CYS  29           HA       CYS  29  12.376   0.338  -9.151
  205    HB2  CYS  29           HB2      CYS  29  12.063  -0.680  -6.319
  206    HB3  CYS  29           HB3      CYS  29  10.932   0.379  -7.156
  207    H    ALA  30           H        ALA  30  13.021   2.378  -9.222
  208    HA   ALA  30           HA       ALA  30  14.726   3.429  -7.087
  209    HB1  ALA  30           HB1      ALA  30  14.233   4.191  -9.927
  210    HB2  ALA  30           HB2      ALA  30  14.827   5.409  -8.798
  211    HB3  ALA  30           HB3      ALA  30  15.757   3.937  -9.076
  212    H    TRP  31           H        TRP  31  13.460   4.087  -5.431
  213    HA   TRP  31           HA       TRP  31  10.902   5.249  -5.713
  214    HB2  TRP  31           HB2      TRP  31  11.665   4.145  -3.643
  215    HB3  TRP  31           HB3      TRP  31  12.828   5.443  -3.387
  216    HD1  TRP  31           HD1      TRP  31  11.659   7.974  -3.038
  217    HE1  TRP  31           HE1      TRP  31   9.517   8.566  -1.738
  218    HE3  TRP  31           HE3      TRP  31   9.468   3.356  -2.936
  219    HZ2  TRP  31           HZ2      TRP  31   7.206   7.249  -0.794
  220    HZ3  TRP  31           HZ3      TRP  31   7.292   3.107  -1.814
  221    HH2  TRP  31           HH2      TRP  31   6.187   5.015  -0.766
  222    H    ASP  32           H        ASP  32  10.549   7.123  -6.706
  223    HA   ASP  32           HA       ASP  32  11.979   9.488  -5.802
  224    HB2  ASP  32           HB2      ASP  32  13.210   8.534  -7.813
  225    HB3  ASP  32           HB3      ASP  32  11.779   8.924  -8.760
  226    H    GLY  33           H        GLY  33   9.656   8.369  -8.274
  227    HA2  GLY  33           HA2      GLY  33   7.351   8.919  -8.277
  228    HA3  GLY  33           HA3      GLY  33   7.696  10.258  -7.192
  229    H    THR  34           H        THR  34  10.021  10.996  -8.990
  230    HA   THR  34           HA       THR  34   8.459  12.185 -11.189
  231    HB   THR  34           HB       THR  34   9.597  14.267 -10.970
  232    HG1  THR  34           HG1      THR  34  11.285  14.560  -9.490
  233   HG21  THR  34          HG21      THR  34   9.135  13.691  -8.084
  234   HG22  THR  34          HG22      THR  34   7.784  13.505  -9.202
  235   HG23  THR  34          HG23      THR  34   8.602  15.060  -9.061
  236    H    PHE  35           H        PHE  35   9.660  12.711 -13.102
  237    HA   PHE  35           HA       PHE  35  12.360  11.677 -13.345
  238    HB2  PHE  35           HB2      PHE  35   9.970  10.369 -14.560
  239    HB3  PHE  35           HB3      PHE  35  11.449  10.438 -15.512
  240    HD1  PHE  35           HD1      PHE  35  13.609   9.880 -13.877
  241    HD2  PHE  35           HD2      PHE  35   9.649   8.363 -13.518
  242    HE1  PHE  35           HE1      PHE  35  14.475   7.913 -12.678
  243    HE2  PHE  35           HE2      PHE  35  10.508   6.394 -12.318
  244    HZ   PHE  35           HZ       PHE  35  12.923   6.168 -11.896
  Start of MODEL   11
    1    H1   SER   1           H        SER   1   0.810   0.126   0.386
    2    HA   SER   1           HA       SER   1   2.367   0.887  -1.966
    3    HB2  SER   1           HB2      SER   1   4.236  -0.290  -0.720
    4    HB3  SER   1           HB3      SER   1   3.571   1.131   0.083
    5    HG   SER   1           HG       SER   1   2.569  -1.442   0.641
    6    H    GLU   2           H        GLU   2   1.584  -0.343  -3.631
    7    HA   GLU   2           HA       GLU   2   1.556  -3.258  -3.276
    8    HB2  GLU   2           HB2      GLU   2   0.203  -3.350  -5.294
    9    HB3  GLU   2           HB3      GLU   2  -0.514  -2.237  -4.136
   10    HG2  GLU   2           HG2      GLU   2   0.120  -0.358  -5.374
   11    HG3  GLU   2           HG3      GLU   2   1.279  -1.274  -6.335
   12    H    CYS   3           H        CYS   3   3.925  -1.433  -3.737
   13    HA   CYS   3           HA       CYS   3   4.981  -2.845  -6.096
   14    HB2  CYS   3           HB2      CYS   3   6.499  -0.766  -6.315
   15    HB3  CYS   3           HB3      CYS   3   4.831  -0.638  -6.863
   16    H    ARG   4           H        ARG   4   7.421  -2.920  -6.087
   17    HA   ARG   4           HA       ARG   4   8.281  -3.920  -3.515
   18    HB2  ARG   4           HB2      ARG   4   9.970  -3.721  -6.003
   19    HB3  ARG   4           HB3      ARG   4  10.146  -4.836  -4.655
   20    HG2  ARG   4           HG2      ARG   4   8.160  -6.022  -5.307
   21    HG3  ARG   4           HG3      ARG   4   7.824  -4.836  -6.570
   22    HD2  ARG   4           HD2      ARG   4   8.896  -6.280  -7.911
   23    HD3  ARG   4           HD3      ARG   4  10.357  -5.591  -7.202
   24    HE   ARG   4           HE       ARG   4  10.717  -7.570  -6.107
   25   HH11  ARG   4          HH11      ARG   4   7.439  -7.491  -7.281
   26   HH12  ARG   4          HH12      ARG   4   7.117  -9.145  -6.878
   27   HH21  ARG   4          HH21      ARG   4  10.303  -9.748  -5.572
   28   HH22  ARG   4          HH22      ARG   4   8.746 -10.427  -5.904
   29    H    TYR   5           H        TYR   5   9.590  -2.932  -2.103
   30    HA   TYR   5           HA       TYR   5  10.127  -0.182  -2.288
   31    HB2  TYR   5           HB2      TYR   5  10.733  -2.359  -0.404
   32    HB3  TYR   5           HB3      TYR   5  11.904  -1.046  -0.397
   33    HD1  TYR   5           HD1      TYR   5   8.989  -2.193   1.089
   34    HD2  TYR   5           HD2      TYR   5  10.722   1.383  -0.432
   35    HE1  TYR   5           HE1      TYR   5   7.482  -0.865   2.508
   36    HE2  TYR   5           HE2      TYR   5   9.221   2.720   0.985
   37    HH   TYR   5           HH       TYR   5   7.651   1.625   3.548
   38    H    LEU   6           H        LEU   6  12.418   0.705  -1.938
   39    HA   LEU   6           HA       LEU   6  13.894   0.574  -4.213
   40    HB2  LEU   6           HB2      LEU   6  14.129   2.066  -2.101
   41    HB3  LEU   6           HB3      LEU   6  15.308   0.859  -1.591
   42    HG   LEU   6           HG       LEU   6  16.295   1.389  -4.012
   43   HD11  LEU   6          HD11      LEU   6  14.436   3.576  -3.428
   44   HD12  LEU   6          HD12      LEU   6  15.146   3.063  -4.959
   45   HD13  LEU   6          HD13      LEU   6  16.065   4.093  -3.861
   46   HD21  LEU   6          HD21      LEU   6  18.014   2.308  -2.879
   47   HD22  LEU   6          HD22      LEU   6  17.091   1.785  -1.470
   48   HD23  LEU   6          HD23      LEU   6  16.981   3.456  -2.026
   49    H    PHE   7           H        PHE   7  15.427  -0.700  -5.105
   50    HA   PHE   7           HA       PHE   7  16.695  -2.544  -5.509
   51    HB2  PHE   7           HB2      PHE   7  17.100  -2.207  -2.546
   52    HB3  PHE   7           HB3      PHE   7  17.857  -3.530  -3.426
   53    HD1  PHE   7           HD1      PHE   7  17.943  -0.005  -2.667
   54    HD2  PHE   7           HD2      PHE   7  19.480  -3.030  -5.238
   55    HE1  PHE   7           HE1      PHE   7  19.784   1.490  -3.318
   56    HE2  PHE   7           HE2      PHE   7  21.326  -1.539  -5.893
   57    HZ   PHE   7           HZ       PHE   7  21.479   0.724  -4.933
   58    H    GLY   8           H        GLY   8  13.988  -3.011  -5.436
   59    HA2  GLY   8           HA2      GLY   8  13.464  -5.333  -3.779
   60    HA3  GLY   8           HA3      GLY   8  12.349  -4.585  -4.913
   61    H    GLY   9           H        GLY   9  15.159  -4.932  -6.563
   62    HA2  GLY   9           HA2      GLY   9  15.968  -6.460  -8.083
   63    HA3  GLY   9           HA3      GLY   9  15.153  -7.715  -7.161
   64    H    CYS  10           H        CYS  10  13.967  -4.895  -8.986
   65    HA   CYS  10           HA       CYS  10  11.878  -6.527 -10.154
   66    HB2  CYS  10           HB2      CYS  10  10.970  -4.476 -11.003
   67    HB3  CYS  10           HB3      CYS  10  11.492  -4.180  -9.348
   68    H    LYS  11           H        LYS  11  11.439  -5.862 -12.606
   69    HA   LYS  11           HA       LYS  11  13.965  -6.132 -14.092
   70    HB2  LYS  11           HB2      LYS  11  11.434  -7.740 -14.437
   71    HB3  LYS  11           HB3      LYS  11  12.694  -7.666 -15.662
   72    HG2  LYS  11           HG2      LYS  11  14.196  -8.356 -13.570
   73    HG3  LYS  11           HG3      LYS  11  12.659  -9.055 -13.055
   74    HD2  LYS  11           HD2      LYS  11  14.024  -9.571 -15.697
   75    HD3  LYS  11           HD3      LYS  11  14.027 -10.664 -14.311
   76    HE2  LYS  11           HE2      LYS  11  11.453 -10.507 -14.483
   77    HE3  LYS  11           HE3      LYS  11  11.755  -9.889 -16.105
   78    HZ1  LYS  11           HZ1      LYS  11  12.782 -11.887 -16.738
   79    HZ2  LYS  11           HZ2      LYS  11  11.392 -12.358 -15.897
   80    HZ3  LYS  11           HZ3      LYS  11  12.905 -12.443 -15.145
   81    H    THR  12           H        THR  12  10.584  -5.154 -14.103
   82    HA   THR  12           HA       THR  12  11.213  -3.252 -16.254
   83    HB   THR  12           HB       THR  12   8.770  -3.620 -17.015
   84    HG1  THR  12           HG1      THR  12   9.232  -6.183 -15.874
   85   HG21  THR  12          HG21      THR  12  10.798  -5.802 -17.523
   86   HG22  THR  12          HG22      THR  12  10.775  -4.232 -18.327
   87   HG23  THR  12          HG23      THR  12   9.442  -5.364 -18.563
   88    H    THR  13           H        THR  13   9.604  -1.468 -16.391
   89    HA   THR  13           HA       THR  13   9.304  -0.181 -13.932
   90    HB   THR  13           HB       THR  13   7.558   0.463 -16.295
   91    HG1  THR  13           HG1      THR  13  10.242   1.351 -16.009
   92   HG21  THR  13          HG21      THR  13   8.550   2.799 -15.359
   93   HG22  THR  13          HG22      THR  13   8.536   1.841 -13.879
   94   HG23  THR  13          HG23      THR  13   7.046   2.074 -14.792
   95    H    ALA  14           H        ALA  14   7.108  -2.240 -15.733
   96    HA   ALA  14           HA       ALA  14   4.740  -1.655 -14.333
   97    HB1  ALA  14           HB1      ALA  14   5.534  -4.244 -15.661
   98    HB2  ALA  14           HB2      ALA  14   3.897  -3.758 -15.221
   99    HB3  ALA  14           HB3      ALA  14   4.778  -2.866 -16.462
  100    H    ASP  15           H        ASP  15   7.510  -3.555 -13.500
  101    HA   ASP  15           HA       ASP  15   6.320  -5.212 -11.539
  102    HB2  ASP  15           HB2      ASP  15   9.178  -4.255 -11.805
  103    HB3  ASP  15           HB3      ASP  15   8.642  -5.539 -10.727
  104    H    CYS  16           H        CYS  16   7.444  -1.921 -11.522
  105    HA   CYS  16           HA       CYS  16   6.926  -1.764  -8.626
  106    HB2  CYS  16           HB2      CYS  16   8.432   0.320 -10.186
  107    HB3  CYS  16           HB3      CYS  16   8.475  -0.006  -8.457
  108    H    CYS  17           H        CYS  17   6.227   0.559  -7.988
  109    HA   CYS  17           HA       CYS  17   3.863   1.170  -9.581
  110    HB2  CYS  17           HB2      CYS  17   3.199   2.547  -7.622
  111    HB3  CYS  17           HB3      CYS  17   3.501   0.862  -7.207
  112    H    LYS  18           H        LYS  18   3.255   3.597  -9.576
  113    HA   LYS  18           HA       LYS  18   4.949   4.974 -11.261
  114    HB2  LYS  18           HB2      LYS  18   3.631   6.999 -10.667
  115    HB3  LYS  18           HB3      LYS  18   2.631   5.602 -11.048
  116    HG2  LYS  18           HG2      LYS  18   2.667   5.235  -8.463
  117    HG3  LYS  18           HG3      LYS  18   3.093   6.948  -8.429
  118    HD2  LYS  18           HD2      LYS  18   1.072   7.594  -9.388
  119    HD3  LYS  18           HD3      LYS  18   0.756   5.985 -10.040
  120    HE2  LYS  18           HE2      LYS  18  -0.684   5.959  -8.273
  121    HE3  LYS  18           HE3      LYS  18   0.760   5.343  -7.473
  122    HZ1  LYS  18           HZ1      LYS  18  -0.579   7.909  -7.168
  123    HZ2  LYS  18           HZ2      LYS  18   1.111   7.940  -7.121
  124    HZ3  LYS  18           HZ3      LYS  18   0.252   6.978  -6.026
  125    H    HIS  19           H        HIS  19   4.697   5.205  -7.735
  126    HA   HIS  19           HA       HIS  19   6.399   7.336  -7.272
  127    HB2  HIS  19           HB2      HIS  19   6.152   4.831  -5.594
  128    HB3  HIS  19           HB3      HIS  19   6.758   6.392  -5.046
  129    HD1  HIS  19           HD1      HIS  19   4.388   5.134  -3.609
  130    HD2  HIS  19           HD2      HIS  19   4.003   7.764  -6.803
  131    HE1  HIS  19           HE1      HIS  19   2.085   6.123  -3.393
  132    H    LEU  20           H        LEU  20   7.155   4.032  -8.123
  133    HA   LEU  20           HA       LEU  20  10.025   4.614  -7.873
  134    HB2  LEU  20           HB2      LEU  20   8.725   1.935  -8.316
  135    HB3  LEU  20           HB3      LEU  20  10.404   2.252  -7.884
  136    HG   LEU  20           HG       LEU  20   8.293   3.158  -5.998
  137   HD11  LEU  20          HD11      LEU  20   9.135   0.279  -6.300
  138   HD12  LEU  20          HD12      LEU  20   7.522   0.933  -6.588
  139   HD13  LEU  20          HD13      LEU  20   8.200   0.942  -4.960
  140   HD21  LEU  20          HD21      LEU  20  10.402   1.776  -4.756
  141   HD22  LEU  20          HD22      LEU  20  10.125   3.518  -4.798
  142   HD23  LEU  20          HD23      LEU  20  11.129   2.753  -6.031
  143    H    GLY  21           H        GLY  21  11.399   3.498  -9.592
  144    HA2  GLY  21           HA2      GLY  21  10.085   3.429 -12.213
  145    HA3  GLY  21           HA3      GLY  21  11.394   4.577 -11.976
  146    H    CYS  22           H        CYS  22  10.549   1.183 -12.174
  147    HA   CYS  22           HA       CYS  22  12.963  -0.041 -11.682
  148    HB2  CYS  22           HB2      CYS  22  10.681  -1.073 -12.313
  149    HB3  CYS  22           HB3      CYS  22  11.220  -0.901 -13.980
  150    H    ARG  23           H        ARG  23  14.914   0.308 -12.487
  151    HA   ARG  23           HA       ARG  23  15.224   1.589 -15.077
  152    HB2  ARG  23           HB2      ARG  23  17.083   0.967 -12.801
  153    HB3  ARG  23           HB3      ARG  23  17.717   1.428 -14.375
  154    HG2  ARG  23           HG2      ARG  23  16.395   3.515 -14.249
  155    HG3  ARG  23           HG3      ARG  23  15.894   3.057 -12.620
  156    HD2  ARG  23           HD2      ARG  23  17.688   4.406 -12.149
  157    HD3  ARG  23           HD3      ARG  23  18.475   2.830 -12.225
  158    HE   ARG  23           HE       ARG  23  18.713   3.709 -14.752
  159   HH11  ARG  23          HH11      ARG  23  19.400   5.199 -11.681
  160   HH12  ARG  23          HH12      ARG  23  20.687   6.179 -12.297
  161   HH21  ARG  23          HH21      ARG  23  20.408   4.995 -15.575
  162   HH22  ARG  23          HH22      ARG  23  21.259   6.063 -14.512
  163    H    THR  24           H        THR  24  16.275   0.710 -16.836
  164    HA   THR  24           HA       THR  24  16.218  -2.173 -17.002
  165    HB   THR  24           HB       THR  24  16.623  -1.914 -19.354
  166    HG1  THR  24           HG1      THR  24  17.657  -0.232 -20.137
  167   HG21  THR  24          HG21      THR  24  14.510  -1.274 -19.648
  168   HG22  THR  24          HG22      THR  24  14.950   0.407 -19.346
  169   HG23  THR  24          HG23      THR  24  14.495  -0.641 -18.003
  170    H    ASP  25           H        ASP  25  18.550   0.244 -16.373
  171    HA   ASP  25           HA       ASP  25  20.790  -1.457 -17.155
  172    HB2  ASP  25           HB2      ASP  25  21.058   0.847 -17.750
  173    HB3  ASP  25           HB3      ASP  25  20.641   1.378 -16.124
  174    H    LEU  26           H        LEU  26  19.287  -0.081 -14.279
  175    HA   LEU  26           HA       LEU  26  21.220  -1.419 -12.552
  176    HB2  LEU  26           HB2      LEU  26  19.047   0.591 -12.116
  177    HB3  LEU  26           HB3      LEU  26  19.707  -0.318 -10.757
  178    HG   LEU  26           HG       LEU  26  21.997   0.592 -11.735
  179   HD11  LEU  26          HD11      LEU  26  20.018   2.018 -13.239
  180   HD12  LEU  26          HD12      LEU  26  21.776   2.081 -13.362
  181   HD13  LEU  26          HD13      LEU  26  20.933   3.138 -12.230
  182   HD21  LEU  26          HD21      LEU  26  20.524   1.075  -9.535
  183   HD22  LEU  26          HD22      LEU  26  20.513   2.678 -10.272
  184   HD23  LEU  26          HD23      LEU  26  22.046   1.892  -9.893
  185    H    TYR  27           H        TYR  27  17.878  -1.635 -13.555
  186    HA   TYR  27           HA       TYR  27  16.296  -3.245 -13.280
  187    HB2  TYR  27           HB2      TYR  27  18.846  -4.686 -12.886
  188    HB3  TYR  27           HB3      TYR  27  17.417  -5.486 -12.240
  189    HD1  TYR  27           HD1      TYR  27  17.591  -3.359 -15.275
  190    HD2  TYR  27           HD2      TYR  27  17.197  -7.301 -13.722
  191    HE1  TYR  27           HE1      TYR  27  17.042  -4.185 -17.526
  192    HE2  TYR  27           HE2      TYR  27  16.648  -8.137 -15.969
  193    HH   TYR  27           HH       TYR  27  16.033  -5.995 -18.628
  194    H    TYR  28           H        TYR  28  16.100  -1.467 -11.388
  195    HA   TYR  28           HA       TYR  28  15.167  -2.956  -9.117
  196    HB2  TYR  28           HB2      TYR  28  16.604  -2.223  -7.469
  197    HB3  TYR  28           HB3      TYR  28  17.723  -2.392  -8.817
  198    HD1  TYR  28           HD1      TYR  28  17.613  -0.086 -10.372
  199    HD2  TYR  28           HD2      TYR  28  17.025  -0.376  -6.169
  200    HE1  TYR  28           HE1      TYR  28  18.274   2.269 -10.124
  201    HE2  TYR  28           HE2      TYR  28  17.684   1.980  -5.909
  202    HH   TYR  28           HH       TYR  28  18.939   3.681  -7.079
  203    H    CYS  29           H        CYS  29  13.722  -1.786  -7.826
  204    HA   CYS  29           HA       CYS  29  12.378   0.340  -9.145
  205    HB2  CYS  29           HB2      CYS  29  12.054  -0.686  -6.317
  206    HB3  CYS  29           HB3      CYS  29  10.924   0.373  -7.157
  207    H    ALA  30           H        ALA  30  13.022   2.380  -9.206
  208    HA   ALA  30           HA       ALA  30  14.715   3.424  -7.059
  209    HB1  ALA  30           HB1      ALA  30  15.449   3.644  -9.424
  210    HB2  ALA  30           HB2      ALA  30  14.068   4.705  -9.709
  211    HB3  ALA  30           HB3      ALA  30  15.327   5.181  -8.569
  212    H    TRP  31           H        TRP  31  13.441   4.088  -5.412
  213    HA   TRP  31           HA       TRP  31  10.884   5.254  -5.714
  214    HB2  TRP  31           HB2      TRP  31  11.625   4.146  -3.638
  215    HB3  TRP  31           HB3      TRP  31  12.793   5.437  -3.372
  216    HD1  TRP  31           HD1      TRP  31  11.632   7.978  -3.039
  217    HE1  TRP  31           HE1      TRP  31   9.486   8.579  -1.751
  218    HE3  TRP  31           HE3      TRP  31   9.427   3.366  -2.934
  219    HZ2  TRP  31           HZ2      TRP  31   7.166   7.272  -0.813
  220    HZ3  TRP  31           HZ3      TRP  31   7.246   3.126  -1.821
  221    HH2  TRP  31           HH2      TRP  31   6.140   5.040  -0.783
  222    H    ASP  32           H        ASP  32  10.558   7.122  -6.729
  223    HA   ASP  32           HA       ASP  32  12.002   9.481  -5.816
  224    HB2  ASP  32           HB2      ASP  32  13.203   8.536  -7.841
  225    HB3  ASP  32           HB3      ASP  32  11.755   8.909  -8.770
  226    H    GLY  33           H        GLY  33   9.626   8.380  -8.243
  227    HA2  GLY  33           HA2      GLY  33   7.329   8.950  -8.217
  228    HA3  GLY  33           HA3      GLY  33   7.696  10.276  -7.124
  229    H    THR  34           H        THR  34  10.001  11.019  -8.945
  230    HA   THR  34           HA       THR  34   8.441  12.188 -11.151
  231    HB   THR  34           HB       THR  34   9.908  14.251 -10.891
  232    HG1  THR  34           HG1      THR  34  11.356  13.127  -9.359
  233   HG21  THR  34          HG21      THR  34   7.451  13.742  -9.967
  234   HG22  THR  34          HG22      THR  34   8.271  15.279  -9.688
  235   HG23  THR  34          HG23      THR  34   8.264  14.042  -8.432
  236    H    PHE  35           H        PHE  35   9.262  11.569 -13.029
  237    HA   PHE  35           HA       PHE  35  12.053  10.725 -13.178
  238    HB2  PHE  35           HB2      PHE  35   9.966  10.518 -15.348
  239    HB3  PHE  35           HB3      PHE  35  11.481   9.629 -15.223
  240    HD1  PHE  35           HD1      PHE  35  11.709   8.206 -12.997
  241    HD2  PHE  35           HD2      PHE  35   8.034   9.440 -14.754
  242    HE1  PHE  35           HE1      PHE  35  10.542   6.379 -11.832
  243    HE2  PHE  35           HE2      PHE  35   6.861   7.616 -13.591
  244    HZ   PHE  35           HZ       PHE  35   8.115   6.083 -12.128
  Start of MODEL   12
    1    H1   SER   1           H        SER   1   0.091  -0.075  -6.289
    2    HA   SER   1           HA       SER   1   0.610   1.326  -3.892
    3    HB2  SER   1           HB2      SER   1  -1.243  -0.031  -2.954
    4    HB3  SER   1           HB3      SER   1  -1.658   0.682  -4.512
    5    HG   SER   1           HG       SER   1  -2.254  -1.527  -4.385
    6    H    GLU   2           H        GLU   2   0.817  -2.154  -4.639
    7    HA   GLU   2           HA       GLU   2   2.373  -2.557  -2.194
    8    HB2  GLU   2           HB2      GLU   2   2.071  -4.977  -2.688
    9    HB3  GLU   2           HB3      GLU   2   0.556  -4.107  -2.489
   10    HG2  GLU   2           HG2      GLU   2   0.004  -4.279  -4.712
   11    HG3  GLU   2           HG3      GLU   2   1.680  -4.465  -5.223
   12    H    CYS   3           H        CYS   3   3.338  -1.291  -4.767
   13    HA   CYS   3           HA       CYS   3   5.038  -2.896  -6.219
   14    HB2  CYS   3           HB2      CYS   3   6.462  -0.793  -6.453
   15    HB3  CYS   3           HB3      CYS   3   4.773  -0.657  -6.934
   16    H    ARG   4           H        ARG   4   7.422  -3.036  -6.127
   17    HA   ARG   4           HA       ARG   4   8.247  -3.965  -3.535
   18    HB2  ARG   4           HB2      ARG   4  10.022  -3.691  -5.952
   19    HB3  ARG   4           HB3      ARG   4  10.170  -4.822  -4.615
   20    HG2  ARG   4           HG2      ARG   4   8.252  -6.052  -5.364
   21    HG3  ARG   4           HG3      ARG   4   7.923  -4.852  -6.616
   22    HD2  ARG   4           HD2      ARG   4   9.012  -6.456  -7.841
   23    HD3  ARG   4           HD3      ARG   4  10.364  -5.426  -7.374
   24    HE   ARG   4           HE       ARG   4  10.323  -7.234  -5.393
   25   HH11  ARG   4          HH11      ARG   4  10.226  -7.569  -8.856
   26   HH12  ARG   4          HH12      ARG   4  11.027  -9.104  -8.862
   27   HH21  ARG   4          HH21      ARG   4  11.380  -9.256  -5.386
   28   HH22  ARG   4          HH22      ARG   4  11.683 -10.064  -6.887
   29    H    TYR   5           H        TYR   5   9.652  -3.044  -2.129
   30    HA   TYR   5           HA       TYR   5  10.046  -0.245  -2.231
   31    HB2  TYR   5           HB2      TYR   5  10.676  -2.437  -0.379
   32    HB3  TYR   5           HB3      TYR   5  11.829  -1.108  -0.334
   33    HD1  TYR   5           HD1      TYR   5   8.913  -2.321   1.096
   34    HD2  TYR   5           HD2      TYR   5  10.615   1.304  -0.339
   35    HE1  TYR   5           HE1      TYR   5   7.371  -1.041   2.521
   36    HE2  TYR   5           HE2      TYR   5   9.079   2.595   1.083
   37    HH   TYR   5           HH       TYR   5   6.412   1.627   2.260
   38    H    LEU   6           H        LEU   6  12.306   0.704  -1.829
   39    HA   LEU   6           HA       LEU   6  13.814   0.684  -4.078
   40    HB2  LEU   6           HB2      LEU   6  13.997   2.115  -1.933
   41    HB3  LEU   6           HB3      LEU   6  15.170   0.906  -1.417
   42    HG   LEU   6           HG       LEU   6  16.226   1.502  -3.791
   43   HD11  LEU   6          HD11      LEU   6  15.946   4.207  -3.560
   44   HD12  LEU   6          HD12      LEU   6  14.308   3.637  -3.242
   45   HD13  LEU   6          HD13      LEU   6  15.119   3.194  -4.744
   46   HD21  LEU   6          HD21      LEU   6  16.683   3.398  -1.517
   47   HD22  LEU   6          HD22      LEU   6  17.852   2.705  -2.641
   48   HD23  LEU   6          HD23      LEU   6  17.128   1.697  -1.386
   49    H    PHE   7           H        PHE   7  15.273  -0.591  -5.046
   50    HA   PHE   7           HA       PHE   7  16.566  -2.401  -5.512
   51    HB2  PHE   7           HB2      PHE   7  17.082  -2.182  -2.545
   52    HB3  PHE   7           HB3      PHE   7  17.921  -3.329  -3.583
   53    HD1  PHE   7           HD1      PHE   7  17.967  -0.079  -2.223
   54    HD2  PHE   7           HD2      PHE   7  19.115  -2.314  -5.659
   55    HE1  PHE   7           HE1      PHE   7  19.615   1.655  -2.797
   56    HE2  PHE   7           HE2      PHE   7  20.765  -0.585  -6.237
   57    HZ   PHE   7           HZ       PHE   7  21.017   1.405  -4.806
   58    H    GLY   8           H        GLY   8  13.991  -3.045  -5.525
   59    HA2  GLY   8           HA2      GLY   8  13.545  -5.340  -3.776
   60    HA3  GLY   8           HA3      GLY   8  12.377  -4.630  -4.879
   61    H    GLY   9           H        GLY   9  15.189  -4.914  -6.569
   62    HA2  GLY   9           HA2      GLY   9  16.013  -6.431  -8.092
   63    HA3  GLY   9           HA3      GLY   9  15.202  -7.696  -7.181
   64    H    CYS  10           H        CYS  10  14.012  -4.867  -8.990
   65    HA   CYS  10           HA       CYS  10  11.929  -6.496 -10.172
   66    HB2  CYS  10           HB2      CYS  10  11.009  -4.447 -10.998
   67    HB3  CYS  10           HB3      CYS  10  11.554  -4.143  -9.351
   68    H    LYS  11           H        LYS  11  11.490  -5.848 -12.618
   69    HA   LYS  11           HA       LYS  11  14.019  -6.080 -14.104
   70    HB2  LYS  11           HB2      LYS  11  11.505  -7.619 -14.763
   71    HB3  LYS  11           HB3      LYS  11  13.070  -7.757 -15.554
   72    HG2  LYS  11           HG2      LYS  11  13.996  -8.544 -13.356
   73    HG3  LYS  11           HG3      LYS  11  12.332  -8.618 -12.769
   74    HD2  LYS  11           HD2      LYS  11  12.985 -10.807 -13.521
   75    HD3  LYS  11           HD3      LYS  11  11.797 -10.152 -14.650
   76    HE2  LYS  11           HE2      LYS  11  13.479  -9.641 -16.249
   77    HE3  LYS  11           HE3      LYS  11  14.769  -9.960 -15.090
   78    HZ1  LYS  11           HZ1      LYS  11  14.794 -11.929 -16.160
   79    HZ2  LYS  11           HZ2      LYS  11  13.182 -11.825 -16.661
   80    HZ3  LYS  11           HZ3      LYS  11  13.547 -12.306 -15.080
   81    H    THR  12           H        THR  12  10.623  -5.160 -14.116
   82    HA   THR  12           HA       THR  12  11.218  -3.258 -16.278
   83    HB   THR  12           HB       THR  12   9.097  -3.665 -17.350
   84    HG1  THR  12           HG1      THR  12   7.687  -5.274 -16.556
   85   HG21  THR  12          HG21      THR  12   9.402  -6.011 -18.094
   86   HG22  THR  12          HG22      THR  12  10.576  -6.240 -16.798
   87   HG23  THR  12          HG23      THR  12  10.905  -5.090 -18.094
   88    H    THR  13           H        THR  13   9.613  -1.483 -16.408
   89    HA   THR  13           HA       THR  13   9.299  -0.193 -13.954
   90    HB   THR  13           HB       THR  13   7.628   0.376 -16.403
   91    HG1  THR  13           HG1      THR  13   9.387   1.704 -17.046
   92   HG21  THR  13          HG21      THR  13   8.685   2.610 -14.868
   93   HG22  THR  13          HG22      THR  13   7.655   1.554 -13.902
   94   HG23  THR  13          HG23      THR  13   7.032   2.278 -15.385
   95    H    ALA  14           H        ALA  14   7.121  -2.284 -15.737
   96    HA   ALA  14           HA       ALA  14   4.749  -1.717 -14.337
   97    HB1  ALA  14           HB1      ALA  14   3.858  -3.242 -15.697
   98    HB2  ALA  14           HB2      ALA  14   5.456  -3.355 -16.434
   99    HB3  ALA  14           HB3      ALA  14   4.985  -4.493 -15.172
  100    H    ASP  15           H        ASP  15   7.539  -3.591 -13.498
  101    HA   ASP  15           HA       ASP  15   6.368  -5.233 -11.514
  102    HB2  ASP  15           HB2      ASP  15   9.219  -4.265 -11.812
  103    HB3  ASP  15           HB3      ASP  15   8.698  -5.534 -10.708
  104    H    CYS  16           H        CYS  16   7.474  -1.937 -11.536
  105    HA   CYS  16           HA       CYS  16   6.968  -1.754  -8.639
  106    HB2  CYS  16           HB2      CYS  16   8.464   0.313 -10.234
  107    HB3  CYS  16           HB3      CYS  16   8.505   0.022  -8.498
  108    H    CYS  17           H        CYS  17   6.266   0.576  -8.022
  109    HA   CYS  17           HA       CYS  17   3.898   1.167  -9.624
  110    HB2  CYS  17           HB2      CYS  17   3.229   2.552  -7.663
  111    HB3  CYS  17           HB3      CYS  17   3.509   0.861  -7.260
  112    H    LYS  18           H        LYS  18   3.278   3.589  -9.624
  113    HA   LYS  18           HA       LYS  18   4.976   4.976 -11.297
  114    HB2  LYS  18           HB2      LYS  18   3.649   7.005 -10.666
  115    HB3  LYS  18           HB3      LYS  18   2.675   5.618 -11.134
  116    HG2  LYS  18           HG2      LYS  18   2.497   5.119  -8.638
  117    HG3  LYS  18           HG3      LYS  18   3.116   6.755  -8.396
  118    HD2  LYS  18           HD2      LYS  18   1.241   7.735  -9.393
  119    HD3  LYS  18           HD3      LYS  18   0.759   6.229 -10.177
  120    HE2  LYS  18           HE2      LYS  18   0.250   5.276  -7.959
  121    HE3  LYS  18           HE3      LYS  18   0.667   6.821  -7.220
  122    HZ1  LYS  18           HZ1      LYS  18  -1.281   6.992  -9.346
  123    HZ2  LYS  18           HZ2      LYS  18  -1.277   7.720  -7.820
  124    HZ3  LYS  18           HZ3      LYS  18  -1.805   6.122  -7.993
  125    H    HIS  19           H        HIS  19   4.691   5.216  -7.774
  126    HA   HIS  19           HA       HIS  19   6.382   7.352  -7.302
  127    HB2  HIS  19           HB2      HIS  19   6.047   4.845  -5.641
  128    HB3  HIS  19           HB3      HIS  19   6.777   6.344  -5.074
  129    HD1  HIS  19           HD1      HIS  19   5.228   7.980  -4.026
  130    HD2  HIS  19           HD2      HIS  19   3.215   5.207  -6.377
  131    HE1  HIS  19           HE1      HIS  19   2.783   8.440  -3.664
  132    H    LEU  20           H        LEU  20   7.159   4.053  -8.144
  133    HA   LEU  20           HA       LEU  20  10.025   4.645  -7.868
  134    HB2  LEU  20           HB2      LEU  20   8.739   1.961  -8.320
  135    HB3  LEU  20           HB3      LEU  20  10.413   2.285  -7.872
  136    HG   LEU  20           HG       LEU  20   8.273   3.177  -6.009
  137   HD11  LEU  20          HD11      LEU  20   9.160   0.310  -6.282
  138   HD12  LEU  20          HD12      LEU  20   7.544   0.936  -6.610
  139   HD13  LEU  20          HD13      LEU  20   8.185   0.968  -4.968
  140   HD21  LEU  20          HD21      LEU  20  10.336   1.867  -4.684
  141   HD22  LEU  20          HD22      LEU  20  10.124   3.609  -4.855
  142   HD23  LEU  20          HD23      LEU  20  11.126   2.725  -6.006
  143    H    GLY  21           H        GLY  21  11.417   3.533  -9.573
  144    HA2  GLY  21           HA2      GLY  21  10.125   3.469 -12.206
  145    HA3  GLY  21           HA3      GLY  21  11.441   4.605 -11.955
  146    H    CYS  22           H        CYS  22  10.570   1.219 -12.172
  147    HA   CYS  22           HA       CYS  22  12.960  -0.033 -11.654
  148    HB2  CYS  22           HB2      CYS  22  10.684  -1.040 -12.332
  149    HB3  CYS  22           HB3      CYS  22  11.244  -0.848 -13.991
  150    H    ARG  23           H        ARG  23  14.930   0.296 -12.419
  151    HA   ARG  23           HA       ARG  23  15.336   1.665 -14.934
  152    HB2  ARG  23           HB2      ARG  23  17.086   0.813 -12.663
  153    HB3  ARG  23           HB3      ARG  23  17.824   1.185 -14.216
  154    HG2  ARG  23           HG2      ARG  23  16.615   3.402 -14.113
  155    HG3  ARG  23           HG3      ARG  23  16.240   3.008 -12.434
  156    HD2  ARG  23           HD2      ARG  23  18.179   4.138 -12.091
  157    HD3  ARG  23           HD3      ARG  23  18.858   2.537 -12.379
  158    HE   ARG  23           HE       ARG  23  18.800   3.598 -14.851
  159   HH11  ARG  23          HH11      ARG  23  20.003   4.783 -11.806
  160   HH12  ARG  23          HH12      ARG  23  21.260   5.734 -12.525
  161   HH21  ARG  23          HH21      ARG  23  20.450   4.847 -15.809
  162   HH22  ARG  23          HH22      ARG  23  21.513   5.771 -14.802
  163    H    THR  24           H        THR  24  16.361   0.848 -16.746
  164    HA   THR  24           HA       THR  24  16.074  -2.001 -17.136
  165    HB   THR  24           HB       THR  24  16.608  -1.577 -19.465
  166    HG1  THR  24           HG1      THR  24  16.919   1.178 -18.934
  167   HG21  THR  24          HG21      THR  24  14.356  -0.807 -18.287
  168   HG22  THR  24          HG22      THR  24  14.653  -0.518 -20.001
  169   HG23  THR  24          HG23      THR  24  14.906   0.777 -18.831
  170    H    ASP  25           H        ASP  25  18.615   0.233 -16.459
  171    HA   ASP  25           HA       ASP  25  20.685  -1.681 -17.228
  172    HB2  ASP  25           HB2      ASP  25  20.730   1.208 -16.384
  173    HB3  ASP  25           HB3      ASP  25  22.204   0.244 -16.413
  174    H    LEU  26           H        LEU  26  19.334  -0.104 -14.380
  175    HA   LEU  26           HA       LEU  26  21.187  -1.482 -12.615
  176    HB2  LEU  26           HB2      LEU  26  19.013   0.541 -12.215
  177    HB3  LEU  26           HB3      LEU  26  19.707  -0.329 -10.847
  178    HG   LEU  26           HG       LEU  26  20.741   1.838 -11.042
  179   HD11  LEU  26          HD11      LEU  26  22.115  -0.600 -11.015
  180   HD12  LEU  26          HD12      LEU  26  22.679   0.959 -10.417
  181   HD13  LEU  26          HD13      LEU  26  23.042   0.466 -12.071
  182   HD21  LEU  26          HD21      LEU  26  20.289   1.778 -13.644
  183   HD22  LEU  26          HD22      LEU  26  21.953   1.195 -13.678
  184   HD23  LEU  26          HD23      LEU  26  21.581   2.760 -12.953
  185    H    TYR  27           H        TYR  27  17.823  -1.629 -13.594
  186    HA   TYR  27           HA       TYR  27  16.210  -3.205 -13.300
  187    HB2  TYR  27           HB2      TYR  27  18.733  -4.704 -12.966
  188    HB3  TYR  27           HB3      TYR  27  17.302  -5.477 -12.292
  189    HD1  TYR  27           HD1      TYR  27  17.387  -3.327 -15.307
  190    HD2  TYR  27           HD2      TYR  27  17.080  -7.291 -13.793
  191    HE1  TYR  27           HE1      TYR  27  16.769  -4.128 -17.548
  192    HE2  TYR  27           HE2      TYR  27  16.461  -8.104 -16.030
  193    HH   TYR  27           HH       TYR  27  16.994  -6.562 -18.759
  194    H    TYR  28           H        TYR  28  16.094  -1.433 -11.393
  195    HA   TYR  28           HA       TYR  28  15.186  -2.925  -9.106
  196    HB2  TYR  28           HB2      TYR  28  16.662  -2.199  -7.489
  197    HB3  TYR  28           HB3      TYR  28  17.750  -2.368  -8.862
  198    HD1  TYR  28           HD1      TYR  28  17.700  -0.087 -10.402
  199    HD2  TYR  28           HD2      TYR  28  17.031  -0.329  -6.207
  200    HE1  TYR  28           HE1      TYR  28  18.372   2.267 -10.166
  201    HE2  TYR  28           HE2      TYR  28  17.700   2.025  -5.959
  202    HH   TYR  28           HH       TYR  28  19.404   3.656  -7.800
  203    H    CYS  29           H        CYS  29  13.706  -1.798  -7.862
  204    HA   CYS  29           HA       CYS  29  12.376   0.356  -9.132
  205    HB2  CYS  29           HB2      CYS  29  12.067  -0.691  -6.310
  206    HB3  CYS  29           HB3      CYS  29  10.935   0.373  -7.137
  207    H    ALA  30           H        ALA  30  13.021   2.396  -9.176
  208    HA   ALA  30           HA       ALA  30  14.723   3.420  -7.022
  209    HB1  ALA  30           HB1      ALA  30  15.848   4.277  -8.735
  210    HB2  ALA  30           HB2      ALA  30  14.556   3.874  -9.868
  211    HB3  ALA  30           HB3      ALA  30  14.500   5.392  -8.972
  212    H    TRP  31           H        TRP  31  13.457   4.094  -5.376
  213    HA   TRP  31           HA       TRP  31  10.904   5.269  -5.678
  214    HB2  TRP  31           HB2      TRP  31  11.668   4.144  -3.607
  215    HB3  TRP  31           HB3      TRP  31  12.797   5.468  -3.327
  216    HD1  TRP  31           HD1      TRP  31  11.590   7.959  -2.942
  217    HE1  TRP  31           HE1      TRP  31   9.405   8.502  -1.692
  218    HE3  TRP  31           HE3      TRP  31   9.447   3.318  -3.000
  219    HZ2  TRP  31           HZ2      TRP  31   7.083   7.141  -0.842
  220    HZ3  TRP  31           HZ3      TRP  31   7.243   3.023  -1.946
  221    HH2  TRP  31           HH2      TRP  31   6.087   4.896  -0.890
  222    H    ASP  32           H        ASP  32  10.576   7.149  -6.668
  223    HA   ASP  32           HA       ASP  32  12.036   9.495  -5.751
  224    HB2  ASP  32           HB2      ASP  32  13.234   8.555  -7.779
  225    HB3  ASP  32           HB3      ASP  32  11.787   8.938  -8.708
  226    H    GLY  33           H        GLY  33   9.648   8.406  -8.171
  227    HA2  GLY  33           HA2      GLY  33   7.351   8.989  -8.116
  228    HA3  GLY  33           HA3      GLY  33   7.744  10.336  -7.058
  229    H    THR  34           H        THR  34  10.033  11.012  -8.927
  230    HA   THR  34           HA       THR  34   8.456  12.144 -11.141
  231    HB   THR  34           HB       THR  34   9.721  14.244 -10.969
  232    HG1  THR  34           HG1      THR  34  10.775  13.078  -8.588
  233   HG21  THR  34          HG21      THR  34   8.540  13.685  -8.262
  234   HG22  THR  34          HG22      THR  34   7.533  13.794  -9.707
  235   HG23  THR  34          HG23      THR  34   8.498  15.179  -9.196
  236    H    PHE  35           H        PHE  35   9.678  12.688 -13.039
  237    HA   PHE  35           HA       PHE  35  12.407  11.693 -13.206
  238    HB2  PHE  35           HB2      PHE  35  10.057  10.409 -14.521
  239    HB3  PHE  35           HB3      PHE  35  11.568  10.493 -15.421
  240    HD1  PHE  35           HD1      PHE  35  13.674   9.891 -13.746
  241    HD2  PHE  35           HD2      PHE  35   9.696   8.398 -13.504
  242    HE1  PHE  35           HE1      PHE  35  14.497   7.902 -12.552
  243    HE2  PHE  35           HE2      PHE  35  10.511   6.408 -12.310
  244    HZ   PHE  35           HZ       PHE  35  12.915   6.158 -11.832
  Start of MODEL   13
    1    H1   SER   1           H        SER   1   0.481   0.571  -6.224
    2    HA   SER   1           HA       SER   1   0.317   1.163  -3.561
    3    HB2  SER   1           HB2      SER   1  -1.581   0.319  -4.870
    4    HB3  SER   1           HB3      SER   1  -0.840  -1.280  -4.930
    5    HG   SER   1           HG       SER   1  -2.484  -0.897  -3.248
    6    H    GLU   2           H        GLU   2   0.904  -2.184  -4.632
    7    HA   GLU   2           HA       GLU   2   2.439  -2.622  -2.172
    8    HB2  GLU   2           HB2      GLU   2   0.425  -4.088  -2.969
    9    HB3  GLU   2           HB3      GLU   2   1.615  -4.816  -4.039
   10    HG2  GLU   2           HG2      GLU   2   2.975  -5.459  -2.146
   11    HG3  GLU   2           HG3      GLU   2   1.860  -4.654  -1.045
   12    H    CYS   3           H        CYS   3   3.377  -1.335  -4.745
   13    HA   CYS   3           HA       CYS   3   5.063  -2.929  -6.226
   14    HB2  CYS   3           HB2      CYS   3   6.479  -0.824  -6.467
   15    HB3  CYS   3           HB3      CYS   3   4.784  -0.684  -6.921
   16    H    ARG   4           H        ARG   4   7.429  -3.115  -6.159
   17    HA   ARG   4           HA       ARG   4   8.286  -4.022  -3.570
   18    HB2  ARG   4           HB2      ARG   4  10.030  -3.804  -6.015
   19    HB3  ARG   4           HB3      ARG   4  10.171  -4.928  -4.670
   20    HG2  ARG   4           HG2      ARG   4   8.184  -6.098  -5.388
   21    HG3  ARG   4           HG3      ARG   4   7.930  -4.922  -6.680
   22    HD2  ARG   4           HD2      ARG   4   9.036  -6.432  -7.931
   23    HD3  ARG   4           HD3      ARG   4  10.464  -5.695  -7.206
   24    HE   ARG   4           HE       ARG   4  10.848  -7.657  -6.112
   25   HH11  ARG   4          HH11      ARG   4   7.505  -7.561  -7.077
   26   HH12  ARG   4          HH12      ARG   4   7.171  -9.177  -6.550
   27   HH21  ARG   4          HH21      ARG   4  10.422  -9.787  -5.414
   28   HH22  ARG   4          HH22      ARG   4   8.831 -10.442  -5.603
   29    H    TYR   5           H        TYR   5   9.536  -2.997  -2.135
   30    HA   TYR   5           HA       TYR   5  10.035  -0.244  -2.324
   31    HB2  TYR   5           HB2      TYR   5  10.638  -2.399  -0.420
   32    HB3  TYR   5           HB3      TYR   5  11.799  -1.078  -0.402
   33    HD1  TYR   5           HD1      TYR   5   8.871  -2.240   1.045
   34    HD2  TYR   5           HD2      TYR   5  10.599   1.342  -0.467
   35    HE1  TYR   5           HE1      TYR   5   7.332  -0.918   2.435
   36    HE2  TYR   5           HE2      TYR   5   9.066   2.674   0.919
   37    HH   TYR   5           HH       TYR   5   7.662   2.535   2.767
   38    H    LEU   6           H        LEU   6  12.305   0.684  -1.937
   39    HA   LEU   6           HA       LEU   6  13.820   0.590  -4.181
   40    HB2  LEU   6           HB2      LEU   6  14.017   2.092  -2.103
   41    HB3  LEU   6           HB3      LEU   6  15.141   0.874  -1.504
   42    HG   LEU   6           HG       LEU   6  16.279   1.335  -3.868
   43   HD11  LEU   6          HD11      LEU   6  15.203   2.996  -4.920
   44   HD12  LEU   6          HD12      LEU   6  16.089   4.039  -3.808
   45   HD13  LEU   6          HD13      LEU   6  14.429   3.571  -3.443
   46   HD21  LEU   6          HD21      LEU   6  17.932   2.061  -2.566
   47   HD22  LEU   6          HD22      LEU   6  16.804   1.943  -1.214
   48   HD23  LEU   6          HD23      LEU   6  17.008   3.477  -2.061
   49    H    PHE   7           H        PHE   7  15.356  -0.671  -5.076
   50    HA   PHE   7           HA       PHE   7  16.649  -2.496  -5.483
   51    HB2  PHE   7           HB2      PHE   7  17.045  -2.118  -2.530
   52    HB3  PHE   7           HB3      PHE   7  17.772  -3.493  -3.356
   53    HD1  PHE   7           HD1      PHE   7  17.957   0.048  -2.712
   54    HD2  PHE   7           HD2      PHE   7  19.408  -3.095  -5.189
   55    HE1  PHE   7           HE1      PHE   7  19.842   1.469  -3.404
   56    HE2  PHE   7           HE2      PHE   7  21.296  -1.679  -5.885
   57    HZ   PHE   7           HZ       PHE   7  21.514   0.606  -4.994
   58    H    GLY   8           H        GLY   8  13.962  -3.006  -5.456
   59    HA2  GLY   8           HA2      GLY   8  13.467  -5.357  -3.816
   60    HA3  GLY   8           HA3      GLY   8  12.330  -4.593  -4.917
   61    H    GLY   9           H        GLY   9  15.244  -4.969  -6.484
   62    HA2  GLY   9           HA2      GLY   9  16.009  -6.426  -8.085
   63    HA3  GLY   9           HA3      GLY   9  15.203  -7.703  -7.187
   64    H    CYS  10           H        CYS  10  14.016  -4.854  -8.970
   65    HA   CYS  10           HA       CYS  10  11.914  -6.458 -10.148
   66    HB2  CYS  10           HB2      CYS  10  11.002  -4.407 -10.948
   67    HB3  CYS  10           HB3      CYS  10  11.595  -4.089  -9.321
   68    H    LYS  11           H        LYS  11  11.471  -5.847 -12.588
   69    HA   LYS  11           HA       LYS  11  13.992  -6.081 -14.088
   70    HB2  LYS  11           HB2      LYS  11  11.477  -7.714 -14.460
   71    HB3  LYS  11           HB3      LYS  11  12.795  -7.670 -15.624
   72    HG2  LYS  11           HG2      LYS  11  14.225  -8.337 -13.512
   73    HG3  LYS  11           HG3      LYS  11  12.666  -8.943 -12.944
   74    HD2  LYS  11           HD2      LYS  11  13.978  -9.669 -15.564
   75    HD3  LYS  11           HD3      LYS  11  13.967 -10.674 -14.112
   76    HE2  LYS  11           HE2      LYS  11  11.529  -9.758 -15.636
   77    HE3  LYS  11           HE3      LYS  11  12.252 -11.364 -15.731
   78    HZ1  LYS  11           HZ1      LYS  11  10.524 -11.598 -14.217
   79    HZ2  LYS  11           HZ2      LYS  11  10.832 -10.116 -13.461
   80    HZ3  LYS  11           HZ3      LYS  11  11.881 -11.422 -13.222
   81    H    THR  12           H        THR  12  10.588  -5.177 -14.097
   82    HA   THR  12           HA       THR  12  11.173  -3.279 -16.265
   83    HB   THR  12           HB       THR  12   8.847  -3.675 -17.139
   84    HG1  THR  12           HG1      THR  12   9.026  -6.007 -15.504
   85   HG21  THR  12          HG21      THR  12   9.448  -5.889 -18.228
   86   HG22  THR  12          HG22      THR  12  10.905  -5.871 -17.233
   87   HG23  THR  12          HG23      THR  12  10.623  -4.587 -18.409
   88    H    THR  13           H        THR  13   9.564  -1.509 -16.399
   89    HA   THR  13           HA       THR  13   9.252  -0.205 -13.955
   90    HB   THR  13           HB       THR  13   7.544   0.337 -16.384
   91    HG1  THR  13           HG1      THR  13   9.371   0.726 -17.370
   92   HG21  THR  13          HG21      THR  13   8.523   2.673 -15.104
   93   HG22  THR  13          HG22      THR  13   7.872   1.610 -13.856
   94   HG23  THR  13          HG23      THR  13   6.858   2.101 -15.212
   95    H    ALA  14           H        ALA  14   7.066  -2.314 -15.713
   96    HA   ALA  14           HA       ALA  14   4.707  -1.757 -14.293
   97    HB1  ALA  14           HB1      ALA  14   3.876  -3.857 -15.160
   98    HB2  ALA  14           HB2      ALA  14   4.780  -3.008 -16.414
   99    HB3  ALA  14           HB3      ALA  14   5.514  -4.369 -15.567
  100    H    ASP  15           H        ASP  15   7.512  -3.620 -13.475
  101    HA   ASP  15           HA       ASP  15   6.366  -5.252 -11.467
  102    HB2  ASP  15           HB2      ASP  15   9.214  -4.283 -11.791
  103    HB3  ASP  15           HB3      ASP  15   8.699  -5.561 -10.694
  104    H    CYS  16           H        CYS  16   7.468  -1.955 -11.523
  105    HA   CYS  16           HA       CYS  16   7.000  -1.754  -8.621
  106    HB2  CYS  16           HB2      CYS  16   8.486   0.282 -10.269
  107    HB3  CYS  16           HB3      CYS  16   8.520   0.051  -8.523
  108    H    CYS  17           H        CYS  17   6.296   0.570  -8.005
  109    HA   CYS  17           HA       CYS  17   3.917   1.159  -9.594
  110    HB2  CYS  17           HB2      CYS  17   3.249   2.530  -7.621
  111    HB3  CYS  17           HB3      CYS  17   3.532   0.836  -7.232
  112    H    LYS  18           H        LYS  18   3.290   3.576  -9.586
  113    HA   LYS  18           HA       LYS  18   4.983   4.980 -11.247
  114    HB2  LYS  18           HB2      LYS  18   3.641   6.988 -10.653
  115    HB3  LYS  18           HB3      LYS  18   2.658   5.584 -11.047
  116    HG2  LYS  18           HG2      LYS  18   2.623   5.186  -8.494
  117    HG3  LYS  18           HG3      LYS  18   3.125   6.876  -8.394
  118    HD2  LYS  18           HD2      LYS  18   1.161   7.499  -9.761
  119    HD3  LYS  18           HD3      LYS  18   0.646   5.811  -9.748
  120    HE2  LYS  18           HE2      LYS  18   0.627   5.939  -7.242
  121    HE3  LYS  18           HE3      LYS  18   0.901   7.674  -7.393
  122    HZ1  LYS  18           HZ1      LYS  18  -1.394   7.447  -7.186
  123    HZ2  LYS  18           HZ2      LYS  18  -1.467   6.114  -8.223
  124    HZ3  LYS  18           HZ3      LYS  18  -1.166   7.656  -8.849
  125    H    HIS  19           H        HIS  19   4.724   5.152  -7.722
  126    HA   HIS  19           HA       HIS  19   6.380   7.309  -7.217
  127    HB2  HIS  19           HB2      HIS  19   6.199   4.767  -5.587
  128    HB3  HIS  19           HB3      HIS  19   6.756   6.335  -5.010
  129    HD1  HIS  19           HD1      HIS  19   4.424   4.978  -3.602
  130    HD2  HIS  19           HD2      HIS  19   3.962   7.653  -6.747
  131    HE1  HIS  19           HE1      HIS  19   2.092   5.890  -3.372
  132    H    LEU  20           H        LEU  20   7.207   4.037  -8.129
  133    HA   LEU  20           HA       LEU  20  10.065   4.702  -7.910
  134    HB2  LEU  20           HB2      LEU  20   8.856   1.972  -8.291
  135    HB3  LEU  20           HB3      LEU  20  10.522   2.359  -7.866
  136    HG   LEU  20           HG       LEU  20   8.455   3.282  -5.969
  137   HD11  LEU  20          HD11      LEU  20   9.170   0.362  -6.152
  138   HD12  LEU  20          HD12      LEU  20   7.631   1.044  -6.675
  139   HD13  LEU  20          HD13      LEU  20   8.103   1.132  -4.978
  140   HD21  LEU  20          HD21      LEU  20  10.287   3.480  -4.735
  141   HD22  LEU  20          HD22      LEU  20  11.252   2.785  -6.037
  142   HD23  LEU  20          HD23      LEU  20  10.533   1.735  -4.815
  143    H    GLY  21           H        GLY  21  11.442   3.594  -9.631
  144    HA2  GLY  21           HA2      GLY  21  10.080   3.471 -12.229
  145    HA3  GLY  21           HA3      GLY  21  11.399   4.616 -12.026
  146    H    CYS  22           H        CYS  22  10.534   1.225 -12.181
  147    HA   CYS  22           HA       CYS  22  12.939  -0.014 -11.706
  148    HB2  CYS  22           HB2      CYS  22  10.652  -1.036 -12.317
  149    HB3  CYS  22           HB3      CYS  22  11.172  -0.861 -13.990
  150    H    ARG  23           H        ARG  23  14.890   0.317 -12.520
  151    HA   ARG  23           HA       ARG  23  15.196   1.585 -15.118
  152    HB2  ARG  23           HB2      ARG  23  17.046   0.985 -12.832
  153    HB3  ARG  23           HB3      ARG  23  17.696   1.398 -14.413
  154    HG2  ARG  23           HG2      ARG  23  16.395   3.505 -14.346
  155    HG3  ARG  23           HG3      ARG  23  15.891   3.096 -12.705
  156    HD2  ARG  23           HD2      ARG  23  17.701   4.381 -12.207
  157    HD3  ARG  23           HD3      ARG  23  18.510   2.824 -12.379
  158    HE   ARG  23           HE       ARG  23  18.640   3.821 -14.873
  159   HH11  ARG  23          HH11      ARG  23  19.428   5.168 -11.761
  160   HH12  ARG  23          HH12      ARG  23  20.682   6.193 -12.376
  161   HH21  ARG  23          HH21      ARG  23  20.288   5.166 -15.696
  162   HH22  ARG  23          HH22      ARG  23  21.170   6.192 -14.614
  163    H    THR  24           H        THR  24  16.281   0.699 -16.865
  164    HA   THR  24           HA       THR  24  16.185  -2.185 -17.028
  165    HB   THR  24           HB       THR  24  15.431  -0.688 -18.899
  166    HG1  THR  24           HG1      THR  24  17.550  -2.416 -19.682
  167   HG21  THR  24          HG21      THR  24  18.392  -0.307 -19.352
  168   HG22  THR  24          HG22      THR  24  17.305   0.931 -18.720
  169   HG23  THR  24          HG23      THR  24  17.080   0.310 -20.355
  170    H    ASP  25           H        ASP  25  18.556   0.236 -16.462
  171    HA   ASP  25           HA       ASP  25  20.770  -1.530 -17.165
  172    HB2  ASP  25           HB2      ASP  25  20.805   1.296 -16.083
  173    HB3  ASP  25           HB3      ASP  25  22.204   0.395 -16.661
  174    H    LEU  26           H        LEU  26  19.204  -0.118 -14.355
  175    HA   LEU  26           HA       LEU  26  21.141  -1.367 -12.563
  176    HB2  LEU  26           HB2      LEU  26  18.867   0.550 -12.135
  177    HB3  LEU  26           HB3      LEU  26  19.711  -0.224 -10.796
  178    HG   LEU  26           HG       LEU  26  20.603   1.969 -11.055
  179   HD11  LEU  26          HD11      LEU  26  22.140  -0.308 -11.129
  180   HD12  LEU  26          HD12      LEU  26  22.719   1.322 -10.786
  181   HD13  LEU  26          HD13      LEU  26  22.821   0.677 -12.425
  182   HD21  LEU  26          HD21      LEU  26  21.150   2.995 -13.022
  183   HD22  LEU  26          HD22      LEU  26  19.848   1.945 -13.582
  184   HD23  LEU  26          HD23      LEU  26  21.531   1.479 -13.838
  185    H    TYR  27           H        TYR  27  17.785  -1.610 -13.552
  186    HA   TYR  27           HA       TYR  27  16.212  -3.223 -13.245
  187    HB2  TYR  27           HB2      TYR  27  18.771  -4.657 -12.890
  188    HB3  TYR  27           HB3      TYR  27  17.352  -5.461 -12.226
  189    HD1  TYR  27           HD1      TYR  27  17.471  -3.328 -15.259
  190    HD2  TYR  27           HD2      TYR  27  17.131  -7.277 -13.711
  191    HE1  TYR  27           HE1      TYR  27  16.894  -4.153 -17.503
  192    HE2  TYR  27           HE2      TYR  27  16.554  -8.112 -15.951
  193    HH   TYR  27           HH       TYR  27  15.653  -7.285 -18.049
  194    H    TYR  28           H        TYR  28  16.046  -1.441 -11.352
  195    HA   TYR  28           HA       TYR  28  15.143  -2.925  -9.068
  196    HB2  TYR  28           HB2      TYR  28  16.616  -2.219  -7.441
  197    HB3  TYR  28           HB3      TYR  28  17.711  -2.390  -8.809
  198    HD1  TYR  28           HD1      TYR  28  17.676  -0.098 -10.339
  199    HD2  TYR  28           HD2      TYR  28  17.004  -0.362  -6.146
  200    HE1  TYR  28           HE1      TYR  28  18.365   2.250 -10.087
  201    HE2  TYR  28           HE2      TYR  28  17.690   1.985  -5.883
  202    HH   TYR  28           HH       TYR  28  17.788   4.048  -7.323
  203    H    CYS  29           H        CYS  29  13.676  -1.782  -7.815
  204    HA   CYS  29           HA       CYS  29  12.366   0.385  -9.086
  205    HB2  CYS  29           HB2      CYS  29  12.038  -0.645  -6.260
  206    HB3  CYS  29           HB3      CYS  29  10.910   0.404  -7.113
  207    H    ALA  30           H        ALA  30  13.032   2.418  -9.127
  208    HA   ALA  30           HA       ALA  30  14.730   3.424  -6.962
  209    HB1  ALA  30           HB1      ALA  30  15.878   4.151  -8.738
  210    HB2  ALA  30           HB2      ALA  30  14.498   3.966  -9.822
  211    HB3  ALA  30           HB3      ALA  30  14.653   5.417  -8.832
  212    H    TRP  31           H        TRP  31  13.450   4.107  -5.328
  213    HA   TRP  31           HA       TRP  31  10.913   5.293  -5.636
  214    HB2  TRP  31           HB2      TRP  31  11.708   4.213  -3.546
  215    HB3  TRP  31           HB3      TRP  31  12.820   5.556  -3.302
  216    HD1  TRP  31           HD1      TRP  31  11.579   8.040  -2.967
  217    HE1  TRP  31           HE1      TRP  31   9.395   8.580  -1.715
  218    HE3  TRP  31           HE3      TRP  31   9.505   3.369  -2.903
  219    HZ2  TRP  31           HZ2      TRP  31   7.098   7.206  -0.818
  220    HZ3  TRP  31           HZ3      TRP  31   7.313   3.065  -1.828
  221    HH2  TRP  31           HH2      TRP  31   6.136   4.945  -0.807
  222    H    ASP  32           H        ASP  32  10.574   7.149  -6.667
  223    HA   ASP  32           HA       ASP  32  12.016   9.523  -5.801
  224    HB2  ASP  32           HB2      ASP  32  13.186   8.460  -7.842
  225    HB3  ASP  32           HB3      ASP  32  11.781   9.003  -8.756
  226    H    GLY  33           H        GLY  33   9.684   8.379  -8.252
  227    HA2  GLY  33           HA2      GLY  33   7.397   8.944  -8.315
  228    HA3  GLY  33           HA3      GLY  33   7.710  10.248  -7.179
  229    H    THR  34           H        THR  34  10.069  11.058  -8.902
  230    HA   THR  34           HA       THR  34   8.517  12.385 -11.029
  231    HB   THR  34           HB       THR  34  10.131  14.292 -10.813
  232    HG1  THR  34           HG1      THR  34  11.818  13.313  -9.704
  233   HG21  THR  34          HG21      THR  34   7.825  13.847  -9.475
  234   HG22  THR  34          HG22      THR  34   8.749  15.345  -9.364
  235   HG23  THR  34          HG23      THR  34   8.931  14.103  -8.126
  236    H    PHE  35           H        PHE  35   9.145  11.853 -13.006
  237    HA   PHE  35           HA       PHE  35  11.987  11.292 -13.493
  238    HB2  PHE  35           HB2      PHE  35   9.649   9.635 -14.456
  239    HB3  PHE  35           HB3      PHE  35  11.295   9.461 -15.054
  240    HD1  PHE  35           HD1      PHE  35  12.944   9.582 -12.715
  241    HD2  PHE  35           HD2      PHE  35   9.116   7.787 -13.203
  242    HE1  PHE  35           HE1      PHE  35  13.445   8.023 -10.880
  243    HE2  PHE  35           HE2      PHE  35   9.611   6.225 -11.368
  244    HZ   PHE  35           HZ       PHE  35  11.777   6.342 -10.203
  Start of MODEL   14
    1    H1   SER   1           H        SER   1   1.137  -0.105   0.613
    2    HA   SER   1           HA       SER   1   2.124   0.883  -1.960
    3    HB2  SER   1           HB2      SER   1   3.572  -0.556   0.278
    4    HB3  SER   1           HB3      SER   1   4.325   0.066  -1.190
    5    HG   SER   1           HG       SER   1   4.589   1.736   0.110
    6    H    GLU   2           H        GLU   2   1.553  -0.358  -3.628
    7    HA   GLU   2           HA       GLU   2   1.536  -3.274  -3.294
    8    HB2  GLU   2           HB2      GLU   2   0.411  -1.639  -5.573
    9    HB3  GLU   2           HB3      GLU   2   0.178  -3.359  -5.300
   10    HG2  GLU   2           HG2      GLU   2  -1.038  -2.858  -3.233
   11    HG3  GLU   2           HG3      GLU   2  -0.829  -1.135  -3.540
   12    H    CYS   3           H        CYS   3   3.906  -1.446  -3.736
   13    HA   CYS   3           HA       CYS   3   4.972  -2.846  -6.099
   14    HB2  CYS   3           HB2      CYS   3   6.487  -0.765  -6.309
   15    HB3  CYS   3           HB3      CYS   3   4.817  -0.634  -6.854
   16    H    ARG   4           H        ARG   4   7.413  -2.911  -6.082
   17    HA   ARG   4           HA       ARG   4   8.267  -3.916  -3.509
   18    HB2  ARG   4           HB2      ARG   4   9.960  -3.720  -5.992
   19    HB3  ARG   4           HB3      ARG   4  10.131  -4.836  -4.644
   20    HG2  ARG   4           HG2      ARG   4   8.146  -6.020  -5.299
   21    HG3  ARG   4           HG3      ARG   4   7.813  -4.833  -6.562
   22    HD2  ARG   4           HD2      ARG   4   8.883  -6.284  -7.901
   23    HD3  ARG   4           HD3      ARG   4  10.341  -5.587  -7.199
   24    HE   ARG   4           HE       ARG   4  10.740  -7.589  -6.187
   25   HH11  ARG   4          HH11      ARG   4   7.363  -7.418  -7.015
   26   HH12  ARG   4          HH12      ARG   4   7.026  -9.044  -6.523
   27   HH21  ARG   4          HH21      ARG   4  10.309  -9.732  -5.537
   28   HH22  ARG   4          HH22      ARG   4   8.701 -10.359  -5.682
   29    H    TYR   5           H        TYR   5   9.598  -2.942  -2.102
   30    HA   TYR   5           HA       TYR   5  10.131  -0.188  -2.286
   31    HB2  TYR   5           HB2      TYR   5  10.731  -2.363  -0.399
   32    HB3  TYR   5           HB3      TYR   5  11.903  -1.051  -0.391
   33    HD1  TYR   5           HD1      TYR   5   8.987  -2.197   1.092
   34    HD2  TYR   5           HD2      TYR   5  10.719   1.378  -0.432
   35    HE1  TYR   5           HE1      TYR   5   7.476  -0.869   2.507
   36    HE2  TYR   5           HE2      TYR   5   9.214   2.716   0.981
   37    HH   TYR   5           HH       TYR   5   7.649   2.678   2.556
   38    H    LEU   6           H        LEU   6  12.423   0.695  -1.935
   39    HA   LEU   6           HA       LEU   6  13.903   0.557  -4.208
   40    HB2  LEU   6           HB2      LEU   6  14.139   2.054  -2.101
   41    HB3  LEU   6           HB3      LEU   6  15.309   0.843  -1.581
   42    HG   LEU   6           HG       LEU   6  16.337   1.348  -3.974
   43   HD11  LEU   6          HD11      LEU   6  14.408   3.491  -3.531
   44   HD12  LEU   6          HD12      LEU   6  15.233   2.991  -5.008
   45   HD13  LEU   6          HD13      LEU   6  16.041   4.066  -3.866
   46   HD21  LEU   6          HD21      LEU   6  16.762   3.291  -1.719
   47   HD22  LEU   6          HD22      LEU   6  17.932   2.727  -2.911
   48   HD23  LEU   6          HD23      LEU   6  17.338   1.625  -1.668
   49    H    PHE   7           H        PHE   7  15.427  -0.725  -5.098
   50    HA   PHE   7           HA       PHE   7  16.694  -2.569  -5.498
   51    HB2  PHE   7           HB2      PHE   7  17.065  -2.391  -2.504
   52    HB3  PHE   7           HB3      PHE   7  17.949  -3.517  -3.529
   53    HD1  PHE   7           HD1      PHE   7  17.908  -0.276  -2.119
   54    HD2  PHE   7           HD2      PHE   7  19.282  -2.484  -5.489
   55    HE1  PHE   7           HE1      PHE   7  19.590   1.462  -2.568
   56    HE2  PHE   7           HE2      PHE   7  20.966  -0.750  -5.943
   57    HZ   PHE   7           HZ       PHE   7  21.122   1.227  -4.481
   58    H    GLY   8           H        GLY   8  13.990  -3.032  -5.441
   59    HA2  GLY   8           HA2      GLY   8  13.456  -5.355  -3.785
   60    HA3  GLY   8           HA3      GLY   8  12.343  -4.599  -4.917
   61    H    GLY   9           H        GLY   9  15.148  -4.948  -6.573
   62    HA2  GLY   9           HA2      GLY   9  15.952  -6.474  -8.097
   63    HA3  GLY   9           HA3      GLY   9  15.132  -7.730  -7.180
   64    H    CYS  10           H        CYS  10  13.956  -4.898  -8.993
   65    HA   CYS  10           HA       CYS  10  11.862  -6.518 -10.168
   66    HB2  CYS  10           HB2      CYS  10  10.959  -4.461 -11.007
   67    HB3  CYS  10           HB3      CYS  10  11.482  -4.173  -9.351
   68    H    LYS  11           H        LYS  11  11.421  -5.868 -12.614
   69    HA   LYS  11           HA       LYS  11  13.946  -6.125 -14.103
   70    HB2  LYS  11           HB2      LYS  11  11.405  -7.616 -14.770
   71    HB3  LYS  11           HB3      LYS  11  12.968  -7.780 -15.559
   72    HG2  LYS  11           HG2      LYS  11  12.467  -8.463 -12.671
   73    HG3  LYS  11           HG3      LYS  11  12.393  -9.629 -13.995
   74    HD2  LYS  11           HD2      LYS  11  14.723  -9.176 -14.544
   75    HD3  LYS  11           HD3      LYS  11  14.802  -7.965 -13.262
   76    HE2  LYS  11           HE2      LYS  11  14.357  -9.695 -11.596
   77    HE3  LYS  11           HE3      LYS  11  14.250 -10.905 -12.873
   78    HZ1  LYS  11           HZ1      LYS  11  16.508 -10.165 -11.508
   79    HZ2  LYS  11           HZ2      LYS  11  16.685  -9.438 -13.024
   80    HZ3  LYS  11           HZ3      LYS  11  16.445 -11.109 -12.911
   81    H    THR  12           H        THR  12  10.572  -5.132 -14.097
   82    HA   THR  12           HA       THR  12  11.199  -3.229 -16.247
   83    HB   THR  12           HB       THR  12   8.866  -3.572 -17.132
   84    HG1  THR  12           HG1      THR  12   8.962  -6.051 -15.750
   85   HG21  THR  12          HG21      THR  12  10.686  -4.481 -18.382
   86   HG22  THR  12          HG22      THR  12   9.438  -5.724 -18.305
   87   HG23  THR  12          HG23      THR  12  10.857  -5.833 -17.264
   88    H    THR  13           H        THR  13   9.583  -1.448 -16.380
   89    HA   THR  13           HA       THR  13   9.288  -0.167 -13.914
   90    HB   THR  13           HB       THR  13   7.509   0.506 -16.237
   91    HG1  THR  13           HG1      THR  13  10.149   1.477 -16.131
   92   HG21  THR  13          HG21      THR  13   7.149   2.304 -14.967
   93   HG22  THR  13          HG22      THR  13   8.843   2.746 -15.187
   94   HG23  THR  13          HG23      THR  13   8.358   1.771 -13.800
   95    H    ALA  14           H        ALA  14   7.089  -2.217 -15.722
   96    HA   ALA  14           HA       ALA  14   4.722  -1.639 -14.319
   97    HB1  ALA  14           HB1      ALA  14   5.081  -2.986 -16.496
   98    HB2  ALA  14           HB2      ALA  14   5.296  -4.363 -15.416
   99    HB3  ALA  14           HB3      ALA  14   3.782  -3.461 -15.401
  100    H    ASP  15           H        ASP  15   7.492  -3.543 -13.492
  101    HA   ASP  15           HA       ASP  15   6.302  -5.199 -11.530
  102    HB2  ASP  15           HB2      ASP  15   9.162  -4.248 -11.802
  103    HB3  ASP  15           HB3      ASP  15   8.625  -5.531 -10.721
  104    H    CYS  16           H        CYS  16   7.430  -1.911 -11.512
  105    HA   CYS  16           HA       CYS  16   6.917  -1.755  -8.616
  106    HB2  CYS  16           HB2      CYS  16   8.425   0.326 -10.176
  107    HB3  CYS  16           HB3      CYS  16   8.469  -0.000  -8.446
  108    H    CYS  17           H        CYS  17   6.223   0.568  -7.973
  109    HA   CYS  17           HA       CYS  17   3.860   1.187  -9.567
  110    HB2  CYS  17           HB2      CYS  17   3.197   2.558  -7.603
  111    HB3  CYS  17           HB3      CYS  17   3.495   0.871  -7.194
  112    H    LYS  18           H        LYS  18   3.258   3.617  -9.549
  113    HA   LYS  18           HA       LYS  18   4.953   4.997 -11.228
  114    HB2  LYS  18           HB2      LYS  18   3.642   7.025 -10.614
  115    HB3  LYS  18           HB3      LYS  18   2.642   5.636 -11.017
  116    HG2  LYS  18           HG2      LYS  18   2.624   5.223  -8.459
  117    HG3  LYS  18           HG3      LYS  18   3.119   6.914  -8.361
  118    HD2  LYS  18           HD2      LYS  18   1.141   7.466  -9.816
  119    HD3  LYS  18           HD3      LYS  18   0.612   5.795  -9.605
  120    HE2  LYS  18           HE2      LYS  18   0.681   6.187  -7.129
  121    HE3  LYS  18           HE3      LYS  18   0.972   7.892  -7.471
  122    HZ1  LYS  18           HZ1      LYS  18  -1.342   6.544  -8.686
  123    HZ2  LYS  18           HZ2      LYS  18  -1.136   8.177  -8.298
  124    HZ3  LYS  18           HZ3      LYS  18  -1.429   7.048  -7.074
  125    H    HIS  19           H        HIS  19   4.709   5.204  -7.701
  126    HA   HIS  19           HA       HIS  19   6.412   7.332  -7.226
  127    HB2  HIS  19           HB2      HIS  19   6.181   4.815  -5.563
  128    HB3  HIS  19           HB3      HIS  19   6.770   6.379  -5.007
  129    HD1  HIS  19           HD1      HIS  19   4.412   5.085  -3.580
  130    HD2  HIS  19           HD2      HIS  19   4.002   7.733  -6.755
  131    HE1  HIS  19           HE1      HIS  19   2.100   6.048  -3.357
  132    H    LEU  20           H        LEU  20   7.167   4.034  -8.100
  133    HA   LEU  20           HA       LEU  20  10.038   4.617  -7.860
  134    HB2  LEU  20           HB2      LEU  20   8.741   1.938  -8.308
  135    HB3  LEU  20           HB3      LEU  20  10.420   2.257  -7.877
  136    HG   LEU  20           HG       LEU  20   8.319   3.158  -5.981
  137   HD11  LEU  20          HD11      LEU  20   7.524   0.945  -6.575
  138   HD12  LEU  20          HD12      LEU  20   8.220   0.932  -4.955
  139   HD13  LEU  20          HD13      LEU  20   9.134   0.273  -6.312
  140   HD21  LEU  20          HD21      LEU  20  11.154   2.713  -6.027
  141   HD22  LEU  20          HD22      LEU  20  10.411   1.759  -4.743
  142   HD23  LEU  20          HD23      LEU  20  10.165   3.505  -4.799
  143    H    GLY  21           H        GLY  21  11.405   3.508  -9.588
  144    HA2  GLY  21           HA2      GLY  21  10.079   3.447 -12.203
  145    HA3  GLY  21           HA3      GLY  21  11.390   4.595 -11.968
  146    H    CYS  22           H        CYS  22  10.545   1.199 -12.164
  147    HA   CYS  22           HA       CYS  22  12.966  -0.020 -11.693
  148    HB2  CYS  22           HB2      CYS  22  10.679  -1.056 -12.300
  149    HB3  CYS  22           HB3      CYS  22  11.203  -0.888 -13.972
  150    H    ARG  23           H        ARG  23  14.908   0.334 -12.518
  151    HA   ARG  23           HA       ARG  23  15.176   1.579 -15.136
  152    HB2  ARG  23           HB2      ARG  23  17.062   1.068 -12.854
  153    HB3  ARG  23           HB3      ARG  23  17.669   1.522 -14.441
  154    HG2  ARG  23           HG2      ARG  23  16.320   3.574 -14.351
  155    HG3  ARG  23           HG3      ARG  23  15.774   3.123 -12.735
  156    HD2  ARG  23           HD2      ARG  23  17.521   4.540 -12.246
  157    HD3  ARG  23           HD3      ARG  23  18.329   2.974 -12.226
  158    HE   ARG  23           HE       ARG  23  18.670   3.767 -14.772
  159   HH11  ARG  23          HH11      ARG  23  19.211   5.359 -11.724
  160   HH12  ARG  23          HH12      ARG  23  20.519   6.330 -12.315
  161   HH21  ARG  23          HH21      ARG  23  20.389   5.040 -15.562
  162   HH22  ARG  23          HH22      ARG  23  21.188   6.149 -14.499
  163    H    THR  24           H        THR  24  16.264   0.685 -16.869
  164    HA   THR  24           HA       THR  24  16.280  -2.203 -16.958
  165    HB   THR  24           HB       THR  24  15.450  -0.800 -18.860
  166    HG1  THR  24           HG1      THR  24  17.644  -2.364 -19.727
  167   HG21  THR  24          HG21      THR  24  18.313  -0.358 -19.623
  168   HG22  THR  24          HG22      THR  24  17.478   0.805 -18.592
  169   HG23  THR  24          HG23      THR  24  16.862   0.457 -20.207
  170    H    ASP  25           H        ASP  25  18.542   0.279 -16.360
  171    HA   ASP  25           HA       ASP  25  20.836  -1.348 -17.128
  172    HB2  ASP  25           HB2      ASP  25  20.541   1.265 -17.376
  173    HB3  ASP  25           HB3      ASP  25  21.114   1.268 -15.709
  174    H    LEU  26           H        LEU  26  19.292  -0.036 -14.238
  175    HA   LEU  26           HA       LEU  26  21.239  -1.375 -12.525
  176    HB2  LEU  26           HB2      LEU  26  19.021   0.583 -12.033
  177    HB3  LEU  26           HB3      LEU  26  19.776  -0.297 -10.706
  178    HG   LEU  26           HG       LEU  26  21.977   0.712 -11.823
  179   HD11  LEU  26          HD11      LEU  26  19.900   2.021 -13.225
  180   HD12  LEU  26          HD12      LEU  26  21.637   2.313 -13.313
  181   HD13  LEU  26          HD13      LEU  26  20.651   3.205 -12.155
  182   HD21  LEU  26          HD21      LEU  26  20.394   2.604 -10.157
  183   HD22  LEU  26          HD22      LEU  26  22.080   2.106 -10.010
  184   HD23  LEU  26          HD23      LEU  26  20.790   1.018  -9.493
  185    H    TYR  27           H        TYR  27  17.903  -1.607 -13.538
  186    HA   TYR  27           HA       TYR  27  16.333  -3.233 -13.282
  187    HB2  TYR  27           HB2      TYR  27  18.892  -4.654 -12.887
  188    HB3  TYR  27           HB3      TYR  27  17.470  -5.470 -12.246
  189    HD1  TYR  27           HD1      TYR  27  17.650  -3.334 -15.276
  190    HD2  TYR  27           HD2      TYR  27  17.244  -7.276 -13.731
  191    HE1  TYR  27           HE1      TYR  27  17.109  -4.155 -17.531
  192    HE2  TYR  27           HE2      TYR  27  16.703  -8.109 -15.981
  193    HH   TYR  27           HH       TYR  27  16.947  -6.055 -18.809
  194    H    TYR  28           H        TYR  28  16.110  -1.467 -11.382
  195    HA   TYR  28           HA       TYR  28  15.164  -2.971  -9.129
  196    HB2  TYR  28           HB2      TYR  28  16.589  -2.254  -7.460
  197    HB3  TYR  28           HB3      TYR  28  17.717  -2.435  -8.799
  198    HD1  TYR  28           HD1      TYR  28  17.644  -0.124 -10.352
  199    HD2  TYR  28           HD2      TYR  28  17.032  -0.417  -6.152
  200    HE1  TYR  28           HE1      TYR  28  18.334   2.222 -10.094
  201    HE2  TYR  28           HE2      TYR  28  17.719   1.929  -5.882
  202    HH   TYR  28           HH       TYR  28  17.884   3.960  -7.181
  203    H    CYS  29           H        CYS  29  13.703  -1.818  -7.851
  204    HA   CYS  29           HA       CYS  29  12.369   0.318  -9.150
  205    HB2  CYS  29           HB2      CYS  29  12.066  -0.704  -6.319
  206    HB3  CYS  29           HB3      CYS  29  10.937   0.365  -7.144
  207    H    ALA  30           H        ALA  30  13.018   2.356  -9.224
  208    HA   ALA  30           HA       ALA  30  14.729   3.407  -7.093
  209    HB1  ALA  30           HB1      ALA  30  14.850   5.379  -8.802
  210    HB2  ALA  30           HB2      ALA  30  15.758   3.896  -9.092
  211    HB3  ALA  30           HB3      ALA  30  14.235   4.175  -9.933
  212    H    TRP  31           H        TRP  31  13.464   4.074  -5.441
  213    HA   TRP  31           HA       TRP  31  10.909   5.244  -5.726
  214    HB2  TRP  31           HB2      TRP  31  11.671   4.145  -3.652
  215    HB3  TRP  31           HB3      TRP  31  12.837   5.443  -3.401
  216    HD1  TRP  31           HD1      TRP  31  11.668   7.980  -3.072
  217    HE1  TRP  31           HE1      TRP  31   9.531   8.580  -1.770
  218    HE3  TRP  31           HE3      TRP  31   9.480   3.362  -2.929
  219    HZ2  TRP  31           HZ2      TRP  31   7.222   7.271  -0.810
  220    HZ3  TRP  31           HZ3      TRP  31   7.307   3.121  -1.799
  221    HH2  TRP  31           HH2      TRP  31   6.204   5.036  -0.762
  222    H    ASP  32           H        ASP  32  10.540   7.123  -6.696
  223    HA   ASP  32           HA       ASP  32  11.977   9.485  -5.811
  224    HB2  ASP  32           HB2      ASP  32  13.213   8.517  -7.816
  225    HB3  ASP  32           HB3      ASP  32  11.788   8.919  -8.769
  226    H    GLY  33           H        GLY  33   9.666   8.360  -8.290
  227    HA2  GLY  33           HA2      GLY  33   7.376   8.915  -8.357
  228    HA3  GLY  33           HA3      GLY  33   7.678  10.208  -7.206
  229    H    THR  34           H        THR  34  10.039  11.046  -8.910
  230    HA   THR  34           HA       THR  34   8.479  12.429 -10.995
  231    HB   THR  34           HB       THR  34  10.276  14.231 -10.794
  232    HG1  THR  34           HG1      THR  34  11.398  14.257  -8.814
  233   HG21  THR  34          HG21      THR  34   8.500  13.794  -8.390
  234   HG22  THR  34          HG22      THR  34   7.968  14.468  -9.931
  235   HG23  THR  34          HG23      THR  34   9.152  15.333  -8.950
  236    H    PHE  35           H        PHE  35   9.398  12.703 -13.023
  237    HA   PHE  35           HA       PHE  35  12.057  11.671 -13.549
  238    HB2  PHE  35           HB2      PHE  35   9.557  10.264 -14.348
  239    HB3  PHE  35           HB3      PHE  35  10.874  10.311 -15.515
  240    HD1  PHE  35           HD1      PHE  35  13.269   9.901 -14.166
  241    HD2  PHE  35           HD2      PHE  35   9.449   8.288 -13.208
  242    HE1  PHE  35           HE1      PHE  35  14.357   8.016 -13.016
  243    HE2  PHE  35           HE2      PHE  35  10.529   6.402 -12.057
  244    HZ   PHE  35           HZ       PHE  35  12.987   6.264 -11.959
  Start of MODEL   15
    1    H1   SER   1           H        SER   1   0.512   1.455  -0.740
    2    HA   SER   1           HA       SER   1   2.948   0.596  -1.551
    3    HB2  SER   1           HB2      SER   1   2.355   0.847   0.810
    4    HB3  SER   1           HB3      SER   1   1.327  -0.583   0.721
    5    HG   SER   1           HG       SER   1   3.052  -1.847   0.702
    6    H    GLU   2           H        GLU   2   1.665  -0.363  -3.634
    7    HA   GLU   2           HA       GLU   2   1.542  -3.282  -3.275
    8    HB2  GLU   2           HB2      GLU   2   0.301  -3.262  -5.462
    9    HB3  GLU   2           HB3      GLU   2  -0.536  -2.480  -4.128
   10    HG2  GLU   2           HG2      GLU   2  -0.250  -0.371  -5.005
   11    HG3  GLU   2           HG3      GLU   2   1.140  -0.849  -5.977
   12    H    CYS   3           H        CYS   3   3.911  -1.455  -3.724
   13    HA   CYS   3           HA       CYS   3   4.969  -2.855  -6.091
   14    HB2  CYS   3           HB2      CYS   3   6.486  -0.776  -6.303
   15    HB3  CYS   3           HB3      CYS   3   4.815  -0.643  -6.843
   16    H    ARG   4           H        ARG   4   7.413  -2.919  -6.079
   17    HA   ARG   4           HA       ARG   4   8.271  -3.928  -3.509
   18    HB2  ARG   4           HB2      ARG   4   9.958  -3.733  -5.998
   19    HB3  ARG   4           HB3      ARG   4  10.131  -4.850  -4.651
   20    HG2  ARG   4           HG2      ARG   4   8.142  -6.030  -5.302
   21    HG3  ARG   4           HG3      ARG   4   7.809  -4.843  -6.564
   22    HD2  ARG   4           HD2      ARG   4   8.878  -6.286  -7.908
   23    HD3  ARG   4           HD3      ARG   4  10.340  -5.606  -7.197
   24    HE   ARG   4           HE       ARG   4  10.691  -7.588  -6.105
   25   HH11  ARG   4          HH11      ARG   4   7.415  -7.493  -7.281
   26   HH12  ARG   4          HH12      ARG   4   7.086  -9.146  -6.880
   27   HH21  ARG   4          HH21      ARG   4  10.269  -9.766  -5.574
   28   HH22  ARG   4          HH22      ARG   4   8.708 -10.437  -5.908
   29    H    TYR   5           H        TYR   5   9.584  -2.944  -2.099
   30    HA   TYR   5           HA       TYR   5  10.127  -0.196  -2.287
   31    HB2  TYR   5           HB2      TYR   5  10.733  -2.372  -0.401
   32    HB3  TYR   5           HB3      TYR   5  11.900  -1.055  -0.392
   33    HD1  TYR   5           HD1      TYR   5   8.988  -2.211   1.091
   34    HD2  TYR   5           HD2      TYR   5  10.712   1.370  -0.429
   35    HE1  TYR   5           HE1      TYR   5   7.475  -0.888   2.508
   36    HE2  TYR   5           HE2      TYR   5   9.204   2.703   0.985
   37    HH   TYR   5           HH       TYR   5   7.452   2.654   2.366
   38    H    LEU   6           H        LEU   6  12.419   0.688  -1.940
   39    HA   LEU   6           HA       LEU   6  13.895   0.548  -4.213
   40    HB2  LEU   6           HB2      LEU   6  14.135   2.055  -2.121
   41    HB3  LEU   6           HB3      LEU   6  15.295   0.842  -1.583
   42    HG   LEU   6           HG       LEU   6  16.349   1.318  -3.965
   43   HD11  LEU   6          HD11      LEU   6  14.424   3.481  -3.566
   44   HD12  LEU   6          HD12      LEU   6  15.236   2.937  -5.033
   45   HD13  LEU   6          HD13      LEU   6  16.062   4.032  -3.924
   46   HD21  LEU   6          HD21      LEU   6  16.761   3.326  -1.769
   47   HD22  LEU   6          HD22      LEU   6  17.946   2.673  -2.901
   48   HD23  LEU   6          HD23      LEU   6  17.292   1.651  -1.621
   49    H    PHE   7           H        PHE   7  15.423  -0.732  -5.102
   50    HA   PHE   7           HA       PHE   7  16.694  -2.577  -5.498
   51    HB2  PHE   7           HB2      PHE   7  17.058  -2.407  -2.503
   52    HB3  PHE   7           HB3      PHE   7  17.951  -3.519  -3.535
   53    HD1  PHE   7           HD1      PHE   7  17.934  -0.323  -2.061
   54    HD2  PHE   7           HD2      PHE   7  19.234  -2.430  -5.524
   55    HE1  PHE   7           HE1      PHE   7  19.605   1.429  -2.496
   56    HE2  PHE   7           HE2      PHE   7  20.907  -0.680  -5.964
   57    HZ   PHE   7           HZ       PHE   7  21.094   1.252  -4.450
   58    H    GLY   8           H        GLY   8  13.982  -3.033  -5.433
   59    HA2  GLY   8           HA2      GLY   8  13.451  -5.360  -3.783
   60    HA3  GLY   8           HA3      GLY   8  12.337  -4.604  -4.914
   61    H    GLY   9           H        GLY   9  15.144  -4.952  -6.570
   62    HA2  GLY   9           HA2      GLY   9  15.947  -6.477  -8.095
   63    HA3  GLY   9           HA3      GLY   9  15.128  -7.733  -7.178
   64    H    CYS  10           H        CYS  10  13.952  -4.900  -8.991
   65    HA   CYS  10           HA       CYS  10  11.858  -6.520 -10.166
   66    HB2  CYS  10           HB2      CYS  10  10.956  -4.462 -11.005
   67    HB3  CYS  10           HB3      CYS  10  11.480  -4.176  -9.349
   68    H    LYS  11           H        LYS  11  11.419  -5.858 -12.613
   69    HA   LYS  11           HA       LYS  11  13.944  -6.120 -14.102
   70    HB2  LYS  11           HB2      LYS  11  11.401  -7.699 -14.522
   71    HB3  LYS  11           HB3      LYS  11  12.744  -7.677 -15.658
   72    HG2  LYS  11           HG2      LYS  11  14.074  -8.361 -13.443
   73    HG3  LYS  11           HG3      LYS  11  12.488  -9.026 -13.043
   74    HD2  LYS  11           HD2      LYS  11  14.044  -9.598 -15.567
   75    HD3  LYS  11           HD3      LYS  11  13.925 -10.672 -14.172
   76    HE2  LYS  11           HE2      LYS  11  11.411 -10.588 -14.510
   77    HE3  LYS  11           HE3      LYS  11  11.743  -9.824 -16.062
   78    HZ1  LYS  11           HZ1      LYS  11  13.118 -11.787 -16.621
   79    HZ2  LYS  11           HZ2      LYS  11  11.483 -12.157 -16.399
   80    HZ3  LYS  11           HZ3      LYS  11  12.605 -12.526 -15.188
   81    H    THR  12           H        THR  12  10.569  -5.131 -14.097
   82    HA   THR  12           HA       THR  12  11.194  -3.228 -16.249
   83    HB   THR  12           HB       THR  12   8.912  -3.570 -17.185
   84    HG1  THR  12           HG1      THR  12   8.910  -5.827 -15.438
   85   HG21  THR  12          HG21      THR  12   9.431  -5.592 -18.403
   86   HG22  THR  12          HG22      THR  12  10.579  -6.087 -17.158
   87   HG23  THR  12          HG23      THR  12  10.914  -4.671 -18.154
   88    H    THR  13           H        THR  13   9.580  -1.446 -16.380
   89    HA   THR  13           HA       THR  13   9.289  -0.163 -13.915
   90    HB   THR  13           HB       THR  13   7.479   0.539 -16.195
   91    HG1  THR  13           HG1      THR  13  10.295   0.579 -16.182
   92   HG21  THR  13          HG21      THR  13   7.383   2.535 -15.183
   93   HG22  THR  13          HG22      THR  13   9.135   2.606 -14.988
   94   HG23  THR  13          HG23      THR  13   8.149   1.750 -13.803
   95    H    ALA  14           H        ALA  14   7.086  -2.209 -15.722
   96    HA   ALA  14           HA       ALA  14   4.722  -1.626 -14.314
   97    HB1  ALA  14           HB1      ALA  14   4.902  -2.880 -16.480
   98    HB2  ALA  14           HB2      ALA  14   5.417  -4.285 -15.544
   99    HB3  ALA  14           HB3      ALA  14   3.814  -3.595 -15.290
  100    H    ASP  15           H        ASP  15   7.490  -3.536 -13.494
  101    HA   ASP  15           HA       ASP  15   6.299  -5.197 -11.538
  102    HB2  ASP  15           HB2      ASP  15   9.159  -4.245 -11.803
  103    HB3  ASP  15           HB3      ASP  15   8.620  -5.535 -10.732
  104    H    CYS  16           H        CYS  16   7.428  -1.909 -11.510
  105    HA   CYS  16           HA       CYS  16   6.916  -1.763  -8.613
  106    HB2  CYS  16           HB2      CYS  16   8.424   0.324 -10.169
  107    HB3  CYS  16           HB3      CYS  16   8.467  -0.006  -8.439
  108    H    CYS  17           H        CYS  17   6.223   0.559  -7.964
  109    HA   CYS  17           HA       CYS  17   3.857   1.182  -9.552
  110    HB2  CYS  17           HB2      CYS  17   3.197   2.549  -7.585
  111    HB3  CYS  17           HB3      CYS  17   3.497   0.862  -7.179
  112    H    LYS  18           H        LYS  18   3.255   3.612  -9.532
  113    HA   LYS  18           HA       LYS  18   4.948   4.994 -11.211
  114    HB2  LYS  18           HB2      LYS  18   3.637   7.020 -10.600
  115    HB3  LYS  18           HB3      LYS  18   2.634   5.628 -10.992
  116    HG2  LYS  18           HG2      LYS  18   2.633   5.227  -8.430
  117    HG3  LYS  18           HG3      LYS  18   3.122   6.921  -8.345
  118    HD2  LYS  18           HD2      LYS  18   1.108   7.297  -9.956
  119    HD3  LYS  18           HD3      LYS  18   0.569   5.729  -9.350
  120    HE2  LYS  18           HE2      LYS  18   0.237   6.518  -7.216
  121    HE3  LYS  18           HE3      LYS  18   1.419   7.815  -7.397
  122    HZ1  LYS  18           HZ1      LYS  18  -0.108   9.028  -8.762
  123    HZ2  LYS  18           HZ2      LYS  18  -0.900   8.603  -7.329
  124    HZ3  LYS  18           HZ3      LYS  18  -1.221   7.752  -8.756
  125    H    HIS  19           H        HIS  19   4.707   5.199  -7.684
  126    HA   HIS  19           HA       HIS  19   6.411   7.325  -7.209
  127    HB2  HIS  19           HB2      HIS  19   6.181   4.807  -5.547
  128    HB3  HIS  19           HB3      HIS  19   6.772   6.370  -4.991
  129    HD1  HIS  19           HD1      HIS  19   4.413   5.074  -3.564
  130    HD2  HIS  19           HD2      HIS  19   4.004   7.731  -6.733
  131    HE1  HIS  19           HE1      HIS  19   2.102   6.038  -3.338
  132    H    LEU  20           H        LEU  20   7.165   4.029  -8.088
  133    HA   LEU  20           HA       LEU  20  10.036   4.611  -7.848
  134    HB2  LEU  20           HB2      LEU  20   8.738   1.932  -8.298
  135    HB3  LEU  20           HB3      LEU  20  10.417   2.250  -7.869
  136    HG   LEU  20           HG       LEU  20   8.318   3.148  -5.970
  137   HD11  LEU  20          HD11      LEU  20   8.218   0.923  -4.946
  138   HD12  LEU  20          HD12      LEU  20   9.136   0.267  -6.300
  139   HD13  LEU  20          HD13      LEU  20   7.526   0.934  -6.569
  140   HD21  LEU  20          HD21      LEU  20  10.170   3.504  -4.798
  141   HD22  LEU  20          HD22      LEU  20  11.155   2.697  -6.018
  142   HD23  LEU  20          HD23      LEU  20  10.406   1.758  -4.726
  143    H    GLY  21           H        GLY  21  11.401   3.503  -9.579
  144    HA2  GLY  21           HA2      GLY  21  10.074   3.444 -12.193
  145    HA3  GLY  21           HA3      GLY  21  11.383   4.593 -11.957
  146    H    CYS  22           H        CYS  22  10.541   1.196 -12.157
  147    HA   CYS  22           HA       CYS  22  12.963  -0.020 -11.689
  148    HB2  CYS  22           HB2      CYS  22  10.677  -1.058 -12.293
  149    HB3  CYS  22           HB3      CYS  22  11.200  -0.888 -13.966
  150    H    ARG  23           H        ARG  23  14.904   0.336 -12.516
  151    HA   ARG  23           HA       ARG  23  15.167   1.581 -15.135
  152    HB2  ARG  23           HB2      ARG  23  17.026   1.112 -12.828
  153    HB3  ARG  23           HB3      ARG  23  17.674   1.492 -14.417
  154    HG2  ARG  23           HG2      ARG  23  16.191   3.535 -14.396
  155    HG3  ARG  23           HG3      ARG  23  15.895   3.185 -12.692
  156    HD2  ARG  23           HD2      ARG  23  17.663   4.764 -12.770
  157    HD3  ARG  23           HD3      ARG  23  18.386   3.209 -12.363
  158    HE   ARG  23           HE       ARG  23  18.653   3.288 -15.037
  159   HH11  ARG  23          HH11      ARG  23  19.415   5.583 -12.532
  160   HH12  ARG  23          HH12      ARG  23  20.744   6.282 -13.397
  161   HH21  ARG  23          HH21      ARG  23  20.400   4.199 -16.185
  162   HH22  ARG  23          HH22      ARG  23  21.303   5.495 -15.475
  163    H    THR  24           H        THR  24  16.256   0.687 -16.866
  164    HA   THR  24           HA       THR  24  16.285  -2.202 -16.948
  165    HB   THR  24           HB       THR  24  15.444  -0.813 -18.854
  166    HG1  THR  24           HG1      THR  24  16.338  -2.200 -20.385
  167   HG21  THR  24          HG21      THR  24  18.367  -0.266 -19.366
  168   HG22  THR  24          HG22      THR  24  17.236   0.917 -18.708
  169   HG23  THR  24          HG23      THR  24  16.996   0.274 -20.333
  170    H    ASP  25           H        ASP  25  18.536   0.289 -16.350
  171    HA   ASP  25           HA       ASP  25  20.837  -1.326 -17.123
  172    HB2  ASP  25           HB2      ASP  25  20.905   1.060 -17.643
  173    HB3  ASP  25           HB3      ASP  25  20.673   1.455 -15.942
  174    H    LEU  26           H        LEU  26  19.285  -0.031 -14.230
  175    HA   LEU  26           HA       LEU  26  21.241  -1.364 -12.522
  176    HB2  LEU  26           HB2      LEU  26  19.019   0.587 -12.022
  177    HB3  LEU  26           HB3      LEU  26  19.781  -0.292 -10.698
  178    HG   LEU  26           HG       LEU  26  21.977   0.723 -11.814
  179   HD11  LEU  26          HD11      LEU  26  21.705   2.464 -13.175
  180   HD12  LEU  26          HD12      LEU  26  20.439   3.162 -12.164
  181   HD13  LEU  26          HD13      LEU  26  20.034   1.926 -13.356
  182   HD21  LEU  26          HD21      LEU  26  22.084   2.076  -9.987
  183   HD22  LEU  26          HD22      LEU  26  20.737   1.049  -9.493
  184   HD23  LEU  26          HD23      LEU  26  20.425   2.647 -10.172
  185    H    TYR  27           H        TYR  27  17.906  -1.606 -13.537
  186    HA   TYR  27           HA       TYR  27  16.339  -3.234 -13.280
  187    HB2  TYR  27           HB2      TYR  27  18.901  -4.649 -12.880
  188    HB3  TYR  27           HB3      TYR  27  17.480  -5.468 -12.243
  189    HD1  TYR  27           HD1      TYR  27  17.657  -3.329 -15.272
  190    HD2  TYR  27           HD2      TYR  27  17.269  -7.276 -13.731
  191    HE1  TYR  27           HE1      TYR  27  17.124  -4.150 -17.529
  192    HE2  TYR  27           HE2      TYR  27  16.738  -8.109 -15.984
  193    HH   TYR  27           HH       TYR  27  15.676  -6.899 -18.189
  194    H    TYR  28           H        TYR  28  16.109  -1.469 -11.382
  195    HA   TYR  28           HA       TYR  28  15.163  -2.973  -9.130
  196    HB2  TYR  28           HB2      TYR  28  16.586  -2.257  -7.459
  197    HB3  TYR  28           HB3      TYR  28  17.716  -2.437  -8.796
  198    HD1  TYR  28           HD1      TYR  28  17.642  -0.124 -10.349
  199    HD2  TYR  28           HD2      TYR  28  17.032  -0.421  -6.149
  200    HE1  TYR  28           HE1      TYR  28  18.331   2.223 -10.090
  201    HE2  TYR  28           HE2      TYR  28  17.717   1.925  -5.878
  202    HH   TYR  28           HH       TYR  28  18.163   3.850  -6.961
  203    H    CYS  29           H        CYS  29  13.703  -1.819  -7.852
  204    HA   CYS  29           HA       CYS  29  12.368   0.315  -9.152
  205    HB2  CYS  29           HB2      CYS  29  12.067  -0.704  -6.319
  206    HB3  CYS  29           HB3      CYS  29  10.936   0.364  -7.145
  207    H    ALA  30           H        ALA  30  13.014   2.353  -9.230
  208    HA   ALA  30           HA       ALA  30  14.730   3.407  -7.104
  209    HB1  ALA  30           HB1      ALA  30  14.286   4.080  -9.957
  210    HB2  ALA  30           HB2      ALA  30  14.746   5.392  -8.870
  211    HB3  ALA  30           HB3      ALA  30  15.786   3.976  -9.034
  212    H    TRP  31           H        TRP  31  13.468   4.071  -5.447
  213    HA   TRP  31           HA       TRP  31  10.910   5.238  -5.724
  214    HB2  TRP  31           HB2      TRP  31  11.681   4.142  -3.653
  215    HB3  TRP  31           HB3      TRP  31  12.845   5.441  -3.406
  216    HD1  TRP  31           HD1      TRP  31  11.675   7.975  -3.071
  217    HE1  TRP  31           HE1      TRP  31   9.539   8.573  -1.764
  218    HE3  TRP  31           HE3      TRP  31   9.491   3.355  -2.926
  219    HZ2  TRP  31           HZ2      TRP  31   7.235   7.260  -0.799
  220    HZ3  TRP  31           HZ3      TRP  31   7.321   3.111  -1.792
  221    HH2  TRP  31           HH2      TRP  31   6.218   5.024  -0.750
  222    H    ASP  32           H        ASP  32  10.541   7.114  -6.703
  223    HA   ASP  32           HA       ASP  32  11.968   9.482  -5.816
  224    HB2  ASP  32           HB2      ASP  32  13.211   8.502  -7.820
  225    HB3  ASP  32           HB3      ASP  32  11.794   8.926  -8.775
  226    H    GLY  33           H        GLY  33   9.676   8.344  -8.306
  227    HA2  GLY  33           HA2      GLY  33   7.383   8.891  -8.387
  228    HA3  GLY  33           HA3      GLY  33   7.675  10.188  -7.239
  229    H    THR  34           H        THR  34  10.044  11.029  -8.931
  230    HA   THR  34           HA       THR  34   8.485  12.430 -11.005
  231    HB   THR  34           HB       THR  34  10.338  14.183 -10.836
  232    HG1  THR  34           HG1      THR  34  10.736  12.986  -8.285
  233   HG21  THR  34          HG21      THR  34   8.457  13.730  -8.517
  234   HG22  THR  34          HG22      THR  34   8.120  14.632  -9.994
  235   HG23  THR  34          HG23      THR  34   9.304  15.243  -8.839
  236    H    PHE  35           H        PHE  35   8.988  11.922 -13.024
  237    HA   PHE  35           HA       PHE  35  11.765  11.273 -13.693
  238    HB2  PHE  35           HB2      PHE  35   9.356   9.585 -14.382
  239    HB3  PHE  35           HB3      PHE  35  10.919   9.415 -15.175
  240    HD1  PHE  35           HD1      PHE  35  12.852   9.566 -13.086
  241    HD2  PHE  35           HD2      PHE  35   8.989   7.782 -13.016
  242    HE1  PHE  35           HE1      PHE  35  13.592   8.044 -11.301
  243    HE2  PHE  35           HE2      PHE  35   9.722   6.257 -11.229
  244    HZ   PHE  35           HZ       PHE  35  12.027   6.386 -10.371
  Start of MODEL   16
    1    H1   SER   1           H        SER   1  -0.933   1.237  -2.818
    2    HA   SER   1           HA       SER   1   0.218  -0.156  -5.089
    3    HB2  SER   1           HB2      SER   1   1.596   1.925  -3.396
    4    HB3  SER   1           HB3      SER   1   1.909   1.503  -5.079
    5    HG   SER   1           HG       SER   1   0.569   3.483  -4.490
    6    H    GLU   2           H        GLU   2   0.891  -2.166  -4.604
    7    HA   GLU   2           HA       GLU   2   2.436  -2.587  -2.148
    8    HB2  GLU   2           HB2      GLU   2   0.417  -4.059  -2.968
    9    HB3  GLU   2           HB3      GLU   2   1.639  -4.809  -3.987
   10    HG2  GLU   2           HG2      GLU   2   2.803  -5.669  -2.188
   11    HG3  GLU   2           HG3      GLU   2   2.115  -4.506  -1.055
   12    H    CYS   3           H        CYS   3   3.370  -1.315  -4.728
   13    HA   CYS   3           HA       CYS   3   5.052  -2.916  -6.205
   14    HB2  CYS   3           HB2      CYS   3   6.471  -0.812  -6.454
   15    HB3  CYS   3           HB3      CYS   3   4.776  -0.676  -6.910
   16    H    ARG   4           H        ARG   4   7.421  -3.099  -6.141
   17    HA   ARG   4           HA       ARG   4   8.281  -3.994  -3.549
   18    HB2  ARG   4           HB2      ARG   4  10.023  -3.794  -5.996
   19    HB3  ARG   4           HB3      ARG   4  10.159  -4.914  -4.646
   20    HG2  ARG   4           HG2      ARG   4   8.169  -6.079  -5.359
   21    HG3  ARG   4           HG3      ARG   4   7.917  -4.909  -6.656
   22    HD2  ARG   4           HD2      ARG   4   9.014  -6.433  -7.897
   23    HD3  ARG   4           HD3      ARG   4  10.445  -5.687  -7.188
   24    HE   ARG   4           HE       ARG   4  10.851  -7.655  -6.122
   25   HH11  ARG   4          HH11      ARG   4   7.462  -7.510  -6.903
   26   HH12  ARG   4          HH12      ARG   4   7.126  -9.107  -6.320
   27   HH21  ARG   4          HH21      ARG   4  10.421  -9.758  -5.352
   28   HH22  ARG   4          HH22      ARG   4   8.810 -10.385  -5.438
   29    H    TYR   5           H        TYR   5   9.565  -2.980  -2.131
   30    HA   TYR   5           HA       TYR   5  10.061  -0.221  -2.340
   31    HB2  TYR   5           HB2      TYR   5  10.660  -2.364  -0.417
   32    HB3  TYR   5           HB3      TYR   5  11.815  -1.036  -0.406
   33    HD1  TYR   5           HD1      TYR   5   8.887  -2.200   1.041
   34    HD2  TYR   5           HD2      TYR   5  10.609   1.377  -0.490
   35    HE1  TYR   5           HE1      TYR   5   7.337  -0.873   2.414
   36    HE2  TYR   5           HE2      TYR   5   9.065   2.714   0.881
   37    HH   TYR   5           HH       TYR   5   7.716   2.486   2.886
   38    H    LEU   6           H        LEU   6  12.336   0.699  -1.958
   39    HA   LEU   6           HA       LEU   6  13.854   0.581  -4.198
   40    HB2  LEU   6           HB2      LEU   6  14.054   2.065  -2.082
   41    HB3  LEU   6           HB3      LEU   6  15.218   0.854  -1.547
   42    HG   LEU   6           HG       LEU   6  16.246   1.394  -3.958
   43   HD11  LEU   6          HD11      LEU   6  15.118   3.095  -4.887
   44   HD12  LEU   6          HD12      LEU   6  16.052   4.094  -3.774
   45   HD13  LEU   6          HD13      LEU   6  14.412   3.602  -3.353
   46   HD21  LEU   6          HD21      LEU   6  17.187   1.585  -1.560
   47   HD22  LEU   6          HD22      LEU   6  16.796   3.298  -1.713
   48   HD23  LEU   6          HD23      LEU   6  17.924   2.546  -2.842
   49    H    PHE   7           H        PHE   7  15.391  -0.689  -5.081
   50    HA   PHE   7           HA       PHE   7  16.670  -2.527  -5.480
   51    HB2  PHE   7           HB2      PHE   7  17.044  -2.211  -2.509
   52    HB3  PHE   7           HB3      PHE   7  17.825  -3.513  -3.399
   53    HD1  PHE   7           HD1      PHE   7  17.914  -0.033  -2.526
   54    HD2  PHE   7           HD2      PHE   7  19.406  -2.936  -5.258
   55    HE1  PHE   7           HE1      PHE   7  19.745   1.491  -3.141
   56    HE2  PHE   7           HE2      PHE   7  21.240  -1.417  -5.877
   57    HZ   PHE   7           HZ       PHE   7  21.411   0.801  -4.818
   58    H    GLY   8           H        GLY   8  13.979  -3.017  -5.461
   59    HA2  GLY   8           HA2      GLY   8  13.462  -5.360  -3.816
   60    HA3  GLY   8           HA3      GLY   8  12.334  -4.590  -4.922
   61    H    GLY   9           H        GLY   9  15.234  -4.978  -6.498
   62    HA2  GLY   9           HA2      GLY   9  15.995  -6.449  -8.090
   63    HA3  GLY   9           HA3      GLY   9  15.182  -7.719  -7.189
   64    H    CYS  10           H        CYS  10  14.008  -4.866  -8.974
   65    HA   CYS  10           HA       CYS  10  11.902  -6.465 -10.154
   66    HB2  CYS  10           HB2      CYS  10  10.996  -4.410 -10.955
   67    HB3  CYS  10           HB3      CYS  10  11.582  -4.100  -9.324
   68    H    LYS  11           H        LYS  11  11.459  -5.870 -12.590
   69    HA   LYS  11           HA       LYS  11  13.980  -6.102 -14.090
   70    HB2  LYS  11           HB2      LYS  11  11.479  -7.762 -14.362
   71    HB3  LYS  11           HB3      LYS  11  12.666  -7.641 -15.654
   72    HG2  LYS  11           HG2      LYS  11  14.387  -8.473 -14.053
   73    HG3  LYS  11           HG3      LYS  11  13.090  -8.750 -12.889
   74    HD2  LYS  11           HD2      LYS  11  13.282 -10.828 -13.873
   75    HD3  LYS  11           HD3      LYS  11  12.004 -10.094 -14.845
   76    HE2  LYS  11           HE2      LYS  11  13.871  -9.348 -16.418
   77    HE3  LYS  11           HE3      LYS  11  14.904 -10.475 -15.540
   78    HZ1  LYS  11           HZ1      LYS  11  14.159 -11.967 -16.998
   79    HZ2  LYS  11           HZ2      LYS  11  12.858 -11.005 -17.490
   80    HZ3  LYS  11           HZ3      LYS  11  12.722 -11.967 -16.105
   81    H    THR  12           H        THR  12  10.589  -5.163 -14.089
   82    HA   THR  12           HA       THR  12  11.186  -3.262 -16.249
   83    HB   THR  12           HB       THR  12   8.833  -3.649 -17.105
   84    HG1  THR  12           HG1      THR  12   7.850  -4.834 -15.547
   85   HG21  THR  12          HG21      THR  12  11.105  -4.677 -17.960
   86   HG22  THR  12          HG22      THR  12   9.564  -5.199 -18.639
   87   HG23  THR  12          HG23      THR  12  10.370  -6.186 -17.421
   88    H    THR  13           H        THR  13   9.573  -1.492 -16.384
   89    HA   THR  13           HA       THR  13   9.254  -0.200 -13.934
   90    HB   THR  13           HB       THR  13   7.560   0.352 -16.371
   91    HG1  THR  13           HG1      THR  13   9.471   0.597 -17.290
   92   HG21  THR  13          HG21      THR  13   6.992   2.276 -15.371
   93   HG22  THR  13          HG22      THR  13   8.645   2.583 -14.837
   94   HG23  THR  13          HG23      THR  13   7.590   1.539 -13.885
   95    H    ALA  14           H        ALA  14   7.072  -2.297 -15.711
   96    HA   ALA  14           HA       ALA  14   4.708  -1.748 -14.299
   97    HB1  ALA  14           HB1      ALA  14   5.077  -3.119 -16.459
   98    HB2  ALA  14           HB2      ALA  14   5.328  -4.477 -15.362
   99    HB3  ALA  14           HB3      ALA  14   3.795  -3.604 -15.349
  100    H    ASP  15           H        ASP  15   7.510  -3.616 -13.474
  101    HA   ASP  15           HA       ASP  15   6.353  -5.248 -11.472
  102    HB2  ASP  15           HB2      ASP  15   9.204  -4.284 -11.787
  103    HB3  ASP  15           HB3      ASP  15   8.685  -5.560 -10.689
  104    H    CYS  16           H        CYS  16   7.461  -1.953 -11.519
  105    HA   CYS  16           HA       CYS  16   6.983  -1.756  -8.619
  106    HB2  CYS  16           HB2      CYS  16   8.476   0.285 -10.254
  107    HB3  CYS  16           HB3      CYS  16   8.508   0.043  -8.511
  108    H    CYS  17           H        CYS  17   6.282   0.570  -8.002
  109    HA   CYS  17           HA       CYS  17   3.908   1.163  -9.596
  110    HB2  CYS  17           HB2      CYS  17   3.236   2.534  -7.627
  111    HB3  CYS  17           HB3      CYS  17   3.523   0.842  -7.232
  112    H    LYS  18           H        LYS  18   3.284   3.582  -9.589
  113    HA   LYS  18           HA       LYS  18   4.982   4.980 -11.250
  114    HB2  LYS  18           HB2      LYS  18   3.647   6.999 -10.634
  115    HB3  LYS  18           HB3      LYS  18   2.669   5.604 -11.072
  116    HG2  LYS  18           HG2      LYS  18   2.556   5.145  -8.548
  117    HG3  LYS  18           HG3      LYS  18   3.119   6.809  -8.369
  118    HD2  LYS  18           HD2      LYS  18   1.190   7.436  -9.929
  119    HD3  LYS  18           HD3      LYS  18   0.571   5.814  -9.614
  120    HE2  LYS  18           HE2      LYS  18   1.217   7.846  -7.481
  121    HE3  LYS  18           HE3      LYS  18  -0.395   7.563  -8.136
  122    HZ1  LYS  18           HZ1      LYS  18  -0.636   5.954  -6.656
  123    HZ2  LYS  18           HZ2      LYS  18   0.950   6.151  -6.105
  124    HZ3  LYS  18           HZ3      LYS  18   0.625   5.092  -7.384
  125    H    HIS  19           H        HIS  19   4.716   5.163  -7.726
  126    HA   HIS  19           HA       HIS  19   6.379   7.314  -7.224
  127    HB2  HIS  19           HB2      HIS  19   6.184   4.778  -5.587
  128    HB3  HIS  19           HB3      HIS  19   6.748   6.344  -5.013
  129    HD1  HIS  19           HD1      HIS  19   4.401   4.991  -3.614
  130    HD2  HIS  19           HD2      HIS  19   3.970   7.686  -6.747
  131    HE1  HIS  19           HE1      HIS  19   2.075   5.921  -3.387
  132    H    LEU  20           H        LEU  20   7.197   4.038  -8.124
  133    HA   LEU  20           HA       LEU  20  10.056   4.687  -7.892
  134    HB2  LEU  20           HB2      LEU  20   8.834   1.968  -8.296
  135    HB3  LEU  20           HB3      LEU  20  10.500   2.343  -7.862
  136    HG   LEU  20           HG       LEU  20   8.412   3.252  -5.974
  137   HD11  LEU  20          HD11      LEU  20   7.601   1.023  -6.651
  138   HD12  LEU  20          HD12      LEU  20   8.134   1.076  -4.972
  139   HD13  LEU  20          HD13      LEU  20   9.165   0.342  -6.200
  140   HD21  LEU  20          HD21      LEU  20  11.224   2.753  -6.025
  141   HD22  LEU  20          HD22      LEU  20  10.480   1.760  -4.771
  142   HD23  LEU  20          HD23      LEU  20  10.251   3.509  -4.762
  143    H    GLY  21           H        GLY  21  11.437   3.581  -9.613
  144    HA2  GLY  21           HA2      GLY  21  10.090   3.478 -12.219
  145    HA3  GLY  21           HA3      GLY  21  11.409   4.618 -12.004
  146    H    CYS  22           H        CYS  22  10.539   1.228 -12.170
  147    HA   CYS  22           HA       CYS  22  12.945  -0.012 -11.693
  148    HB2  CYS  22           HB2      CYS  22  10.658  -1.033 -12.303
  149    HB3  CYS  22           HB3      CYS  22  11.175  -0.856 -13.977
  150    H    ARG  23           H        ARG  23  14.895   0.320 -12.507
  151    HA   ARG  23           HA       ARG  23  15.200   1.585 -15.106
  152    HB2  ARG  23           HB2      ARG  23  16.993   1.059 -12.775
  153    HB3  ARG  23           HB3      ARG  23  17.719   1.325 -14.355
  154    HG2  ARG  23           HG2      ARG  23  16.211   3.440 -14.400
  155    HG3  ARG  23           HG3      ARG  23  16.152   3.207 -12.652
  156    HD2  ARG  23           HD2      ARG  23  17.951   4.675 -13.024
  157    HD3  ARG  23           HD3      ARG  23  18.686   3.100 -12.729
  158    HE   ARG  23           HE       ARG  23  19.459   3.084 -14.893
  159   HH11  ARG  23          HH11      ARG  23  17.117   5.630 -14.507
  160   HH12  ARG  23          HH12      ARG  23  17.445   6.343 -16.052
  161   HH21  ARG  23          HH21      ARG  23  19.900   4.014 -16.928
  162   HH22  ARG  23          HH22      ARG  23  19.028   5.423 -17.428
  163    H    THR  24           H        THR  24  16.274   0.696 -16.854
  164    HA   THR  24           HA       THR  24  16.197  -2.189 -17.003
  165    HB   THR  24           HB       THR  24  15.419  -0.708 -18.876
  166    HG1  THR  24           HG1      THR  24  15.899  -2.310 -20.200
  167   HG21  THR  24          HG21      THR  24  18.374  -0.305 -19.349
  168   HG22  THR  24          HG22      THR  24  17.280   0.927 -18.719
  169   HG23  THR  24          HG23      THR  24  17.052   0.295 -20.349
  170    H    ASP  25           H        ASP  25  18.549   0.241 -16.435
  171    HA   ASP  25           HA       ASP  25  20.776  -1.498 -17.164
  172    HB2  ASP  25           HB2      ASP  25  20.594   1.375 -16.275
  173    HB3  ASP  25           HB3      ASP  25  22.135   0.527 -16.368
  174    H    LEU  26           H        LEU  26  19.215  -0.119 -14.334
  175    HA   LEU  26           HA       LEU  26  21.165  -1.383 -12.564
  176    HB2  LEU  26           HB2      LEU  26  18.916   0.556 -12.125
  177    HB3  LEU  26           HB3      LEU  26  19.720  -0.255 -10.784
  178    HG   LEU  26           HG       LEU  26  20.645   1.939 -11.016
  179   HD11  LEU  26          HD11      LEU  26  22.937   1.426 -11.141
  180   HD12  LEU  26          HD12      LEU  26  22.661   0.088 -12.257
  181   HD13  LEU  26          HD13      LEU  26  22.155  -0.049 -10.573
  182   HD21  LEU  26          HD21      LEU  26  21.023   2.986 -12.954
  183   HD22  LEU  26          HD22      LEU  26  20.081   1.687 -13.686
  184   HD23  LEU  26          HD23      LEU  26  21.842   1.591 -13.655
  185    H    TYR  27           H        TYR  27  17.809  -1.619 -13.546
  186    HA   TYR  27           HA       TYR  27  16.235  -3.234 -13.246
  187    HB2  TYR  27           HB2      TYR  27  18.794  -4.668 -12.882
  188    HB3  TYR  27           HB3      TYR  27  17.373  -5.472 -12.224
  189    HD1  TYR  27           HD1      TYR  27  17.506  -3.338 -15.255
  190    HD2  TYR  27           HD2      TYR  27  17.157  -7.287 -13.711
  191    HE1  TYR  27           HE1      TYR  27  16.936  -4.159 -17.502
  192    HE2  TYR  27           HE2      TYR  27  16.588  -8.120 -15.955
  193    HH   TYR  27           HH       TYR  27  16.482  -7.609 -18.137
  194    H    TYR  28           H        TYR  28  16.064  -1.453 -11.353
  195    HA   TYR  28           HA       TYR  28  15.155  -2.937  -9.071
  196    HB2  TYR  28           HB2      TYR  28  16.625  -2.232  -7.441
  197    HB3  TYR  28           HB3      TYR  28  17.722  -2.400  -8.806
  198    HD1  TYR  28           HD1      TYR  28  17.695  -0.109 -10.332
  199    HD2  TYR  28           HD2      TYR  28  16.995  -0.372  -6.144
  200    HE1  TYR  28           HE1      TYR  28  18.381   2.240 -10.076
  201    HE2  TYR  28           HE2      TYR  28  17.677   1.976  -5.875
  202    HH   TYR  28           HH       TYR  28  18.856   3.872  -8.628
  203    H    CYS  29           H        CYS  29  13.677  -1.801  -7.830
  204    HA   CYS  29           HA       CYS  29  12.364   0.358  -9.102
  205    HB2  CYS  29           HB2      CYS  29  12.055  -0.665  -6.271
  206    HB3  CYS  29           HB3      CYS  29  10.925   0.393  -7.108
  207    H    ALA  30           H        ALA  30  13.023   2.394  -9.161
  208    HA   ALA  30           HA       ALA  30  14.731   3.419  -7.013
  209    HB1  ALA  30           HB1      ALA  30  15.831   3.988  -8.914
  210    HB2  ALA  30           HB2      ALA  30  14.354   4.088  -9.874
  211    HB3  ALA  30           HB3      ALA  30  14.790   5.405  -8.785
  212    H    TRP  31           H        TRP  31  13.454   4.104  -5.376
  213    HA   TRP  31           HA       TRP  31  10.912   5.286  -5.680
  214    HB2  TRP  31           HB2      TRP  31  11.705   4.212  -3.590
  215    HB3  TRP  31           HB3      TRP  31  12.829   5.547  -3.353
  216    HD1  TRP  31           HD1      TRP  31  11.601   8.046  -3.034
  217    HE1  TRP  31           HE1      TRP  31   9.430   8.604  -1.768
  218    HE3  TRP  31           HE3      TRP  31   9.509   3.382  -2.914
  219    HZ2  TRP  31           HZ2      TRP  31   7.136   7.247  -0.840
  220    HZ3  TRP  31           HZ3      TRP  31   7.325   3.098  -1.818
  221    HH2  TRP  31           HH2      TRP  31   6.165   4.991  -0.802
  222    H    ASP  32           H        ASP  32  10.545   7.153  -6.676
  223    HA   ASP  32           HA       ASP  32  11.999   9.523  -5.831
  224    HB2  ASP  32           HB2      ASP  32  13.183   8.492  -7.857
  225    HB3  ASP  32           HB3      ASP  32  11.759   8.960  -8.781
  226    H    GLY  33           H        GLY  33   9.658   8.382  -8.277
  227    HA2  GLY  33           HA2      GLY  33   7.370   8.943  -8.332
  228    HA3  GLY  33           HA3      GLY  33   7.684  10.240  -7.187
  229    H    THR  34           H        THR  34  10.035  11.066  -8.912
  230    HA   THR  34           HA       THR  34   8.503  12.334 -11.087
  231    HB   THR  34           HB       THR  34   9.965  14.350 -10.785
  232    HG1  THR  34           HG1      THR  34  11.639  13.484  -9.561
  233   HG21  THR  34          HG21      THR  34   8.528  15.328  -9.272
  234   HG22  THR  34          HG22      THR  34   8.513  13.919  -8.213
  235   HG23  THR  34          HG23      THR  34   7.604  13.895  -9.724
  236    H    PHE  35           H        PHE  35   9.400  12.260 -13.061
  237    HA   PHE  35           HA       PHE  35  12.251  11.629 -13.308
  238    HB2  PHE  35           HB2      PHE  35   9.969  10.091 -14.538
  239    HB3  PHE  35           HB3      PHE  35  11.597  10.039 -15.206
  240    HD1  PHE  35           HD1      PHE  35  13.376   9.816 -13.036
  241    HD2  PHE  35           HD2      PHE  35   9.471   8.164 -13.412
  242    HE1  PHE  35           HE1      PHE  35  13.975   8.044 -11.439
  243    HE2  PHE  35           HE2      PHE  35  10.065   6.390 -11.814
  244    HZ   PHE  35           HZ       PHE  35  12.318   6.328 -10.825
  Start of MODEL   17
    1    H1   SER   1           H        SER   1   0.568   1.293  -0.238
    2    HA   SER   1           HA       SER   1   2.624   0.818  -1.872
    3    HB2  SER   1           HB2      SER   1   2.149  -0.583   0.769
    4    HB3  SER   1           HB3      SER   1   3.705  -0.512  -0.057
    5    HG   SER   1           HG       SER   1   3.404   1.849   0.041
    6    H    GLU   2           H        GLU   2   1.637  -0.306  -3.697
    7    HA   GLU   2           HA       GLU   2   1.509  -3.224  -3.325
    8    HB2  GLU   2           HB2      GLU   2   0.295  -1.454  -5.453
    9    HB3  GLU   2           HB3      GLU   2   0.282  -3.211  -5.518
   10    HG2  GLU   2           HG2      GLU   2  -0.838  -3.042  -3.189
   11    HG3  GLU   2           HG3      GLU   2  -1.176  -1.379  -3.668
   12    H    CYS   3           H        CYS   3   3.889  -1.408  -3.768
   13    HA   CYS   3           HA       CYS   3   4.958  -2.824  -6.118
   14    HB2  CYS   3           HB2      CYS   3   6.486  -0.750  -6.326
   15    HB3  CYS   3           HB3      CYS   3   4.823  -0.618  -6.887
   16    H    ARG   4           H        ARG   4   7.418  -2.849  -6.088
   17    HA   ARG   4           HA       ARG   4   8.250  -3.871  -3.510
   18    HB2  ARG   4           HB2      ARG   4   9.956  -3.675  -5.986
   19    HB3  ARG   4           HB3      ARG   4  10.123  -4.789  -4.635
   20    HG2  ARG   4           HG2      ARG   4   8.150  -5.981  -5.297
   21    HG3  ARG   4           HG3      ARG   4   7.809  -4.793  -6.557
   22    HD2  ARG   4           HD2      ARG   4   8.880  -6.249  -7.893
   23    HD3  ARG   4           HD3      ARG   4  10.334  -5.526  -7.210
   24    HE   ARG   4           HE       ARG   4  10.745  -7.485  -6.098
   25   HH11  ARG   4          HH11      ARG   4   7.455  -7.483  -7.237
   26   HH12  ARG   4          HH12      ARG   4   7.170  -9.138  -6.813
   27   HH21  ARG   4          HH21      ARG   4  10.380  -9.666  -5.536
   28   HH22  ARG   4          HH22      ARG   4   8.834 -10.379  -5.845
   29    H    TYR   5           H        TYR   5   9.605  -2.917  -2.108
   30    HA   TYR   5           HA       TYR   5  10.126  -0.155  -2.278
   31    HB2  TYR   5           HB2      TYR   5  10.716  -2.335  -0.397
   32    HB3  TYR   5           HB3      TYR   5  11.903  -1.035  -0.389
   33    HD1  TYR   5           HD1      TYR   5   8.994  -2.151   1.116
   34    HD2  TYR   5           HD2      TYR   5  10.732   1.407  -0.441
   35    HE1  TYR   5           HE1      TYR   5   7.503  -0.807   2.538
   36    HE2  TYR   5           HE2      TYR   5   9.247   2.760   0.978
   37    HH   TYR   5           HH       TYR   5   7.414   2.709   2.298
   38    H    LEU   6           H        LEU   6  12.419   0.728  -1.922
   39    HA   LEU   6           HA       LEU   6  13.896   0.602  -4.196
   40    HB2  LEU   6           HB2      LEU   6  14.131   2.083  -2.071
   41    HB3  LEU   6           HB3      LEU   6  15.315   0.875  -1.576
   42    HG   LEU   6           HG       LEU   6  16.269   1.436  -4.015
   43   HD11  LEU   6          HD11      LEU   6  15.133   3.153  -4.895
   44   HD12  LEU   6          HD12      LEU   6  16.070   4.140  -3.776
   45   HD13  LEU   6          HD13      LEU   6  14.441   3.624  -3.343
   46   HD21  LEU   6          HD21      LEU   6  17.997   2.489  -2.931
   47   HD22  LEU   6          HD22      LEU   6  17.229   1.642  -1.588
   48   HD23  LEU   6          HD23      LEU   6  16.924   3.362  -1.836
   49    H    PHE   7           H        PHE   7  15.418  -0.677  -5.095
   50    HA   PHE   7           HA       PHE   7  16.681  -2.523  -5.505
   51    HB2  PHE   7           HB2      PHE   7  17.093  -2.218  -2.535
   52    HB3  PHE   7           HB3      PHE   7  17.872  -3.503  -3.451
   53    HD1  PHE   7           HD1      PHE   7  17.946  -0.034  -2.535
   54    HD2  PHE   7           HD2      PHE   7  19.422  -2.889  -5.327
   55    HE1  PHE   7           HE1      PHE   7  19.755   1.513  -3.156
   56    HE2  PHE   7           HE2      PHE   7  21.235  -1.345  -5.951
   57    HZ   PHE   7           HZ       PHE   7  21.402   0.859  -4.866
   58    H    GLY   8           H        GLY   8  13.990  -3.000  -5.450
   59    HA2  GLY   8           HA2      GLY   8  13.458  -5.313  -3.778
   60    HA3  GLY   8           HA3      GLY   8  12.346  -4.569  -4.917
   61    H    GLY   9           H        GLY   9  15.140  -4.909  -6.580
   62    HA2  GLY   9           HA2      GLY   9  15.959  -6.447  -8.085
   63    HA3  GLY   9           HA3      GLY   9  15.142  -7.699  -7.162
   64    H    CYS  10           H        CYS  10  13.958  -4.882  -8.993
   65    HA   CYS  10           HA       CYS  10  11.874  -6.518 -10.165
   66    HB2  CYS  10           HB2      CYS  10  10.964  -4.468 -11.016
   67    HB3  CYS  10           HB3      CYS  10  11.480  -4.173  -9.359
   68    H    LYS  11           H        LYS  11  11.439  -5.853 -12.618
   69    HA   LYS  11           HA       LYS  11  13.968  -6.116 -14.099
   70    HB2  LYS  11           HB2      LYS  11  11.425  -7.656 -14.646
   71    HB3  LYS  11           HB3      LYS  11  12.894  -7.727 -15.610
   72    HG2  LYS  11           HG2      LYS  11  12.881  -8.442 -12.698
   73    HG3  LYS  11           HG3      LYS  11  12.471  -9.614 -13.953
   74    HD2  LYS  11           HD2      LYS  11  14.671  -9.077 -15.037
   75    HD3  LYS  11           HD3      LYS  11  15.070  -8.127 -13.604
   76    HE2  LYS  11           HE2      LYS  11  16.045 -10.194 -13.171
   77    HE3  LYS  11           HE3      LYS  11  14.519 -10.270 -12.292
   78    HZ1  LYS  11           HZ1      LYS  11  13.594 -11.683 -13.870
   79    HZ2  LYS  11           HZ2      LYS  11  15.175 -12.264 -13.710
   80    HZ3  LYS  11           HZ3      LYS  11  14.753 -11.314 -15.045
   81    H    THR  12           H        THR  12  10.587  -5.144 -14.114
   82    HA   THR  12           HA       THR  12  11.214  -3.243 -16.266
   83    HB   THR  12           HB       THR  12   9.095  -3.619 -17.352
   84    HG1  THR  12           HG1      THR  12   7.799  -5.458 -16.541
   85   HG21  THR  12          HG21      THR  12   9.513  -5.705 -18.349
   86   HG22  THR  12          HG22      THR  12  10.202  -6.371 -16.868
   87   HG23  THR  12          HG23      THR  12  11.094  -5.161 -17.790
   88    H    THR  13           H        THR  13   9.604  -1.461 -16.405
   89    HA   THR  13           HA       THR  13   9.302  -0.172 -13.945
   90    HB   THR  13           HB       THR  13   7.555   0.472 -16.308
   91    HG1  THR  13           HG1      THR  13  10.310   1.147 -15.991
   92   HG21  THR  13          HG21      THR  13   8.206   1.731 -13.829
   93   HG22  THR  13          HG22      THR  13   7.116   2.290 -15.099
   94   HG23  THR  13          HG23      THR  13   8.825   2.723 -15.149
   95    H    ALA  14           H        ALA  14   7.108  -2.231 -15.748
   96    HA   ALA  14           HA       ALA  14   4.739  -1.647 -14.351
   97    HB1  ALA  14           HB1      ALA  14   5.632  -4.105 -15.839
   98    HB2  ALA  14           HB2      ALA  14   4.020  -3.930 -15.146
   99    HB3  ALA  14           HB3      ALA  14   4.565  -2.818 -16.402
  100    H    ASP  15           H        ASP  15   7.509  -3.544 -13.512
  101    HA   ASP  15           HA       ASP  15   6.319  -5.199 -11.549
  102    HB2  ASP  15           HB2      ASP  15   9.176  -4.238 -11.816
  103    HB3  ASP  15           HB3      ASP  15   8.640  -5.520 -10.732
  104    H    CYS  16           H        CYS  16   7.441  -1.906 -11.536
  105    HA   CYS  16           HA       CYS  16   6.917  -1.745  -8.642
  106    HB2  CYS  16           HB2      CYS  16   8.424   0.339 -10.200
  107    HB3  CYS  16           HB3      CYS  16   8.466   0.011  -8.470
  108    H    CYS  17           H        CYS  17   6.215   0.578  -8.008
  109    HA   CYS  17           HA       CYS  17   3.855   1.187  -9.608
  110    HB2  CYS  17           HB2      CYS  17   3.187   2.568  -7.652
  111    HB3  CYS  17           HB3      CYS  17   3.487   0.884  -7.235
  112    H    LYS  18           H        LYS  18   3.248   3.618  -9.600
  113    HA   LYS  18           HA       LYS  18   4.941   4.992 -11.286
  114    HB2  LYS  18           HB2      LYS  18   3.628   7.022 -10.678
  115    HB3  LYS  18           HB3      LYS  18   2.632   5.631 -11.085
  116    HG2  LYS  18           HG2      LYS  18   2.533   5.201  -8.564
  117    HG3  LYS  18           HG3      LYS  18   3.140   6.850  -8.397
  118    HD2  LYS  18           HD2      LYS  18   1.237   7.702  -9.642
  119    HD3  LYS  18           HD3      LYS  18   0.648   6.059  -9.905
  120    HE2  LYS  18           HE2      LYS  18   0.743   5.949  -7.284
  121    HE3  LYS  18           HE3      LYS  18   0.660   7.705  -7.417
  122    HZ1  LYS  18           HZ1      LYS  18  -1.496   7.589  -7.855
  123    HZ2  LYS  18           HZ2      LYS  18  -1.447   5.934  -7.509
  124    HZ3  LYS  18           HZ3      LYS  18  -1.261   6.471  -9.103
  125    H    HIS  19           H        HIS  19   4.690   5.227  -7.761
  126    HA   HIS  19           HA       HIS  19   6.393   7.355  -7.299
  127    HB2  HIS  19           HB2      HIS  19   6.134   4.850  -5.623
  128    HB3  HIS  19           HB3      HIS  19   6.759   6.402  -5.073
  129    HD1  HIS  19           HD1      HIS  19   4.368   5.146  -3.649
  130    HD2  HIS  19           HD2      HIS  19   4.025   7.831  -6.801
  131    HE1  HIS  19           HE1      HIS  19   2.081   6.165  -3.419
  132    H    LEU  20           H        LEU  20   7.148   4.051  -8.147
  133    HA   LEU  20           HA       LEU  20  10.019   4.633  -7.900
  134    HB2  LEU  20           HB2      LEU  20   8.723   1.952  -8.341
  135    HB3  LEU  20           HB3      LEU  20  10.399   2.273  -7.901
  136    HG   LEU  20           HG       LEU  20   8.276   3.176  -6.027
  137   HD11  LEU  20          HD11      LEU  20   7.508   0.952  -6.606
  138   HD12  LEU  20          HD12      LEU  20   8.198   0.955  -4.984
  139   HD13  LEU  20          HD13      LEU  20   9.124   0.299  -6.333
  140   HD21  LEU  20          HD21      LEU  20  10.110   3.557  -4.838
  141   HD22  LEU  20          HD22      LEU  20  11.117   2.759  -6.046
  142   HD23  LEU  20          HD23      LEU  20  10.369   1.814  -4.756
  143    H    GLY  21           H        GLY  21  11.391   3.515  -9.618
  144    HA2  GLY  21           HA2      GLY  21  10.075   3.438 -12.237
  145    HA3  GLY  21           HA3      GLY  21  11.383   4.590 -12.004
  146    H    CYS  22           H        CYS  22  10.542   1.193 -12.193
  147    HA   CYS  22           HA       CYS  22  12.961  -0.024 -11.702
  148    HB2  CYS  22           HB2      CYS  22  10.679  -1.061 -12.326
  149    HB3  CYS  22           HB3      CYS  22  11.217  -0.895 -13.993
  150    H    ARG  23           H        ARG  23  14.910   0.327 -12.511
  151    HA   ARG  23           HA       ARG  23  15.207   1.590 -15.114
  152    HB2  ARG  23           HB2      ARG  23  17.068   1.019 -12.826
  153    HB3  ARG  23           HB3      ARG  23  17.702   1.462 -14.405
  154    HG2  ARG  23           HG2      ARG  23  16.347   3.536 -14.312
  155    HG3  ARG  23           HG3      ARG  23  15.870   3.101 -12.669
  156    HD2  ARG  23           HD2      ARG  23  17.656   4.513 -12.290
  157    HD3  ARG  23           HD3      ARG  23  18.429   2.929 -12.253
  158    HE   ARG  23           HE       ARG  23  18.705   3.640 -14.829
  159   HH11  ARG  23          HH11      ARG  23  19.368   5.320 -11.852
  160   HH12  ARG  23          HH12      ARG  23  20.672   6.248 -12.515
  161   HH21  ARG  23          HH21      ARG  23  20.420   4.857 -15.712
  162   HH22  ARG  23          HH22      ARG  23  21.269   5.985 -14.711
  163    H    THR  24           H        THR  24  16.278   0.704 -16.859
  164    HA   THR  24           HA       THR  24  16.246  -2.181 -16.995
  165    HB   THR  24           HB       THR  24  16.622  -1.954 -19.341
  166    HG1  THR  24           HG1      THR  24  18.016  -0.448 -19.874
  167   HG21  THR  24          HG21      THR  24  14.468  -0.834 -18.080
  168   HG22  THR  24          HG22      THR  24  14.603  -1.087 -19.821
  169   HG23  THR  24          HG23      THR  24  15.008   0.482 -19.123
  170    H    ASP  25           H        ASP  25  18.553   0.259 -16.372
  171    HA   ASP  25           HA       ASP  25  20.815  -1.417 -17.141
  172    HB2  ASP  25           HB2      ASP  25  20.530   1.433 -16.234
  173    HB3  ASP  25           HB3      ASP  25  22.101   0.636 -16.196
  174    H    LEU  26           H        LEU  26  19.301  -0.050 -14.259
  175    HA   LEU  26           HA       LEU  26  21.228  -1.397 -12.535
  176    HB2  LEU  26           HB2      LEU  26  19.041   0.599 -12.089
  177    HB3  LEU  26           HB3      LEU  26  19.718  -0.306 -10.736
  178    HG   LEU  26           HG       LEU  26  21.991   0.633 -11.754
  179   HD11  LEU  26          HD11      LEU  26  20.116   1.925 -13.347
  180   HD12  LEU  26          HD12      LEU  26  21.822   2.333 -13.172
  181   HD13  LEU  26          HD13      LEU  26  20.616   3.138 -12.168
  182   HD21  LEU  26          HD21      LEU  26  20.513   2.665 -10.209
  183   HD22  LEU  26          HD22      LEU  26  22.070   1.902  -9.887
  184   HD23  LEU  26          HD23      LEU  26  20.574   1.048  -9.507
  185    H    TYR  27           H        TYR  27  17.888  -1.616 -13.548
  186    HA   TYR  27           HA       TYR  27  16.311  -3.233 -13.286
  187    HB2  TYR  27           HB2      TYR  27  18.863  -4.665 -12.893
  188    HB3  TYR  27           HB3      TYR  27  17.440  -5.473 -12.245
  189    HD1  TYR  27           HD1      TYR  27  17.618  -3.346 -15.283
  190    HD2  TYR  27           HD2      TYR  27  17.206  -7.284 -13.726
  191    HE1  TYR  27           HE1      TYR  27  17.069  -4.171 -17.534
  192    HE2  TYR  27           HE2      TYR  27  16.657  -8.121 -15.973
  193    HH   TYR  27           HH       TYR  27  15.626  -7.007 -18.150
  194    H    TYR  28           H        TYR  28  16.101  -1.461 -11.390
  195    HA   TYR  28           HA       TYR  28  15.154  -2.958  -9.131
  196    HB2  TYR  28           HB2      TYR  28  16.587  -2.241  -7.470
  197    HB3  TYR  28           HB3      TYR  28  17.712  -2.410  -8.813
  198    HD1  TYR  28           HD1      TYR  28  17.616  -0.094 -10.360
  199    HD2  TYR  28           HD2      TYR  28  17.024  -0.406  -6.158
  200    HE1  TYR  28           HE1      TYR  28  18.289   2.256 -10.097
  201    HE2  TYR  28           HE2      TYR  28  17.694   1.945  -5.883
  202    HH   TYR  28           HH       TYR  28  18.918   3.834  -8.588
  203    H    CYS  29           H        CYS  29  13.713  -1.788  -7.837
  204    HA   CYS  29           HA       CYS  29  12.381   0.350  -9.151
  205    HB2  CYS  29           HB2      CYS  29  12.045  -0.683  -6.326
  206    HB3  CYS  29           HB3      CYS  29  10.922   0.381  -7.168
  207    H    ALA  30           H        ALA  30  13.034   2.388  -9.202
  208    HA   ALA  30           HA       ALA  30  14.725   3.417  -7.045
  209    HB1  ALA  30           HB1      ALA  30  14.093   4.790  -9.646
  210    HB2  ALA  30           HB2      ALA  30  15.425   5.115  -8.536
  211    HB3  ALA  30           HB3      ALA  30  15.400   3.619  -9.468
  212    H    TRP  31           H        TRP  31  13.480   4.119  -5.401
  213    HA   TRP  31           HA       TRP  31  10.923   5.307  -5.728
  214    HB2  TRP  31           HB2      TRP  31  11.615   4.143  -3.662
  215    HB3  TRP  31           HB3      TRP  31  12.786   5.419  -3.346
  216    HD1  TRP  31           HD1      TRP  31  11.619   7.969  -3.022
  217    HE1  TRP  31           HE1      TRP  31   9.458   8.560  -1.754
  218    HE3  TRP  31           HE3      TRP  31   9.420   3.355  -2.973
  219    HZ2  TRP  31           HZ2      TRP  31   7.130   7.243  -0.853
  220    HZ3  TRP  31           HZ3      TRP  31   7.227   3.104  -1.887
  221    HH2  TRP  31           HH2      TRP  31   6.107   5.010  -0.849
  222    H    ASP  32           H        ASP  32  10.705   7.179  -6.780
  223    HA   ASP  32           HA       ASP  32  12.205   9.489  -5.795
  224    HB2  ASP  32           HB2      ASP  32  13.357   8.616  -7.841
  225    HB3  ASP  32           HB3      ASP  32  11.875   8.918  -8.746
  226    H    GLY  33           H        GLY  33   9.617   8.370  -7.963
  227    HA2  GLY  33           HA2      GLY  33   7.356   9.059  -7.747
  228    HA3  GLY  33           HA3      GLY  33   7.902  10.487  -6.881
  229    H    THR  34           H        THR  34  10.018  10.859  -9.018
  230    HA   THR  34           HA       THR  34   8.294  11.779 -11.214
  231    HB   THR  34           HB       THR  34   9.714  13.860 -11.344
  232    HG1  THR  34           HG1      THR  34  11.352  13.930 -10.018
  233   HG21  THR  34          HG21      THR  34   8.199  15.012 -10.106
  234   HG22  THR  34          HG22      THR  34   8.407  13.979  -8.692
  235   HG23  THR  34          HG23      THR  34   7.406  13.440 -10.039
  236    H    PHE  35           H        PHE  35   9.425  12.170 -13.223
  237    HA   PHE  35           HA       PHE  35  12.031  10.818 -13.404
  238    HB2  PHE  35           HB2      PHE  35   9.865  10.547 -15.489
  239    HB3  PHE  35           HB3      PHE  35  11.374   9.644 -15.376
  240    HD1  PHE  35           HD1      PHE  35  11.679   8.158 -13.293
  241    HD2  PHE  35           HD2      PHE  35   7.921   9.671 -14.595
  242    HE1  PHE  35           HE1      PHE  35  10.531   6.396 -12.016
  243    HE2  PHE  35           HE2      PHE  35   6.766   7.913 -13.320
  244    HZ   PHE  35           HZ       PHE  35   8.071   6.272 -12.027
  Start of MODEL   18
    1    H1   SER   1           H        SER   1  -0.085   0.259  -0.353
    2    HA   SER   1           HA       SER   1   1.701   0.588  -2.463
    3    HB2  SER   1           HB2      SER   1   2.408   0.842  -0.150
    4    HB3  SER   1           HB3      SER   1   2.094  -0.864   0.166
    5    HG   SER   1           HG       SER   1   4.147  -1.012  -0.327
    6    H    GLU   2           H        GLU   2   1.057  -0.693  -4.213
    7    HA   GLU   2           HA       GLU   2   1.271  -3.599  -3.873
    8    HB2  GLU   2           HB2      GLU   2   0.189  -1.984  -6.190
    9    HB3  GLU   2           HB3      GLU   2   0.206  -3.740  -6.093
   10    HG2  GLU   2           HG2      GLU   2  -1.222  -3.567  -4.055
   11    HG3  GLU   2           HG3      GLU   2  -1.347  -1.836  -4.361
   12    H    CYS   3           H        CYS   3   3.511  -1.576  -4.076
   13    HA   CYS   3           HA       CYS   3   4.925  -2.863  -6.317
   14    HB2  CYS   3           HB2      CYS   3   6.281  -0.673  -6.372
   15    HB3  CYS   3           HB3      CYS   3   4.662  -0.654  -7.064
   16    H    ARG   4           H        ARG   4   7.319  -2.844  -6.051
   17    HA   ARG   4           HA       ARG   4   7.987  -3.782  -3.411
   18    HB2  ARG   4           HB2      ARG   4   9.921  -3.410  -5.687
   19    HB3  ARG   4           HB3      ARG   4  10.015  -4.551  -4.352
   20    HG2  ARG   4           HG2      ARG   4   8.249  -5.870  -5.258
   21    HG3  ARG   4           HG3      ARG   4   7.900  -4.653  -6.488
   22    HD2  ARG   4           HD2      ARG   4   9.134  -6.228  -7.659
   23    HD3  ARG   4           HD3      ARG   4  10.348  -5.028  -7.220
   24    HE   ARG   4           HE       ARG   4  11.362  -6.585  -5.876
   25   HH11  ARG   4          HH11      ARG   4   8.195  -7.717  -6.773
   26   HH12  ARG   4          HH12      ARG   4   8.436  -9.306  -6.126
   27   HH21  ARG   4          HH21      ARG   4  11.692  -8.674  -5.021
   28   HH22  ARG   4          HH22      ARG   4  10.426  -9.848  -5.129
   29    H    TYR   5           H        TYR   5  10.350  -3.100  -2.683
   30    HA   TYR   5           HA       TYR   5  10.299  -0.165  -2.488
   31    HB2  TYR   5           HB2      TYR   5  10.842  -2.319  -0.563
   32    HB3  TYR   5           HB3      TYR   5  11.988  -0.985  -0.496
   33    HD1  TYR   5           HD1      TYR   5   8.845  -2.162   0.607
   34    HD2  TYR   5           HD2      TYR   5  10.941   1.405  -0.384
   35    HE1  TYR   5           HE1      TYR   5   7.236  -0.856   1.933
   36    HE2  TYR   5           HE2      TYR   5   9.339   2.722   0.941
   37    HH   TYR   5           HH       TYR   5   7.769   2.378   2.802
   38    H    LEU   6           H        LEU   6  12.551   0.771  -2.003
   39    HA   LEU   6           HA       LEU   6  14.153   0.723  -4.175
   40    HB2  LEU   6           HB2      LEU   6  14.277   2.101  -1.964
   41    HB3  LEU   6           HB3      LEU   6  15.461   0.885  -1.493
   42    HG   LEU   6           HG       LEU   6  16.571   1.544  -3.785
   43   HD11  LEU   6          HD11      LEU   6  15.239   3.085  -4.790
   44   HD12  LEU   6          HD12      LEU   6  16.227   4.175  -3.819
   45   HD13  LEU   6          HD13      LEU   6  14.619   3.712  -3.263
   46   HD21  LEU   6          HD21      LEU   6  16.720   3.289  -1.328
   47   HD22  LEU   6          HD22      LEU   6  17.939   3.176  -2.597
   48   HD23  LEU   6          HD23      LEU   6  17.596   1.778  -1.577
   49    H    PHE   7           H        PHE   7  15.552  -0.617  -5.124
   50    HA   PHE   7           HA       PHE   7  16.828  -2.450  -5.554
   51    HB2  PHE   7           HB2      PHE   7  17.282  -2.284  -2.570
   52    HB3  PHE   7           HB3      PHE   7  18.152  -3.385  -3.634
   53    HD1  PHE   7           HD1      PHE   7  18.057  -0.127  -2.227
   54    HD2  PHE   7           HD2      PHE   7  19.464  -2.347  -5.574
   55    HE1  PHE   7           HE1      PHE   7  19.700   1.641  -2.704
   56    HE2  PHE   7           HE2      PHE   7  21.111  -0.583  -6.057
   57    HZ   PHE   7           HZ       PHE   7  21.230   1.414  -4.621
   58    H    GLY   8           H        GLY   8  14.139  -2.934  -5.442
   59    HA2  GLY   8           HA2      GLY   8  13.571  -5.184  -3.730
   60    HA3  GLY   8           HA3      GLY   8  12.521  -4.529  -4.977
   61    H    GLY   9           H        GLY   9  14.928  -4.756  -6.866
   62    HA2  GLY   9           HA2      GLY   9  15.998  -6.421  -8.114
   63    HA3  GLY   9           HA3      GLY   9  15.200  -7.640  -7.131
   64    H    CYS  10           H        CYS  10  13.948  -4.965  -9.122
   65    HA   CYS  10           HA       CYS  10  11.999  -6.787 -10.284
   66    HB2  CYS  10           HB2      CYS  10  11.011  -4.751 -11.262
   67    HB3  CYS  10           HB3      CYS  10  11.209  -4.609  -9.519
   68    H    LYS  11           H        LYS  11  11.526  -6.121 -12.738
   69    HA   LYS  11           HA       LYS  11  14.097  -6.225 -14.173
   70    HB2  LYS  11           HB2      LYS  11  11.576  -7.744 -14.867
   71    HB3  LYS  11           HB3      LYS  11  13.079  -7.772 -15.779
   72    HG2  LYS  11           HG2      LYS  11  14.204  -8.727 -13.779
   73    HG3  LYS  11           HG3      LYS  11  12.625  -8.826 -12.997
   74    HD2  LYS  11           HD2      LYS  11  12.971 -10.962 -13.896
   75    HD3  LYS  11           HD3      LYS  11  11.895 -10.169 -15.047
   76    HE2  LYS  11           HE2      LYS  11  13.906  -9.577 -16.401
   77    HE3  LYS  11           HE3      LYS  11  14.875 -10.554 -15.300
   78    HZ1  LYS  11           HZ1      LYS  11  13.939 -11.570 -17.488
   79    HZ2  LYS  11           HZ2      LYS  11  12.525 -11.761 -16.580
   80    HZ3  LYS  11           HZ3      LYS  11  13.963 -12.490 -16.068
   81    H    THR  12           H        THR  12  10.755  -5.180 -14.145
   82    HA   THR  12           HA       THR  12  11.408  -3.226 -16.238
   83    HB   THR  12           HB       THR  12   9.031  -3.513 -17.098
   84    HG1  THR  12           HG1      THR  12   8.161  -4.777 -15.453
   85   HG21  THR  12          HG21      THR  12   9.823  -5.921 -18.098
   86   HG22  THR  12          HG22      THR  12  11.355  -5.256 -17.532
   87   HG23  THR  12          HG23      THR  12  10.379  -4.357 -18.693
   88    H    THR  13           H        THR  13   9.743  -1.453 -16.336
   89    HA   THR  13           HA       THR  13   9.465  -0.257 -13.807
   90    HB   THR  13           HB       THR  13   7.786   0.536 -16.174
   91    HG1  THR  13           HG1      THR  13   9.522   1.244 -17.202
   92   HG21  THR  13          HG21      THR  13   9.195   2.588 -14.662
   93   HG22  THR  13          HG22      THR  13   8.122   1.616 -13.653
   94   HG23  THR  13          HG23      THR  13   7.484   2.457 -15.065
   95    H    ALA  14           H        ALA  14   7.275  -2.191 -15.744
   96    HA   ALA  14           HA       ALA  14   4.871  -1.626 -14.432
   97    HB1  ALA  14           HB1      ALA  14   5.666  -4.271 -15.640
   98    HB2  ALA  14           HB2      ALA  14   4.029  -3.661 -15.387
   99    HB3  ALA  14           HB3      ALA  14   5.088  -2.884 -16.564
  100    H    ASP  15           H        ASP  15   7.598  -3.519 -13.458
  101    HA   ASP  15           HA       ASP  15   6.319  -5.161 -11.540
  102    HB2  ASP  15           HB2      ASP  15   9.182  -4.216 -11.766
  103    HB3  ASP  15           HB3      ASP  15   8.632  -5.408 -10.591
  104    H    CYS  16           H        CYS  16   7.443  -1.870 -11.497
  105    HA   CYS  16           HA       CYS  16   6.776  -1.688  -8.633
  106    HB2  CYS  16           HB2      CYS  16   8.359   0.409 -10.077
  107    HB3  CYS  16           HB3      CYS  16   8.361  -0.001  -8.365
  108    H    CYS  17           H        CYS  17   6.076   0.653  -8.054
  109    HA   CYS  17           HA       CYS  17   3.826   1.290  -9.806
  110    HB2  CYS  17           HB2      CYS  17   3.040   2.660  -7.872
  111    HB3  CYS  17           HB3      CYS  17   3.255   0.955  -7.486
  112    H    LYS  18           H        LYS  18   3.241   3.749  -9.731
  113    HA   LYS  18           HA       LYS  18   5.033   5.139 -11.297
  114    HB2  LYS  18           HB2      LYS  18   3.734   7.171 -10.705
  115    HB3  LYS  18           HB3      LYS  18   2.718   5.807 -11.151
  116    HG2  LYS  18           HG2      LYS  18   2.617   5.371  -8.598
  117    HG3  LYS  18           HG3      LYS  18   3.141   7.052  -8.471
  118    HD2  LYS  18           HD2      LYS  18   1.193   7.490 -10.151
  119    HD3  LYS  18           HD3      LYS  18   0.596   5.935  -9.570
  120    HE2  LYS  18           HE2      LYS  18  -0.441   7.455  -8.155
  121    HE3  LYS  18           HE3      LYS  18   0.958   6.934  -7.218
  122    HZ1  LYS  18           HZ1      LYS  18   2.107   8.955  -8.187
  123    HZ2  LYS  18           HZ2      LYS  18   0.913   9.247  -7.025
  124    HZ3  LYS  18           HZ3      LYS  18   0.573   9.484  -8.665
  125    H    HIS  19           H        HIS  19   4.666   5.219  -7.781
  126    HA   HIS  19           HA       HIS  19   6.367   7.311  -7.162
  127    HB2  HIS  19           HB2      HIS  19   6.044   4.730  -5.616
  128    HB3  HIS  19           HB3      HIS  19   6.651   6.253  -4.973
  129    HD1  HIS  19           HD1      HIS  19   4.226   4.965  -3.668
  130    HD2  HIS  19           HD2      HIS  19   3.964   7.741  -6.748
  131    HE1  HIS  19           HE1      HIS  19   1.929   5.970  -3.474
  132    H    LEU  20           H        LEU  20   7.125   4.037  -8.129
  133    HA   LEU  20           HA       LEU  20   9.994   4.622  -7.823
  134    HB2  LEU  20           HB2      LEU  20   8.693   1.935  -8.223
  135    HB3  LEU  20           HB3      LEU  20  10.380   2.251  -7.827
  136    HG   LEU  20           HG       LEU  20   8.507   3.324  -5.859
  137   HD11  LEU  20          HD11      LEU  20   7.673   1.324  -4.979
  138   HD12  LEU  20          HD12      LEU  20   8.728   0.335  -5.989
  139   HD13  LEU  20          HD13      LEU  20   7.375   1.202  -6.713
  140   HD21  LEU  20          HD21      LEU  20  10.186   1.575  -4.607
  141   HD22  LEU  20          HD22      LEU  20  10.535   3.278  -4.911
  142   HD23  LEU  20          HD23      LEU  20  11.131   2.043  -6.020
  143    H    GLY  21           H        GLY  21  11.384   3.492  -9.520
  144    HA2  GLY  21           HA2      GLY  21  10.092   3.354 -12.144
  145    HA3  GLY  21           HA3      GLY  21  11.360   4.551 -11.923
  146    H    CYS  22           H        CYS  22  10.633   1.126 -12.063
  147    HA   CYS  22           HA       CYS  22  13.081  -0.009 -11.534
  148    HB2  CYS  22           HB2      CYS  22  10.829  -1.111 -12.192
  149    HB3  CYS  22           HB3      CYS  22  11.414  -0.967 -13.846
  150    H    ARG  23           H        ARG  23  15.029   0.386 -12.325
  151    HA   ARG  23           HA       ARG  23  15.387   1.773 -14.819
  152    HB2  ARG  23           HB2      ARG  23  17.134   0.891 -12.581
  153    HB3  ARG  23           HB3      ARG  23  17.897   1.139 -14.146
  154    HG2  ARG  23           HG2      ARG  23  16.825   3.428 -14.159
  155    HG3  ARG  23           HG3      ARG  23  16.422   3.142 -12.466
  156    HD2  ARG  23           HD2      ARG  23  18.427   4.184 -12.188
  157    HD3  ARG  23           HD3      ARG  23  18.996   2.523 -12.348
  158    HE   ARG  23           HE       ARG  23  19.040   3.398 -14.891
  159   HH11  ARG  23          HH11      ARG  23  20.279   4.735 -11.925
  160   HH12  ARG  23          HH12      ARG  23  21.603   5.548 -12.693
  161   HH21  ARG  23          HH21      ARG  23  20.778   4.464 -15.912
  162   HH22  ARG  23          HH22      ARG  23  21.884   5.394 -14.961
  163    H    THR  24           H        THR  24  16.468   1.015 -16.658
  164    HA   THR  24           HA       THR  24  16.054  -1.796 -17.191
  165    HB   THR  24           HB       THR  24  16.661  -1.285 -19.489
  166    HG1  THR  24           HG1      THR  24  17.628   1.072 -18.307
  167   HG21  THR  24          HG21      THR  24  15.055   1.116 -18.916
  168   HG22  THR  24          HG22      THR  24  14.439  -0.384 -18.222
  169   HG23  THR  24          HG23      THR  24  14.705  -0.259 -19.961
  170    H    ASP  25           H        ASP  25  18.690   0.294 -16.394
  171    HA   ASP  25           HA       ASP  25  20.676  -1.694 -17.200
  172    HB2  ASP  25           HB2      ASP  25  21.099   1.042 -15.980
  173    HB3  ASP  25           HB3      ASP  25  22.337   0.007 -16.688
  174    H    LEU  26           H        LEU  26  19.348  -0.155 -14.324
  175    HA   LEU  26           HA       LEU  26  21.118  -1.661 -12.577
  176    HB2  LEU  26           HB2      LEU  26  19.032   0.447 -12.152
  177    HB3  LEU  26           HB3      LEU  26  19.646  -0.500 -10.799
  178    HG   LEU  26           HG       LEU  26  20.788   1.622 -10.901
  179   HD11  LEU  26          HD11      LEU  26  22.619   0.589 -10.204
  180   HD12  LEU  26          HD12      LEU  26  23.072   0.213 -11.867
  181   HD13  LEU  26          HD13      LEU  26  22.050  -0.901 -10.958
  182   HD21  LEU  26          HD21      LEU  26  21.678   2.568 -12.760
  183   HD22  LEU  26          HD22      LEU  26  20.431   1.597 -13.543
  184   HD23  LEU  26          HD23      LEU  26  22.097   1.018 -13.488
  185    H    TYR  27           H        TYR  27  17.763  -1.630 -13.602
  186    HA   TYR  27           HA       TYR  27  16.078  -3.141 -13.376
  187    HB2  TYR  27           HB2      TYR  27  18.531  -4.762 -13.073
  188    HB3  TYR  27           HB3      TYR  27  17.060  -5.494 -12.444
  189    HD1  TYR  27           HD1      TYR  27  17.264  -3.237 -15.372
  190    HD2  TYR  27           HD2      TYR  27  16.785  -7.242 -14.016
  191    HE1  TYR  27           HE1      TYR  27  16.639  -3.927 -17.649
  192    HE2  TYR  27           HE2      TYR  27  16.160  -7.943 -16.289
  193    HH   TYR  27           HH       TYR  27  16.786  -6.708 -18.833
  194    H    TYR  28           H        TYR  28  16.025  -1.435 -11.405
  195    HA   TYR  28           HA       TYR  28  15.064  -2.985  -9.170
  196    HB2  TYR  28           HB2      TYR  28  16.517  -2.255  -7.514
  197    HB3  TYR  28           HB3      TYR  28  17.614  -2.497  -8.870
  198    HD1  TYR  28           HD1      TYR  28  17.492  -0.185 -10.476
  199    HD2  TYR  28           HD2      TYR  28  17.130  -0.437  -6.244
  200    HE1  TYR  28           HE1      TYR  28  18.255   2.144 -10.278
  201    HE2  TYR  28           HE2      TYR  28  17.892   1.892  -6.035
  202    HH   TYR  28           HH       TYR  28  18.338   3.939  -8.837
  203    H    CYS  29           H        CYS  29  13.631  -1.849  -7.852
  204    HA   CYS  29           HA       CYS  29  12.282   0.315  -9.089
  205    HB2  CYS  29           HB2      CYS  29  12.029  -0.776  -6.277
  206    HB3  CYS  29           HB3      CYS  29  10.898   0.338  -7.038
  207    H    ALA  30           H        ALA  30  12.943   2.350  -9.141
  208    HA   ALA  30           HA       ALA  30  14.671   3.360  -6.998
  209    HB1  ALA  30           HB1      ALA  30  15.386   5.046  -8.495
  210    HB2  ALA  30           HB2      ALA  30  15.350   3.545  -9.421
  211    HB3  ALA  30           HB3      ALA  30  14.054   4.726  -9.607
  212    H    TRP  31           H        TRP  31  13.425   4.070  -5.356
  213    HA   TRP  31           HA       TRP  31  10.880   5.261  -5.655
  214    HB2  TRP  31           HB2      TRP  31  11.726   4.155  -3.573
  215    HB3  TRP  31           HB3      TRP  31  12.771   5.550  -3.312
  216    HD1  TRP  31           HD1      TRP  31  11.454   7.950  -2.888
  217    HE1  TRP  31           HE1      TRP  31   9.219   8.384  -1.687
  218    HE3  TRP  31           HE3      TRP  31   9.498   3.229  -3.078
  219    HZ2  TRP  31           HZ2      TRP  31   6.930   6.920  -0.921
  220    HZ3  TRP  31           HZ3      TRP  31   7.281   2.831  -2.087
  221    HH2  TRP  31           HH2      TRP  31   6.026   4.639  -1.031
  222    H    ASP  32           H        ASP  32  10.537   7.135  -6.646
  223    HA   ASP  32           HA       ASP  32  12.019   9.484  -5.784
  224    HB2  ASP  32           HB2      ASP  32  13.193   8.484  -7.813
  225    HB3  ASP  32           HB3      ASP  32  11.754   8.912  -8.735
  226    H    GLY  33           H        GLY  33   9.567   8.289  -8.078
  227    HA2  GLY  33           HA2      GLY  33   7.289   8.906  -8.043
  228    HA3  GLY  33           HA3      GLY  33   7.702  10.284  -7.035
  229    H    THR  34           H        THR  34   9.967  10.893  -8.953
  230    HA   THR  34           HA       THR  34   8.352  11.987 -11.161
  231    HB   THR  34           HB       THR  34   9.881  14.005 -11.085
  232    HG1  THR  34           HG1      THR  34  10.989  14.358  -9.145
  233   HG21  THR  34          HG21      THR  34   8.403  13.926  -8.505
  234   HG22  THR  34          HG22      THR  34   7.487  13.652  -9.988
  235   HG23  THR  34          HG23      THR  34   8.395  15.148  -9.775
  236    H    PHE  35           H        PHE  35   9.225  11.859 -13.162
  237    HA   PHE  35           HA       PHE  35  11.908  10.664 -13.363
  238    HB2  PHE  35           HB2      PHE  35   9.696  10.512 -15.416
  239    HB3  PHE  35           HB3      PHE  35  11.208   9.611 -15.411
  240    HD1  PHE  35           HD1      PHE  35  11.584   8.178 -13.199
  241    HD2  PHE  35           HD2      PHE  35   7.808   9.426 -14.713
  242    HE1  PHE  35           HE1      PHE  35  10.491   6.349 -11.971
  243    HE2  PHE  35           HE2      PHE  35   6.708   7.599 -13.485
  244    HZ   PHE  35           HZ       PHE  35   8.051   6.056 -12.113
  Start of MODEL   19
    1    H1   SER   1           H        SER   1   0.697   1.708  -1.120
    2    HA   SER   1           HA       SER   1   2.871   0.540  -1.609
    3    HB2  SER   1           HB2      SER   1   1.743   0.717   0.740
    4    HB3  SER   1           HB3      SER   1   1.413  -1.001   0.515
    5    HG   SER   1           HG       SER   1   3.415  -0.589   1.591
    6    H    GLU   2           H        GLU   2   1.586  -0.404  -3.742
    7    HA   GLU   2           HA       GLU   2   1.505  -3.327  -3.416
    8    HB2  GLU   2           HB2      GLU   2   0.283  -1.526  -5.508
    9    HB3  GLU   2           HB3      GLU   2   0.333  -3.278  -5.654
   10    HG2  GLU   2           HG2      GLU   2  -1.099  -3.578  -3.814
   11    HG3  GLU   2           HG3      GLU   2  -0.914  -1.903  -3.297
   12    H    CYS   3           H        CYS   3   3.867  -1.475  -3.793
   13    HA   CYS   3           HA       CYS   3   4.997  -2.852  -6.138
   14    HB2  CYS   3           HB2      CYS   3   6.485  -0.751  -6.322
   15    HB3  CYS   3           HB3      CYS   3   4.823  -0.639  -6.893
   16    H    ARG   4           H        ARG   4   7.434  -2.896  -6.072
   17    HA   ARG   4           HA       ARG   4   8.250  -3.887  -3.483
   18    HB2  ARG   4           HB2      ARG   4   9.994  -3.662  -5.929
   19    HB3  ARG   4           HB3      ARG   4  10.148  -4.782  -4.581
   20    HG2  ARG   4           HG2      ARG   4   8.189  -5.982  -5.287
   21    HG3  ARG   4           HG3      ARG   4   7.877  -4.796  -6.556
   22    HD2  ARG   4           HD2      ARG   4   8.917  -6.469  -7.747
   23    HD3  ARG   4           HD3      ARG   4  10.283  -5.431  -7.342
   24    HE   ARG   4           HE       ARG   4  10.270  -7.175  -5.300
   25   HH11  ARG   4          HH11      ARG   4  10.127  -7.609  -8.751
   26   HH12  ARG   4          HH12      ARG   4  10.930  -9.145  -8.722
   27   HH21  ARG   4          HH21      ARG   4  11.327  -9.195  -5.249
   28   HH22  ARG   4          HH22      ARG   4  11.611 -10.046  -6.729
   29    H    TYR   5           H        TYR   5   9.696  -2.984  -2.105
   30    HA   TYR   5           HA       TYR   5  10.142  -0.191  -2.242
   31    HB2  TYR   5           HB2      TYR   5  10.745  -2.374  -0.366
   32    HB3  TYR   5           HB3      TYR   5  11.909  -1.054  -0.339
   33    HD1  TYR   5           HD1      TYR   5   8.999  -2.229   1.124
   34    HD2  TYR   5           HD2      TYR   5  10.704   1.368  -0.380
   35    HE1  TYR   5           HE1      TYR   5   7.471  -0.919   2.539
   36    HE2  TYR   5           HE2      TYR   5   9.182   2.687   1.031
   37    HH   TYR   5           HH       TYR   5   7.088   2.476   2.178
   38    H    LEU   6           H        LEU   6  12.423   0.712  -1.862
   39    HA   LEU   6           HA       LEU   6  13.920   0.625  -4.119
   40    HB2  LEU   6           HB2      LEU   6  14.136   2.063  -1.961
   41    HB3  LEU   6           HB3      LEU   6  15.330   0.855  -1.493
   42    HG   LEU   6           HG       LEU   6  16.350   1.443  -3.854
   43   HD11  LEU   6          HD11      LEU   6  14.383   3.565  -3.360
   44   HD12  LEU   6          HD12      LEU   6  15.125   3.027  -4.866
   45   HD13  LEU   6          HD13      LEU   6  15.997   4.126  -3.797
   46   HD21  LEU   6          HD21      LEU   6  16.710   3.416  -1.619
   47   HD22  LEU   6          HD22      LEU   6  17.908   2.817  -2.767
   48   HD23  LEU   6          HD23      LEU   6  17.288   1.755  -1.502
   49    H    PHE   7           H        PHE   7  15.375  -0.681  -5.061
   50    HA   PHE   7           HA       PHE   7  16.644  -2.518  -5.495
   51    HB2  PHE   7           HB2      PHE   7  17.100  -2.395  -2.508
   52    HB3  PHE   7           HB3      PHE   7  17.996  -3.435  -3.609
   53    HD1  PHE   7           HD1      PHE   7  17.960  -0.332  -1.981
   54    HD2  PHE   7           HD2      PHE   7  19.129  -2.193  -5.627
   55    HE1  PHE   7           HE1      PHE   7  19.553   1.496  -2.400
   56    HE2  PHE   7           HE2      PHE   7  20.724  -0.368  -6.051
   57    HZ   PHE   7           HZ       PHE   7  20.938   1.479  -4.436
   58    H    GLY   8           H        GLY   8  14.028  -3.075  -5.509
   59    HA2  GLY   8           HA2      GLY   8  13.508  -5.363  -3.780
   60    HA3  GLY   8           HA3      GLY   8  12.376  -4.628  -4.905
   61    H    GLY   9           H        GLY   9  15.124  -4.934  -6.628
   62    HA2  GLY   9           HA2      GLY   9  15.954  -6.482  -8.121
   63    HA3  GLY   9           HA3      GLY   9  15.130  -7.734  -7.203
   64    H    CYS  10           H        CYS  10  13.957  -4.901  -9.016
   65    HA   CYS  10           HA       CYS  10  11.866  -6.522 -10.196
   66    HB2  CYS  10           HB2      CYS  10  10.958  -4.465 -11.028
   67    HB3  CYS  10           HB3      CYS  10  11.480  -4.182  -9.370
   68    H    LYS  11           H        LYS  11  11.422  -5.899 -12.635
   69    HA   LYS  11           HA       LYS  11  13.949  -6.132 -14.126
   70    HB2  LYS  11           HB2      LYS  11  11.406  -7.692 -14.612
   71    HB3  LYS  11           HB3      LYS  11  12.816  -7.713 -15.664
   72    HG2  LYS  11           HG2      LYS  11  14.155  -8.650 -13.840
   73    HG3  LYS  11           HG3      LYS  11  12.727  -8.647 -12.801
   74    HD2  LYS  11           HD2      LYS  11  12.719 -10.817 -13.570
   75    HD3  LYS  11           HD3      LYS  11  11.670 -10.032 -14.753
   76    HE2  LYS  11           HE2      LYS  11  13.703  -9.735 -16.199
   77    HE3  LYS  11           HE3      LYS  11  14.578 -10.758 -15.062
   78    HZ1  LYS  11           HZ1      LYS  11  12.202 -11.533 -16.665
   79    HZ2  LYS  11           HZ2      LYS  11  12.932 -12.514 -15.496
   80    HZ3  LYS  11           HZ3      LYS  11  13.789 -12.076 -16.887
   81    H    THR  12           H        THR  12  10.582  -5.132 -14.105
   82    HA   THR  12           HA       THR  12  11.201  -3.229 -16.256
   83    HB   THR  12           HB       THR  12   8.996  -3.581 -17.271
   84    HG1  THR  12           HG1      THR  12   8.683  -5.925 -15.724
   85   HG21  THR  12          HG21      THR  12   9.406  -6.012 -18.034
   86   HG22  THR  12          HG22      THR  12  10.851  -5.928 -17.026
   87   HG23  THR  12          HG23      THR  12  10.649  -4.809 -18.373
   88    H    THR  13           H        THR  13   9.572  -1.456 -16.388
   89    HA   THR  13           HA       THR  13   9.274  -0.180 -13.918
   90    HB   THR  13           HB       THR  13   7.652   0.406 -16.400
   91    HG1  THR  13           HG1      THR  13  10.282   1.219 -15.663
   92   HG21  THR  13          HG21      THR  13   6.782   2.002 -15.100
   93   HG22  THR  13          HG22      THR  13   8.370   2.766 -15.124
   94   HG23  THR  13          HG23      THR  13   7.936   1.676 -13.809
   95    H    ALA  14           H        ALA  14   7.091  -2.245 -15.723
   96    HA   ALA  14           HA       ALA  14   4.716  -1.675 -14.333
   97    HB1  ALA  14           HB1      ALA  14   5.463  -4.326 -15.553
   98    HB2  ALA  14           HB2      ALA  14   3.842  -3.687 -15.277
   99    HB3  ALA  14           HB3      ALA  14   4.892  -2.938 -16.481
  100    H    ASP  15           H        ASP  15   7.493  -3.566 -13.489
  101    HA   ASP  15           HA       ASP  15   6.303  -5.210 -11.515
  102    HB2  ASP  15           HB2      ASP  15   9.160  -4.260 -11.816
  103    HB3  ASP  15           HB3      ASP  15   8.635  -5.512 -10.695
  104    H    CYS  16           H        CYS  16   7.431  -1.920 -11.520
  105    HA   CYS  16           HA       CYS  16   6.915  -1.745  -8.625
  106    HB2  CYS  16           HB2      CYS  16   8.419   0.331 -10.196
  107    HB3  CYS  16           HB3      CYS  16   8.467   0.009  -8.466
  108    H    CYS  17           H        CYS  17   6.218   0.582  -8.000
  109    HA   CYS  17           HA       CYS  17   3.861   1.193  -9.608
  110    HB2  CYS  17           HB2      CYS  17   3.180   2.562  -7.646
  111    HB3  CYS  17           HB3      CYS  17   3.473   0.875  -7.239
  112    H    LYS  18           H        LYS  18   3.253   3.623  -9.586
  113    HA   LYS  18           HA       LYS  18   4.954   5.010 -11.254
  114    HB2  LYS  18           HB2      LYS  18   3.639   7.030 -10.658
  115    HB3  LYS  18           HB3      LYS  18   2.633   5.636 -11.034
  116    HG2  LYS  18           HG2      LYS  18   2.735   5.293  -8.421
  117    HG3  LYS  18           HG3      LYS  18   3.065   7.026  -8.447
  118    HD2  LYS  18           HD2      LYS  18   1.013   7.181  -9.991
  119    HD3  LYS  18           HD3      LYS  18   0.635   5.556  -9.415
  120    HE2  LYS  18           HE2      LYS  18  -0.523   6.791  -7.882
  121    HE3  LYS  18           HE3      LYS  18   1.032   6.675  -7.060
  122    HZ1  LYS  18           HZ1      LYS  18   0.885   8.886  -6.950
  123    HZ2  LYS  18           HZ2      LYS  18  -0.297   8.983  -8.155
  124    HZ3  LYS  18           HZ3      LYS  18   1.337   8.880  -8.580
  125    H    HIS  19           H        HIS  19   4.703   5.200  -7.728
  126    HA   HIS  19           HA       HIS  19   6.402   7.329  -7.239
  127    HB2  HIS  19           HB2      HIS  19   6.178   4.803  -5.588
  128    HB3  HIS  19           HB3      HIS  19   6.755   6.367  -5.025
  129    HD1  HIS  19           HD1      HIS  19   4.411   5.074  -3.593
  130    HD2  HIS  19           HD2      HIS  19   3.974   7.693  -6.788
  131    HE1  HIS  19           HE1      HIS  19   2.090   6.016  -3.377
  132    H    LEU  20           H        LEU  20   7.164   4.039  -8.136
  133    HA   LEU  20           HA       LEU  20  10.034   4.632  -7.895
  134    HB2  LEU  20           HB2      LEU  20   8.752   1.944  -8.329
  135    HB3  LEU  20           HB3      LEU  20  10.428   2.276  -7.898
  136    HG   LEU  20           HG       LEU  20   8.333   3.185  -6.003
  137   HD11  LEU  20          HD11      LEU  20   7.514   0.979  -6.604
  138   HD12  LEU  20          HD12      LEU  20   8.198   0.964  -4.979
  139   HD13  LEU  20          HD13      LEU  20   9.114   0.290  -6.327
  140   HD21  LEU  20          HD21      LEU  20  11.155   2.754  -6.052
  141   HD22  LEU  20          HD22      LEU  20  10.436   1.736  -4.803
  142   HD23  LEU  20          HD23      LEU  20  10.163   3.479  -4.786
  143    H    GLY  21           H        GLY  21  11.400   3.521  -9.623
  144    HA2  GLY  21           HA2      GLY  21  10.065   3.442 -12.232
  145    HA3  GLY  21           HA3      GLY  21  11.373   4.595 -12.007
  146    H    CYS  22           H        CYS  22  10.539   1.194 -12.185
  147    HA   CYS  22           HA       CYS  22  12.963  -0.016 -11.714
  148    HB2  CYS  22           HB2      CYS  22  10.679  -1.058 -12.321
  149    HB3  CYS  22           HB3      CYS  22  11.204  -0.893 -13.992
  150    H    ARG  23           H        ARG  23  14.905   0.343 -12.538
  151    HA   ARG  23           HA       ARG  23  15.172   1.588 -15.156
  152    HB2  ARG  23           HB2      ARG  23  17.060   1.074 -12.874
  153    HB3  ARG  23           HB3      ARG  23  17.666   1.529 -14.462
  154    HG2  ARG  23           HG2      ARG  23  16.324   3.582 -14.371
  155    HG3  ARG  23           HG3      ARG  23  15.768   3.129 -12.759
  156    HD2  ARG  23           HD2      ARG  23  17.513   4.542 -12.254
  157    HD3  ARG  23           HD3      ARG  23  18.318   2.973 -12.234
  158    HE   ARG  23           HE       ARG  23  18.676   3.774 -14.776
  159   HH11  ARG  23          HH11      ARG  23  19.201   5.356 -11.720
  160   HH12  ARG  23          HH12      ARG  23  20.513   6.327 -12.299
  161   HH21  ARG  23          HH21      ARG  23  20.402   5.048 -15.552
  162   HH22  ARG  23          HH22      ARG  23  21.195   6.151 -14.479
  163    H    THR  24           H        THR  24  16.267   0.696 -16.888
  164    HA   THR  24           HA       THR  24  16.277  -2.192 -16.984
  165    HB   THR  24           HB       THR  24  15.457  -0.786 -18.887
  166    HG1  THR  24           HG1      THR  24  16.877  -2.046 -20.463
  167   HG21  THR  24          HG21      THR  24  18.368  -0.297 -19.484
  168   HG22  THR  24          HG22      THR  24  17.350   0.889 -18.668
  169   HG23  THR  24          HG23      THR  24  16.959   0.371 -20.307
  170    H    ASP  25           H        ASP  25  18.545   0.285 -16.376
  171    HA   ASP  25           HA       ASP  25  20.838  -1.348 -17.137
  172    HB2  ASP  25           HB2      ASP  25  20.704   1.167 -17.533
  173    HB3  ASP  25           HB3      ASP  25  20.907   1.353 -15.794
  174    H    LEU  26           H        LEU  26  19.293  -0.030 -14.248
  175    HA   LEU  26           HA       LEU  26  21.228  -1.378 -12.531
  176    HB2  LEU  26           HB2      LEU  26  19.009   0.579 -12.044
  177    HB3  LEU  26           HB3      LEU  26  19.757  -0.304 -10.715
  178    HG   LEU  26           HG       LEU  26  21.964   0.706 -11.821
  179   HD11  LEU  26          HD11      LEU  26  20.657   3.204 -12.152
  180   HD12  LEU  26          HD12      LEU  26  19.883   2.030 -13.216
  181   HD13  LEU  26          HD13      LEU  26  21.622   2.300 -13.320
  182   HD21  LEU  26          HD21      LEU  26  20.691   1.031  -9.504
  183   HD22  LEU  26          HD22      LEU  26  20.437   2.641 -10.177
  184   HD23  LEU  26          HD23      LEU  26  22.075   2.018  -9.972
  185    H    TYR  27           H        TYR  27  17.888  -1.597 -13.544
  186    HA   TYR  27           HA       TYR  27  16.316  -3.222 -13.297
  187    HB2  TYR  27           HB2      TYR  27  18.873  -4.649 -12.925
  188    HB3  TYR  27           HB3      TYR  27  17.457  -5.467 -12.276
  189    HD1  TYR  27           HD1      TYR  27  17.651  -3.324 -15.305
  190    HD2  TYR  27           HD2      TYR  27  17.180  -7.260 -13.761
  191    HE1  TYR  27           HE1      TYR  27  17.093  -4.135 -17.559
  192    HE2  TYR  27           HE2      TYR  27  16.622  -8.083 -16.011
  193    HH   TYR  27           HH       TYR  27  16.681  -7.559 -18.229
  194    H    TYR  28           H        TYR  28  16.101  -1.470 -11.384
  195    HA   TYR  28           HA       TYR  28  15.156  -2.988  -9.140
  196    HB2  TYR  28           HB2      TYR  28  16.593  -2.299  -7.473
  197    HB3  TYR  28           HB3      TYR  28  17.716  -2.450  -8.818
  198    HD1  TYR  28           HD1      TYR  28  17.670  -0.126 -10.325
  199    HD2  TYR  28           HD2      TYR  28  16.984  -0.469  -6.140
  200    HE1  TYR  28           HE1      TYR  28  18.348   2.218 -10.028
  201    HE2  TYR  28           HE2      TYR  28  17.659   1.877  -5.831
  202    HH   TYR  28           HH       TYR  28  19.335   3.536  -7.448
  203    H    CYS  29           H        CYS  29  13.690  -1.847  -7.865
  204    HA   CYS  29           HA       CYS  29  12.367   0.307  -9.141
  205    HB2  CYS  29           HB2      CYS  29  12.058  -0.748  -6.321
  206    HB3  CYS  29           HB3      CYS  29  10.935   0.340  -7.131
  207    H    ALA  30           H        ALA  30  13.021   2.344  -9.194
  208    HA   ALA  30           HA       ALA  30  14.721   3.370  -7.041
  209    HB1  ALA  30           HB1      ALA  30  14.600   3.781  -9.882
  210    HB2  ALA  30           HB2      ALA  30  14.479   5.323  -9.032
  211    HB3  ALA  30           HB3      ALA  30  15.851   4.256  -8.735
  212    H    TRP  31           H        TRP  31  13.451   4.052  -5.401
  213    HA   TRP  31           HA       TRP  31  10.904   5.231  -5.709
  214    HB2  TRP  31           HB2      TRP  31  11.649   4.133  -3.627
  215    HB3  TRP  31           HB3      TRP  31  12.811   5.431  -3.369
  216    HD1  TRP  31           HD1      TRP  31  11.641   7.967  -3.052
  217    HE1  TRP  31           HE1      TRP  31   9.491   8.570  -1.771
  218    HE3  TRP  31           HE3      TRP  31   9.451   3.350  -2.926
  219    HZ2  TRP  31           HZ2      TRP  31   7.173   7.261  -0.832
  220    HZ3  TRP  31           HZ3      TRP  31   7.267   3.110  -1.816
  221    HH2  TRP  31           HH2      TRP  31   6.154   5.026  -0.792
  222    H    ASP  32           H        ASP  32  10.558   7.107  -6.698
  223    HA   ASP  32           HA       ASP  32  12.020   9.461  -5.813
  224    HB2  ASP  32           HB2      ASP  32  13.195   8.461  -7.854
  225    HB3  ASP  32           HB3      ASP  32  11.764   8.929  -8.770
  226    H    GLY  33           H        GLY  33   9.655   8.363  -8.255
  227    HA2  GLY  33           HA2      GLY  33   7.361   8.937  -8.245
  228    HA3  GLY  33           HA3      GLY  33   7.721  10.260  -7.145
  229    H    THR  34           H        THR  34  10.041  11.003  -8.948
  230    HA   THR  34           HA       THR  34   8.467  12.252 -11.104
  231    HB   THR  34           HB       THR  34   9.976  14.234 -10.916
  232    HG1  THR  34           HG1      THR  34  11.594  14.157  -9.562
  233   HG21  THR  34          HG21      THR  34   7.819  14.459  -9.949
  234   HG22  THR  34          HG22      THR  34   8.960  15.076  -8.754
  235   HG23  THR  34          HG23      THR  34   8.262  13.469  -8.559
  236    H    PHE  35           H        PHE  35   9.397  12.369 -13.109
  237    HA   PHE  35           HA       PHE  35  12.174  11.565 -13.454
  238    HB2  PHE  35           HB2      PHE  35   9.823  10.028 -14.543
  239    HB3  PHE  35           HB3      PHE  35  11.414   9.944 -15.289
  240    HD1  PHE  35           HD1      PHE  35  13.289   9.764 -13.188
  241    HD2  PHE  35           HD2      PHE  35   9.368   8.119 -13.369
  242    HE1  PHE  35           HE1      PHE  35  13.951   8.022 -11.582
  243    HE2  PHE  35           HE2      PHE  35  10.023   6.374 -11.763
  244    HZ   PHE  35           HZ       PHE  35  12.317   6.324 -10.866
  Start of MODEL   20
    1    H1   SER   1           H        SER   1  -1.431   1.118  -3.103
    2    HA   SER   1           HA       SER   1   0.276  -0.064  -4.944
    3    HB2  SER   1           HB2      SER   1   0.692   2.130  -2.922
    4    HB3  SER   1           HB3      SER   1   1.992   1.616  -3.998
    5    HG   SER   1           HG       SER   1   0.936   3.262  -5.023
    6    H    GLU   2           H        GLU   2   0.956  -2.112  -4.526
    7    HA   GLU   2           HA       GLU   2   2.454  -2.566  -2.034
    8    HB2  GLU   2           HB2      GLU   2   1.994  -4.892  -2.256
    9    HB3  GLU   2           HB3      GLU   2   0.479  -4.046  -2.534
   10    HG2  GLU   2           HG2      GLU   2   0.818  -4.285  -4.960
   11    HG3  GLU   2           HG3      GLU   2   2.291  -5.200  -4.642
   12    H    CYS   3           H        CYS   3   3.347  -1.311  -4.638
   13    HA   CYS   3           HA       CYS   3   4.994  -2.929  -6.137
   14    HB2  CYS   3           HB2      CYS   3   6.422  -0.833  -6.420
   15    HB3  CYS   3           HB3      CYS   3   4.720  -0.689  -6.848
   16    H    ARG   4           H        ARG   4   7.369  -3.109  -6.117
   17    HA   ARG   4           HA       ARG   4   8.268  -4.022  -3.545
   18    HB2  ARG   4           HB2      ARG   4   9.970  -3.785  -6.019
   19    HB3  ARG   4           HB3      ARG   4  10.145  -4.910  -4.678
   20    HG2  ARG   4           HG2      ARG   4   8.166  -6.103  -5.360
   21    HG3  ARG   4           HG3      ARG   4   7.856  -4.921  -6.632
   22    HD2  ARG   4           HD2      ARG   4   8.957  -6.376  -7.941
   23    HD3  ARG   4           HD3      ARG   4  10.398  -5.663  -7.216
   24    HE   ARG   4           HE       ARG   4  10.778  -7.640  -6.137
   25   HH11  ARG   4          HH11      ARG   4   7.466  -7.561  -7.209
   26   HH12  ARG   4          HH12      ARG   4   7.144  -9.202  -6.757
   27   HH21  ARG   4          HH21      ARG   4  10.366  -9.802  -5.538
   28   HH22  ARG   4          HH22      ARG   4   8.794 -10.476  -5.806
   29    H    TYR   5           H        TYR   5   9.556  -3.011  -2.129
   30    HA   TYR   5           HA       TYR   5  10.043  -0.250  -2.321
   31    HB2  TYR   5           HB2      TYR   5  10.653  -2.404  -0.416
   32    HB3  TYR   5           HB3      TYR   5  11.813  -1.079  -0.404
   33    HD1  TYR   5           HD1      TYR   5   8.888  -2.245   1.052
   34    HD2  TYR   5           HD2      TYR   5  10.613   1.337  -0.464
   35    HE1  TYR   5           HE1      TYR   5   7.353  -0.922   2.446
   36    HE2  TYR   5           HE2      TYR   5   9.084   2.670   0.927
   37    HH   TYR   5           HH       TYR   5   7.210   2.589   2.199
   38    H    LEU   6           H        LEU   6  12.318   0.674  -1.946
   39    HA   LEU   6           HA       LEU   6  13.821   0.565  -4.200
   40    HB2  LEU   6           HB2      LEU   6  14.023   2.060  -2.099
   41    HB3  LEU   6           HB3      LEU   6  15.187   0.855  -1.550
   42    HG   LEU   6           HG       LEU   6  16.239   1.368  -3.947
   43   HD11  LEU   6          HD11      LEU   6  14.357   3.551  -3.440
   44   HD12  LEU   6          HD12      LEU   6  15.130   3.039  -4.940
   45   HD13  LEU   6          HD13      LEU   6  15.999   4.077  -3.810
   46   HD21  LEU   6          HD21      LEU   6  17.222   1.583  -1.619
   47   HD22  LEU   6          HD22      LEU   6  16.686   3.263  -1.654
   48   HD23  LEU   6          HD23      LEU   6  17.854   2.684  -2.844
   49    H    PHE   7           H        PHE   7  15.348  -0.706  -5.095
   50    HA   PHE   7           HA       PHE   7  16.638  -2.534  -5.496
   51    HB2  PHE   7           HB2      PHE   7  17.013  -2.350  -2.502
   52    HB3  PHE   7           HB3      PHE   7  17.909  -3.465  -3.529
   53    HD1  PHE   7           HD1      PHE   7  17.907  -0.280  -2.058
   54    HD2  PHE   7           HD2      PHE   7  19.150  -2.364  -5.554
   55    HE1  PHE   7           HE1      PHE   7  19.566   1.479  -2.511
   56    HE2  PHE   7           HE2      PHE   7  20.812  -0.608  -6.014
   57    HZ   PHE   7           HZ       PHE   7  21.021   1.317  -4.492
   58    H    GLY   8           H        GLY   8  13.955  -3.045  -5.462
   59    HA2  GLY   8           HA2      GLY   8  13.459  -5.379  -3.801
   60    HA3  GLY   8           HA3      GLY   8  12.323  -4.626  -4.910
   61    H    GLY   9           H        GLY   9  15.187  -4.979  -6.527
   62    HA2  GLY   9           HA2      GLY   9  15.970  -6.467  -8.094
   63    HA3  GLY   9           HA3      GLY   9  15.159  -7.736  -7.187
   64    H    CYS  10           H        CYS  10  13.974  -4.893  -8.979
   65    HA   CYS  10           HA       CYS  10  11.876  -6.505 -10.158
   66    HB2  CYS  10           HB2      CYS  10  10.976  -4.445 -10.986
   67    HB3  CYS  10           HB3      CYS  10  11.510  -4.159  -9.333
   68    H    LYS  11           H        LYS  11  11.431  -5.887 -12.596
   69    HA   LYS  11           HA       LYS  11  13.954  -6.136 -14.091
   70    HB2  LYS  11           HB2      LYS  11  11.454  -7.788 -14.307
   71    HB3  LYS  11           HB3      LYS  11  12.534  -7.610 -15.684
   72    HG2  LYS  11           HG2      LYS  11  14.326  -8.313 -13.836
   73    HG3  LYS  11           HG3      LYS  11  12.900  -9.103 -13.161
   74    HD2  LYS  11           HD2      LYS  11  13.367  -9.444 -16.065
   75    HD3  LYS  11           HD3      LYS  11  14.490 -10.264 -14.977
   76    HE2  LYS  11           HE2      LYS  11  12.679 -11.756 -15.505
   77    HE3  LYS  11           HE3      LYS  11  12.551 -11.276 -13.814
   78    HZ1  LYS  11           HZ1      LYS  11  11.073  -9.772 -15.864
   79    HZ2  LYS  11           HZ2      LYS  11  10.712  -9.988 -14.226
   80    HZ3  LYS  11           HZ3      LYS  11  10.463 -11.254 -15.321
   81    H    THR  12           H        THR  12  10.591  -5.117 -14.073
   82    HA   THR  12           HA       THR  12  11.224  -3.210 -16.214
   83    HB   THR  12           HB       THR  12   8.910  -3.550 -17.133
   84    HG1  THR  12           HG1      THR  12   8.241  -4.749 -15.147
   85   HG21  THR  12          HG21      THR  12  11.153  -4.695 -17.903
   86   HG22  THR  12          HG22      THR  12   9.610  -5.166 -18.613
   87   HG23  THR  12          HG23      THR  12  10.340  -6.159 -17.352
   88    H    THR  13           H        THR  13   9.603  -1.432 -16.346
   89    HA   THR  13           HA       THR  13   9.290  -0.164 -13.878
   90    HB   THR  13           HB       THR  13   7.488   0.532 -16.167
   91    HG1  THR  13           HG1      THR  13   9.199   1.428 -17.273
   92   HG21  THR  13          HG21      THR  13   8.512   1.800 -13.778
   93   HG22  THR  13          HG22      THR  13   7.202   2.307 -14.845
   94   HG23  THR  13          HG23      THR  13   8.867   2.761 -15.214
   95    H    ALA  14           H        ALA  14   7.100  -2.207 -15.707
   96    HA   ALA  14           HA       ALA  14   4.729  -1.650 -14.308
   97    HB1  ALA  14           HB1      ALA  14   5.363  -4.351 -15.448
   98    HB2  ALA  14           HB2      ALA  14   3.809  -3.518 -15.364
   99    HB3  ALA  14           HB3      ALA  14   5.050  -2.960 -16.486
  100    H    ASP  15           H        ASP  15   7.502  -3.556 -13.485
  101    HA   ASP  15           HA       ASP  15   6.309  -5.218 -11.529
  102    HB2  ASP  15           HB2      ASP  15   9.170  -4.266 -11.786
  103    HB3  ASP  15           HB3      ASP  15   8.628  -5.562 -10.724
  104    H    CYS  16           H        CYS  16   7.435  -1.929 -11.500
  105    HA   CYS  16           HA       CYS  16   6.926  -1.784  -8.603
  106    HB2  CYS  16           HB2      CYS  16   8.431   0.301 -10.163
  107    HB3  CYS  16           HB3      CYS  16   8.473  -0.021  -8.433
  108    H    CYS  17           H        CYS  17   6.234   0.541  -7.955
  109    HA   CYS  17           HA       CYS  17   3.864   1.158  -9.539
  110    HB2  CYS  17           HB2      CYS  17   3.221   2.543  -7.569
  111    HB3  CYS  17           HB3      CYS  17   3.493   0.849  -7.173
  112    H    LYS  18           H        LYS  18   3.259   3.586  -9.525
  113    HA   LYS  18           HA       LYS  18   4.949   4.967 -11.209
  114    HB2  LYS  18           HB2      LYS  18   3.633   6.990 -10.604
  115    HB3  LYS  18           HB3      LYS  18   2.634   5.597 -10.990
  116    HG2  LYS  18           HG2      LYS  18   2.684   5.220  -8.402
  117    HG3  LYS  18           HG3      LYS  18   3.088   6.939  -8.371
  118    HD2  LYS  18           HD2      LYS  18   1.068   7.520  -9.476
  119    HD3  LYS  18           HD3      LYS  18   0.722   5.835  -9.873
  120    HE2  LYS  18           HE2      LYS  18   0.589   5.394  -7.400
  121    HE3  LYS  18           HE3      LYS  18   0.675   7.138  -7.156
  122    HZ1  LYS  18           HZ1      LYS  18  -1.614   6.192  -7.190
  123    HZ2  LYS  18           HZ2      LYS  18  -1.393   5.823  -8.826
  124    HZ3  LYS  18           HZ3      LYS  18  -1.359   7.433  -8.310
  125    H    HIS  19           H        HIS  19   4.697   5.203  -7.683
  126    HA   HIS  19           HA       HIS  19   6.408   7.325  -7.224
  127    HB2  HIS  19           HB2      HIS  19   6.060   4.820  -5.564
  128    HB3  HIS  19           HB3      HIS  19   6.815   6.308  -5.000
  129    HD1  HIS  19           HD1      HIS  19   5.300   7.945  -3.915
  130    HD2  HIS  19           HD2      HIS  19   3.227   5.242  -6.292
  131    HE1  HIS  19           HE1      HIS  19   2.864   8.444  -3.534
  132    H    LEU  20           H        LEU  20   7.150   4.018  -8.071
  133    HA   LEU  20           HA       LEU  20  10.022   4.569  -7.794
  134    HB2  LEU  20           HB2      LEU  20   8.669   1.924  -8.292
  135    HB3  LEU  20           HB3      LEU  20  10.365   2.190  -7.891
  136    HG   LEU  20           HG       LEU  20   8.289   3.082  -5.949
  137   HD11  LEU  20          HD11      LEU  20   7.522   0.864  -6.534
  138   HD12  LEU  20          HD12      LEU  20   8.265   0.842  -4.935
  139   HD13  LEU  20          HD13      LEU  20   9.151   0.218  -6.326
  140   HD21  LEU  20          HD21      LEU  20  10.198   3.523  -4.886
  141   HD22  LEU  20          HD22      LEU  20  11.147   2.572  -6.029
  142   HD23  LEU  20          HD23      LEU  20  10.357   1.780  -4.665
  143    H    GLY  21           H        GLY  21  11.402   3.472  -9.523
  144    HA2  GLY  21           HA2      GLY  21  10.120   3.479 -12.159
  145    HA3  GLY  21           HA3      GLY  21  11.438   4.609 -11.880
  146    H    CYS  22           H        CYS  22  10.566   1.220 -12.128
  147    HA   CYS  22           HA       CYS  22  12.981  -0.015 -11.656
  148    HB2  CYS  22           HB2      CYS  22  10.693  -1.037 -12.271
  149    HB3  CYS  22           HB3      CYS  22  11.216  -0.858 -13.943
  150    H    ARG  23           H        ARG  23  14.927   0.336 -12.475
  151    HA   ARG  23           HA       ARG  23  15.212   1.613 -15.072
  152    HB2  ARG  23           HB2      ARG  23  17.047   1.070 -12.768
  153    HB3  ARG  23           HB3      ARG  23  17.724   1.426 -14.351
  154    HG2  ARG  23           HG2      ARG  23  16.225   3.504 -14.311
  155    HG3  ARG  23           HG3      ARG  23  16.062   3.180 -12.584
  156    HD2  ARG  23           HD2      ARG  23  17.848   4.751 -12.907
  157    HD3  ARG  23           HD3      ARG  23  18.535   3.209 -12.399
  158    HE   ARG  23           HE       ARG  23  18.687   3.048 -15.076
  159   HH11  ARG  23          HH11      ARG  23  19.630   5.526 -12.819
  160   HH12  ARG  23          HH12      ARG  23  20.940   6.101 -13.797
  161   HH21  ARG  23          HH21      ARG  23  20.410   3.796 -16.372
  162   HH22  ARG  23          HH22      ARG  23  21.382   5.116 -15.818
  163    H    THR  24           H        THR  24  16.259   0.731 -16.830
  164    HA   THR  24           HA       THR  24  16.232  -2.154 -16.973
  165    HB   THR  24           HB       THR  24  16.603  -1.916 -19.325
  166    HG1  THR  24           HG1      THR  24  18.174  -0.358 -19.457
  167   HG21  THR  24          HG21      THR  24  14.955   0.436 -19.299
  168   HG22  THR  24          HG22      THR  24  14.490  -0.637 -17.978
  169   HG23  THR  24          HG23      THR  24  14.505  -1.234 -19.638
  170    H    ASP  25           H        ASP  25  18.536   0.276 -16.338
  171    HA   ASP  25           HA       ASP  25  20.796  -1.387 -17.145
  172    HB2  ASP  25           HB2      ASP  25  20.963   0.971 -17.683
  173    HB3  ASP  25           HB3      ASP  25  20.669   1.411 -16.004
  174    H    LEU  26           H        LEU  26  19.320  -0.027 -14.237
  175    HA   LEU  26           HA       LEU  26  21.253  -1.400 -12.541
  176    HB2  LEU  26           HB2      LEU  26  19.068   0.589 -12.048
  177    HB3  LEU  26           HB3      LEU  26  19.785  -0.314 -10.716
  178    HG   LEU  26           HG       LEU  26  22.026   0.642 -11.762
  179   HD11  LEU  26          HD11      LEU  26  20.529   3.102 -12.214
  180   HD12  LEU  26          HD12      LEU  26  20.210   1.853 -13.417
  181   HD13  LEU  26          HD13      LEU  26  21.861   2.397 -13.131
  182   HD21  LEU  26          HD21      LEU  26  20.734   1.034  -9.491
  183   HD22  LEU  26          HD22      LEU  26  20.453   2.624 -10.203
  184   HD23  LEU  26          HD23      LEU  26  22.101   2.043  -9.963
  185    H    TYR  27           H        TYR  27  17.911  -1.607 -13.538
  186    HA   TYR  27           HA       TYR  27  16.331  -3.223 -13.276
  187    HB2  TYR  27           HB2      TYR  27  18.882  -4.660 -12.887
  188    HB3  TYR  27           HB3      TYR  27  17.458  -5.465 -12.237
  189    HD1  TYR  27           HD1      TYR  27  17.633  -3.335 -15.273
  190    HD2  TYR  27           HD2      TYR  27  17.221  -7.275 -13.720
  191    HE1  TYR  27           HE1      TYR  27  17.078  -4.159 -17.523
  192    HE2  TYR  27           HE2      TYR  27  16.667  -8.109 -15.966
  193    HH   TYR  27           HH       TYR  27  17.334  -6.744 -18.652
  194    H    TYR  28           H        TYR  28  16.126  -1.453 -11.377
  195    HA   TYR  28           HA       TYR  28  15.183  -2.951  -9.116
  196    HB2  TYR  28           HB2      TYR  28  16.619  -2.240  -7.460
  197    HB3  TYR  28           HB3      TYR  28  17.741  -2.399  -8.807
  198    HD1  TYR  28           HD1      TYR  28  17.724  -0.102 -10.329
  199    HD2  TYR  28           HD2      TYR  28  16.963  -0.383  -6.152
  200    HE1  TYR  28           HE1      TYR  28  18.390   2.249 -10.055
  201    HE2  TYR  28           HE2      TYR  28  17.626   1.968  -5.867
  202    HH   TYR  28           HH       TYR  28  18.709   3.919  -8.633
  203    H    CYS  29           H        CYS  29  13.688  -1.818  -7.885
  204    HA   CYS  29           HA       CYS  29  12.353   0.310  -9.172
  205    HB2  CYS  29           HB2      CYS  29  12.086  -0.673  -6.323
  206    HB3  CYS  29           HB3      CYS  29  10.942   0.379  -7.151
  207    H    ALA  30           H        ALA  30  12.989   2.351  -9.281
  208    HA   ALA  30           HA       ALA  30  14.735   3.435  -7.198
  209    HB1  ALA  30           HB1      ALA  30  15.332   3.620  -9.633
  210    HB2  ALA  30           HB2      ALA  30  13.980   4.741  -9.804
  211    HB3  ALA  30           HB3      ALA  30  15.329   5.140  -8.740
  212    H    TRP  31           H        TRP  31  13.509   4.099  -5.514
  213    HA   TRP  31           HA       TRP  31  10.940   5.267  -5.762
  214    HB2  TRP  31           HB2      TRP  31  11.721   4.121  -3.715
  215    HB3  TRP  31           HB3      TRP  31  12.877   5.421  -3.442
  216    HD1  TRP  31           HD1      TRP  31  11.697   7.939  -3.048
  217    HE1  TRP  31           HE1      TRP  31   9.556   8.500  -1.733
  218    HE3  TRP  31           HE3      TRP  31   9.531   3.309  -3.016
  219    HZ2  TRP  31           HZ2      TRP  31   7.254   7.156  -0.805
  220    HZ3  TRP  31           HZ3      TRP  31   7.359   3.030  -1.892
  221    HH2  TRP  31           HH2      TRP  31   6.246   4.916  -0.810
  222    H    ASP  32           H        ASP  32  10.614   7.154  -6.744
  223    HA   ASP  32           HA       ASP  32  12.058   9.496  -5.803
  224    HB2  ASP  32           HB2      ASP  32  13.328   8.613  -7.785
  225    HB3  ASP  32           HB3      ASP  32  11.889   8.899  -8.761
  226    H    GLY  33           H        GLY  33   9.735   8.427  -8.297
  227    HA2  GLY  33           HA2      GLY  33   7.450   9.001  -8.355
  228    HA3  GLY  33           HA3      GLY  33   7.761  10.271  -7.181
  229    H    THR  34           H        THR  34  10.129  11.124  -8.868
  230    HA   THR  34           HA       THR  34   8.569  12.801 -10.694
  231    HB   THR  34           HB       THR  34  10.815  14.063 -10.864
  232    HG1  THR  34           HG1      THR  34  12.386  13.411  -9.596
  233   HG21  THR  34          HG21      THR  34   9.685  14.125  -8.091
  234   HG22  THR  34          HG22      THR  34   8.688  14.606  -9.464
  235   HG23  THR  34          HG23      THR  34  10.191  15.462  -9.123
  236    H    PHE  35           H        PHE  35   8.529  12.339 -12.785
  237    HA   PHE  35           HA       PHE  35  10.900  11.146 -14.033
  238    HB2  PHE  35           HB2      PHE  35   8.063  10.145 -14.324
  239    HB3  PHE  35           HB3      PHE  35   9.387   9.663 -15.378
  240    HD1  PHE  35           HD1      PHE  35  10.748   7.871 -14.809
  241    HD2  PHE  35           HD2      PHE  35   8.330   9.697 -11.819
  242    HE1  PHE  35           HE1      PHE  35  11.351   6.081 -13.232
  243    HE2  PHE  35           HE2      PHE  35   8.930   7.911 -10.237
  244    HZ   PHE  35           HZ       PHE  35  10.442   6.099 -10.943