*HEADER    PROTEIN FIBRIL                          21-NOV-16   5MGQ              
*TITLE     SOLUTION STRUCTURE OF OXIDIZED AND AMIDATED HUMAN IAPP (1-37), THE    
*TITLE    2 DIABETES II PEPTIDE.                                                 
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ISLET AMYLOID POLYPEPTIDE;                                 
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: AMYLIN,DIABETES-ASSOCIATED PEPTIDE,DAP,INSULINOMA AMYLOID   
*COMPND   5 PEPTIDE;                                                             
*COMPND   6 ENGINEERED: YES;                                                     
*COMPND   7 OTHER_DETAILS: RESIDUE NAME "ATY" REFERS TO AMIDATION OF C-TERMINAL  
*COMPND   8 TYR.                                                                 
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: IAPP;                                                          
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3);                       
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 469008                                      
*KEYWDS    RECOMBINANT HUMAN IAPP, TYPE II DIABETES, PROTEIN FIBRIL              
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    D.C.RODRIGUEZ CAMARGO,K.TRIPSIANES,B.REIF                             
*REVDAT   1   29-MAR-17 5MGQ    0                                                
# Restraints file 1: dihedrals.tbl
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         (segid    A and resid 2    and name CA  ) (segid    A and resid 2    and name C   )  1.00 -141.59 13.26 2

 ASSIGN  (segid    A and resid 2    and name N   ) (segid    A and resid 2    and name CA  )
         (segid    A and resid 2    and name C   ) (segid    A and resid 3    and name N   )  1.00 160.02  8.09 2

 ASSIGN  (segid    A and resid 3    and name C   ) (segid    A and resid 4    and name N   )
         (segid    A and resid 4    and name CA  ) (segid    A and resid 4    and name C   )  1.00 -124.79 23.65 2

 ASSIGN  (segid    A and resid 4    and name N   ) (segid    A and resid 4    and name CA  )
         (segid    A and resid 4    and name C   ) (segid    A and resid 5    and name N   )  1.00 168.17 12.83 2

 ASSIGN  (segid    A and resid 4    and name C   ) (segid    A and resid 5    and name N   )
         (segid    A and resid 5    and name CA  ) (segid    A and resid 5    and name C   )  1.00 -66.14  8.77 2

 ASSIGN  (segid    A and resid 5    and name N   ) (segid    A and resid 5    and name CA  )
         (segid    A and resid 5    and name C   ) (segid    A and resid 6    and name N   )  1.00 -28.37  8.31 2

 ASSIGN  (segid    A and resid 5    and name C   ) (segid    A and resid 6    and name N   )
         (segid    A and resid 6    and name CA  ) (segid    A and resid 6    and name C   )  1.00 -77.96 15.09 2

 ASSIGN  (segid    A and resid 6    and name N   ) (segid    A and resid 6    and name CA  )
         (segid    A and resid 6    and name C   ) (segid    A and resid 7    and name N   )  1.00 -21.66 15.53 2

 ASSIGN  (segid    A and resid 8    and name C   ) (segid    A and resid 9    and name N   )
         (segid    A and resid 9    and name CA  ) (segid    A and resid 9    and name C   )  1.00 -62.30  3.86 2

 ASSIGN  (segid    A and resid 9    and name N   ) (segid    A and resid 9    and name CA  )
         (segid    A and resid 9    and name C   ) (segid    A and resid 10   and name N   )  1.00 -36.50  4.97 2

 ASSIGN  (segid    A and resid 9    and name C   ) (segid    A and resid 10   and name N   )
         (segid    A and resid 10   and name CA  ) (segid    A and resid 10   and name C   )  1.00 -68.51  4.77 2

 ASSIGN  (segid    A and resid 10   and name N   ) (segid    A and resid 10   and name CA  )
         (segid    A and resid 10   and name C   ) (segid    A and resid 11   and name N   )  1.00 -35.16  3.49 2

 ASSIGN  (segid    A and resid 10   and name C   ) (segid    A and resid 11   and name N   )
         (segid    A and resid 11   and name CA  ) (segid    A and resid 11   and name C   )  1.00 -69.10  4.09 2

 ASSIGN  (segid    A and resid 11   and name N   ) (segid    A and resid 11   and name CA  )
         (segid    A and resid 11   and name C   ) (segid    A and resid 12   and name N   )  1.00 -37.56  5.05 2

 ASSIGN  (segid    A and resid 11   and name C   ) (segid    A and resid 12   and name N   )
         (segid    A and resid 12   and name CA  ) (segid    A and resid 12   and name C   )  1.00 -69.31  5.92 2

 ASSIGN  (segid    A and resid 12   and name N   ) (segid    A and resid 12   and name CA  )
         (segid    A and resid 12   and name C   ) (segid    A and resid 13   and name N   )  1.00 -31.76  8.95 2

 ASSIGN  (segid    A and resid 12   and name C   ) (segid    A and resid 13   and name N   )
         (segid    A and resid 13   and name CA  ) (segid    A and resid 13   and name C   )  1.00 -64.52  6.88 2

 ASSIGN  (segid    A and resid 13   and name N   ) (segid    A and resid 13   and name CA  )
         (segid    A and resid 13   and name C   ) (segid    A and resid 14   and name N   )  1.00 -29.86  8.64 2

 ASSIGN  (segid    A and resid 13   and name C   ) (segid    A and resid 14   and name N   )
         (segid    A and resid 14   and name CA  ) (segid    A and resid 14   and name C   )  1.00 -74.04  7.30 2

 ASSIGN  (segid    A and resid 14   and name N   ) (segid    A and resid 14   and name CA  )
         (segid    A and resid 14   and name C   ) (segid    A and resid 15   and name N   )  1.00 -16.54  7.67 2

# Restraints file 2: unambig.tbl
 assi 
   (( segid    A and resid 3    and name  HN  ))
   (( segid    A and resid 4    and name  HN  ))
      2.945     1.145     1.145

 assi 
   (( segid    A and resid 5    and name  HN  ))
   (( segid    A and resid 6    and name  HN  ))
      2.850     1.050     1.050

 assi 
   (( segid    A and resid 33   and name  HN  ))
   (( segid    A and resid 34   and name  HN  ))
      2.625     0.825     0.825

 assi 
   (( segid    A and resid 35   and name  HN  ))
   (( segid    A and resid 36   and name  HN  ))
      2.840     1.040     1.040

 assi 
   (( segid    A and resid 30   and name  HN  ))
   (( segid    A and resid 31   and name  HN  ))
      2.570     0.770     0.770

 assi 
   (( segid    A and resid 22   and name  HD21))
   (( segid    A and resid 23   and name  HN  ))
      3.545     1.745     1.745

 assi 
   (( segid    A and resid 14   and name  HN  ))
   (( segid    A and resid 14   and name  HD21))
      3.070     1.270     1.270

 assi 
   (( segid    A and resid 14   and name  HN  ))
   (( segid    A and resid 14   and name  HD22))
      3.140     1.340     1.340

 assi 
   (( segid    A and resid 31   and name  HN  ))
   (( segid    A and resid 32   and name  HN  ))
      2.875     1.075     1.075

 assi 
   (( segid    A and resid 34   and name  HN  ))
   (( segid    A and resid 35   and name  HN  ))
      2.860     1.060     1.060

 assi 
   (( segid    A and resid 29   and name  HN  ))
   (( segid    A and resid 30   and name  HN  ))
      2.750     0.950     0.950

 assi 
   (( segid    A and resid 32   and name  HN  ))
   (( segid    A and resid 33   and name  HN  ))
      2.680     0.880     0.880

 assi 
   (( segid    A and resid 4    and name  HN  ))
   (( segid    A and resid 9    and name  HN  ))
      3.675     1.875     1.875

 assi 
   (( segid    A and resid 5    and name  HN  ))
   (( segid    A and resid 9    and name  HN  ))
      3.825     2.025     2.025

 assi 
   (( segid    A and resid 24   and name  HN  ))
   (( segid    A and resid 25   and name  HN  ))
      2.765     0.965     0.965

 assi 
   (( segid    A and resid 17   and name  HN  ))
   (( segid    A and resid 18   and name  HN  ))
      2.950     1.150     1.150

 assi 
   (( segid    A and resid 4    and name  HN  ))
   (( segid    A and resid 6    and name  HN  ))
      3.250     1.450     1.450

 assi 
   (( segid    A and resid 4    and name  HN  ))
   (( segid    A and resid 5    and name  HN  ))
      3.190     1.390     1.390

 assi 
   (( segid    A and resid 21   and name  HN  ))
   (( segid    A and resid 21   and name  HD21))
      3.190     1.390     1.390

 assi 
   (  segid    A and resid 23   and name  HD# )
   (( segid    A and resid 24   and name  HN  ))
      3.210     1.410     1.410

 assi 
   (  segid    A and resid 15   and name  HD# )
   (( segid    A and resid 16   and name  HN  ))
      3.015     1.215     1.215

 assi 
   (( segid    A and resid 23   and name  HN  ))
   (  segid    A and resid 23   and name  HD# )
      2.905     1.105     1.105

 assi 
   (( segid    A and resid 15   and name  HN  ))
   (  segid    A and resid 15   and name  HD# )
      2.890     1.090     1.090

 assi 
   (( segid    A and resid 37   and name  HN  ))
   (  segid    A and resid 37   and name  HD# )
      2.970     1.170     1.170

 assi 
   (( segid    A and resid 31   and name  HA  ))
   (( segid    A and resid 32   and name  HN  ))
      2.530     0.730     0.730

 assi 
   (( segid    A and resid 35   and name  HA  ))
   (( segid    A and resid 36   and name  HN  ))
      2.610     0.810     0.810

 assi 
   (( segid    A and resid 31   and name  HA  ))
   (( segid    A and resid 33   and name  HN  ))
      3.180     1.380     1.380

 assi 
   (( segid    A and resid 18   and name  HA  ))
   (( segid    A and resid 19   and name  HN  ))
      2.610     0.810     0.810

 assi 
   (( segid    A and resid 22   and name  HA  ))
   (( segid    A and resid 22   and name  HD22))
      3.195     1.395     1.395

 assi 
   (( segid    A and resid 22   and name  HA  ))
   (( segid    A and resid 23   and name  HN  ))
      2.560     0.760     0.760

 assi 
   (( segid    A and resid 25   and name  HN  ))
   (( segid    A and resid 26   and name  HA  ))
      3.070     1.270     1.270

 assi 
   (( segid    A and resid 23   and name  HA  ))
   (( segid    A and resid 24   and name  HN  ))
      2.670     0.870     0.870

 assi 
   (( segid    A and resid 13   and name  HN  ))
   (( segid    A and resid 14   and name  HA  ))
      3.530     1.730     1.730

 assi 
   (( segid    A and resid 4    and name  HA  ))
   (( segid    A and resid 5    and name  HN  ))
      2.470     0.670     0.670

 assi 
   (( segid    A and resid 15   and name  HA  ))
   (( segid    A and resid 16   and name  HN  ))
      2.655     0.855     0.855

 assi 
   (( segid    A and resid 7    and name  HA  ))
   (( segid    A and resid 11   and name  HN  ))
      3.315     1.515     1.515

 assi 
   (( segid    A and resid 14   and name  HA  ))
   (( segid    A and resid 17   and name  HN  ))
      3.070     1.270     1.270

 assi 
   (( segid    A and resid 29   and name  HA  ))
   (( segid    A and resid 30   and name  HN  ))
      2.585     0.785     0.785

 assi 
   (( segid    A and resid 7    and name  HA  ))
   (( segid    A and resid 9    and name  HN  ))
      3.255     1.455     1.455

 assi 
   (( segid    A and resid 20   and name  HA  ))
   (( segid    A and resid 21   and name  HN  ))
      2.615     0.815     0.815

 assi 
   (( segid    A and resid 30   and name  HA  ))
   (( segid    A and resid 31   and name  HN  ))
      2.685     0.885     0.885

 assi 
   (( segid    A and resid 25   and name  HA  ))
   (( segid    A and resid 26   and name  HN  ))
      2.560     0.760     0.760

 assi 
   (( segid    A and resid 10   and name  HA  ))
   (( segid    A and resid 13   and name  HN  ))
      2.795     0.995     0.995

 assi 
   (( segid    A and resid 16   and name  HA  ))
   (( segid    A and resid 17   and name  HN  ))
      2.670     0.870     0.870

 assi 
   (( segid    A and resid 11   and name  HA  ))
   (( segid    A and resid 15   and name  HN  ))
      3.245     1.445     1.445

 assi 
   (( segid    A and resid 11   and name  HA  ))
   (( segid    A and resid 14   and name  HD22))
      3.145     1.345     1.345

 assi 
   (( segid    A and resid 11   and name  HA  ))
   (( segid    A and resid 11   and name  HE  ))
      3.200     1.400     1.400

 assi 
   (( segid    A and resid 36   and name  HA  ))
   (( segid    A and resid 37   and name  HN  ))
      2.440     0.640     0.640

 assi 
   (( segid    A and resid 10   and name  HA  ))
   (( segid    A and resid 14   and name  HD21))
      3.120     1.320     1.320

 assi 
   (( segid    A and resid 10   and name  HA  ))
   (( segid    A and resid 10   and name  HE21))
      3.090     1.290     1.290

 assi 
   (( segid    A and resid 10   and name  HA  ))
   (( segid    A and resid 10   and name  HE22))
      3.115     1.315     1.315

 assi 
   (( segid    A and resid 17   and name  HA  ))
   (( segid    A and resid 18   and name  HN  ))
      2.615     0.815     0.815

 assi 
   (  segid    A and resid 33   and name  HA# )
   (( segid    A and resid 34   and name  HN  ))
      2.460     0.660     0.660

 assi 
   (( segid    A and resid 29   and name  HB2 ))
   (( segid    A and resid 31   and name  HN  ))
      3.530     1.730     1.730

 assi 
   (( segid    A and resid 34   and name  HB1 ))
   (( segid    A and resid 35   and name  HN  ))
      3.030     1.230     1.230

 assi 
   (( segid    A and resid 28   and name  HB1 ))
   (( segid    A and resid 29   and name  HN  ))
      2.865     1.065     1.065

 assi 
   (( segid    A and resid 24   and name  HA1 ))
   (( segid    A and resid 28   and name  HN  ))
      2.605     0.805     0.805

 assi 
   (( segid    A and resid 28   and name  HB1 ))
   (( segid    A and resid 30   and name  HN  ))
      2.845     1.045     1.045

 assi 
   (( segid    A and resid 24   and name  HA1 ))
   (( segid    A and resid 27   and name  HN  ))
      3.095     1.295     1.295

 assi 
   (( segid    A and resid 20   and name  HB2 ))
   (( segid    A and resid 21   and name  HN  ))
      2.780     0.980     0.980

 assi 
   (( segid    A and resid 20   and name  HN  ))
   (( segid    A and resid 20   and name  HB2 ))
      2.595     0.795     0.795

 assi 
   (( segid    A and resid 2    and name  HB2 ))
   (( segid    A and resid 4    and name  HN  ))
      2.960     1.160     1.160

 assi 
   (( segid    A and resid 2    and name  HB2 ))
   (( segid    A and resid 3    and name  HN  ))
      3.045     1.245     1.245

 assi 
   (( segid    A and resid 7    and name  HB2 ))
   (( segid    A and resid 8    and name  HN  ))
      2.890     1.090     1.090

 assi 
   (( segid    A and resid 7    and name  HN  ))
   (( segid    A and resid 7    and name  HB2 ))
      2.855     1.055     1.055

 assi 
   (( segid    A and resid 23   and name  HB1 ))
   (( segid    A and resid 24   and name  HN  ))
      2.975     1.175     1.175

 assi 
   (( segid    A and resid 18   and name  HN  ))
   (( segid    A and resid 18   and name  HB2 ))
      2.715     0.915     0.915

 assi 
   (( segid    A and resid 11   and name  HN  ))
   (  segid    A and resid 11   and name  HD# )
      3.035     1.235     1.235

 assi 
   (( segid    A and resid 15   and name  HB1 ))
   (( segid    A and resid 17   and name  HN  ))
      3.705     1.905     1.905

 assi 
   (( segid    A and resid 17   and name  HN  ))
   (( segid    A and resid 18   and name  HB2 ))
      3.900     2.100     2.100

 assi 
   (( segid    A and resid 23   and name  HN  ))
   (( segid    A and resid 23   and name  HB1 ))
      2.700     0.900     0.900

 assi 
   (( segid    A and resid 20   and name  HN  ))
   (( segid    A and resid 23   and name  HB1 ))
      3.240     1.440     1.440

 assi 
   (( segid    A and resid 10   and name  HN  ))
   (  segid    A and resid 11   and name  HD# )
      3.715     1.915     1.915

 assi 
   (( segid    A and resid 14   and name  HN  ))
   (( segid    A and resid 15   and name  HB1 ))
      3.155     1.355     1.355

 assi 
   (( segid    A and resid 2    and name  HB1 ))
   (( segid    A and resid 3    and name  HN  ))
      3.100     1.300     1.300

 assi 
   (( segid    A and resid 37   and name  HN  ))
   (( segid    A and resid 37   and name  HB1 ))
      2.825     1.025     1.025

 assi 
   (( segid    A and resid 4    and name  HN  ))
   (( segid    A and resid 7    and name  HB1 ))
      2.955     1.155     1.155

 assi 
   (( segid    A and resid 6    and name  HN  ))
   (( segid    A and resid 7    and name  HB1 ))
      3.250     1.450     1.450

 assi 
   (( segid    A and resid 7    and name  HN  ))
   (( segid    A and resid 7    and name  HB1 ))
      2.820     1.020     1.020

 assi 
   (( segid    A and resid 23   and name  HB2 ))
   (( segid    A and resid 24   and name  HN  ))
      2.990     1.190     1.190

 assi 
   (( segid    A and resid 23   and name  HN  ))
   (( segid    A and resid 23   and name  HB2 ))
      2.655     0.855     0.855

 assi 
   (( segid    A and resid 37   and name  HN  ))
   (( segid    A and resid 37   and name  HB2 ))
      2.755     0.955     0.955

 assi 
   (  segid    A and resid 3    and name  HB# )
   (( segid    A and resid 4    and name  HN  ))
      2.945     1.145     1.145

 assi 
   (( segid    A and resid 3    and name  HN  ))
   (  segid    A and resid 3    and name  HB# )
      2.915     1.115     1.115

 assi 
   (  segid    A and resid 3    and name  HB# )
   (( segid    A and resid 3    and name  HD22))
      2.820     1.020     1.020

 assi 
   (  segid    A and resid 3    and name  HB# )
   (( segid    A and resid 3    and name  HD21))
      2.680     0.880     0.880

 assi 
   (( segid    A and resid 35   and name  HN  ))
   (( segid    A and resid 35   and name  HB2 ))
      2.715     0.915     0.915

 assi 
   (( segid    A and resid 35   and name  HN  ))
   (( segid    A and resid 35   and name  HB1 ))
      2.980     1.180     1.180

 assi 
   (( segid    A and resid 34   and name  HN  ))
   (( segid    A and resid 35   and name  HB2 ))
      3.250     1.450     1.450

 assi 
   (( segid    A and resid 35   and name  HB1 ))
   (( segid    A and resid 36   and name  HN  ))
      3.500     1.700     1.700

 assi 
   (( segid    A and resid 13   and name  HN  ))
   (  segid    A and resid 14   and name  HB# )
      3.225     1.425     1.425

 assi 
   (( segid    A and resid 12   and name  HN  ))
   (  segid    A and resid 14   and name  HB# )
      3.640     1.840     1.840

 assi 
   (( segid    A and resid 35   and name  HB2 ))
   (( segid    A and resid 37   and name  HN  ))
      3.890     2.090     2.090

 assi 
   (  segid    A and resid 14   and name  HB# )
   (( segid    A and resid 16   and name  HN  ))
      3.200     1.400     1.400

 assi 
   (  segid    A and resid 14   and name  HB# )
   (( segid    A and resid 15   and name  HN  ))
      2.745     0.945     0.945

 assi 
   (( segid    A and resid 20   and name  HN  ))
   (( segid    A and resid 21   and name  HB2 ))
      3.125     1.325     1.325

 assi 
   (( segid    A and resid 14   and name  HN  ))
   (  segid    A and resid 14   and name  HB# )
      2.550     0.750     0.750

 assi 
   (  segid    A and resid 14   and name  HB# )
   (( segid    A and resid 14   and name  HD21))
      2.795     0.995     0.995

 assi 
   (  segid    A and resid 14   and name  HB# )
   (( segid    A and resid 14   and name  HD22))
      2.855     1.055     1.055

 assi 
   (( segid    A and resid 21   and name  HN  ))
   (( segid    A and resid 21   and name  HB2 ))
      2.580     0.780     0.780

 assi 
   (( segid    A and resid 21   and name  HB2 ))
   (( segid    A and resid 22   and name  HN  ))
      2.850     1.050     1.050

 assi 
   (( segid    A and resid 22   and name  HB1 ))
   (( segid    A and resid 22   and name  HD21))
      2.835     1.035     1.035

 assi 
   (( segid    A and resid 10   and name  HN  ))
   (( segid    A and resid 10   and name  HG2 ))
      2.775     0.975     0.975

 assi 
   (( segid    A and resid 10   and name  HG2 ))
   (( segid    A and resid 11   and name  HN  ))
      3.065     1.265     1.265

 assi 
   (( segid    A and resid 10   and name  HG2 ))
   (( segid    A and resid 10   and name  HE21))
      2.805     1.005     1.005

 assi 
   (( segid    A and resid 10   and name  HG2 ))
   (( segid    A and resid 10   and name  HE22))
      2.925     1.125     1.125

 assi 
   (( segid    A and resid 32   and name  HN  ))
   (( segid    A and resid 32   and name  HB  ))
      2.730     0.930     0.930

 assi 
   (( segid    A and resid 32   and name  HB  ))
   (( segid    A and resid 33   and name  HN  ))
      3.000     1.200     1.200

 assi 
   (( segid    A and resid 10   and name  HN  ))
   (( segid    A and resid 10   and name  HB2 ))
      2.580     0.780     0.780

 assi 
   (( segid    A and resid 10   and name  HB2 ))
   (( segid    A and resid 11   and name  HN  ))
      2.805     1.005     1.005

 assi 
   (( segid    A and resid 9    and name  HN  ))
   (( segid    A and resid 10   and name  HB2 ))
      3.460     1.660     1.660

 assi 
   (( segid    A and resid 10   and name  HB2 ))
   (( segid    A and resid 10   and name  HE21))
      3.215     1.415     1.415

 assi 
   (( segid    A and resid 10   and name  HB2 ))
   (( segid    A and resid 13   and name  HN  ))
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 assi 
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 assi 
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      2.710     0.910     0.910

 assi 
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 assi 
   (( segid    A and resid 26   and name  HN  ))
   (( segid    A and resid 26   and name  HB  ))
      2.670     0.870     0.870

 assi 
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 assi 
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 assi 
   (( segid    A and resid 11   and name  HN  ))
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 assi 
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      3.710     1.910     1.910

 assi 
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 assi 
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 assi 
   (( segid    A and resid 10   and name  HN  ))
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 assi 
   (( segid    A and resid 12   and name  HN  ))
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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      2.400     0.600     0.600

 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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      3.070     1.270     1.270

 assi 
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 assi 
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 assi 
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 assi 
   (( segid    A and resid 9    and name  HN  ))
   (  segid    A and resid 9    and name  HG2#)
      2.755     0.955     0.955

 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
   (( segid    A and resid 30   and name  HN  ))
   (  segid    A and resid 30   and name  HG2#)
      2.740     0.940     0.940

 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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      2.655     0.855     0.855

 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
   (( segid    A and resid 7    and name  HN  ))
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
   (( segid    A and resid 9    and name  HN  ))
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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 assi 
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   (( segid    A and resid 19   and name  HB1 ))
   (( segid    A and resid 22   and name  HB1 ))
      3.445     1.645     1.645

 assi 
   (  segid    A and resid 27   and name  HD2#)
   (( segid    A and resid 28   and name  HA  ))
      3.370     1.570     1.570

 assi 
   (( segid    A and resid 22   and name  HN  ))
   (  segid    A and resid 23   and name  HD# )
      3.095     1.295     1.295

 assi 
   (  segid    A and resid 4    and name  HG2#)
   (( segid    A and resid 6    and name  HA  ))
      3.105     1.305     1.305

 assi 
   (( segid    A and resid 2    and name  HB1 ))
   (  segid    A and resid 4    and name  HG2#)
      3.590     1.790     1.790

 assi 
   (  segid    A and resid 4    and name  HG2#)
   (( segid    A and resid 7    and name  HB1 ))
      3.180     1.380     1.380

 assi 
   (  segid    A and resid 4    and name  HG2#)
   (  segid    A and resid 5    and name  HB# )
      3.085     1.285     1.285

 assi 
   (  segid    A and resid 15   and name  HE# )
   (( segid    A and resid 16   and name  HN  ))
      3.520     1.720     1.720

 assi 
   (  segid    A and resid 17   and name  HG2#)
   (( segid    A and resid 18   and name  HD2 ))
      2.970     1.170     1.170

 assi 
   (  segid    A and resid 8    and name  HB# )
   (  segid    A and resid 11   and name  HD# )
      3.355     1.555     1.555

 assi 
   (( segid    A and resid 1    and name  HA  ))
   (  segid    A and resid 1    and name  HD# )
      3.295     1.495     1.495

 assi 
   (( segid    A and resid 9    and name  HA  ))
   (  segid    A and resid 12   and name  HD2#)
      3.300     1.500     1.500

 assi 
   (( segid    A and resid 14   and name  HD21))
   (  segid    A and resid 17   and name  HG2#)
      3.130     1.330     1.330

 assi 
   (( segid    A and resid 27   and name  HB1 ))
   (( segid    A and resid 28   and name  HA  ))
      3.375     1.575     1.575

 assi 
   (( segid    A and resid 11   and name  HN  ))
   (( segid    A and resid 11   and name  HG2 ))
      3.280     1.480     1.480

 assi 
   (  segid    A and resid 11   and name  HD# )
   (  segid    A and resid 14   and name  HB# )
      3.560     1.760     1.760

 assi 
   (  segid    A and resid 14   and name  HB# )
   (( segid    A and resid 15   and name  HB1 ))
      3.665     1.865     1.865

 assi 
   (  segid    A and resid 14   and name  HB# )
   (  segid    A and resid 17   and name  HG1#)
      3.055     1.255     1.255

 assi 
   (( segid    A and resid 4    and name  HN  ))
   (( segid    A and resid 7    and name  HB2 ))
      3.495     1.695     1.695

 assi 
   (( segid    A and resid 10   and name  HB1 ))
   (( segid    A and resid 11   and name  HN  ))
      3.190     1.390     1.390

 assi 
   (( segid    A and resid 23   and name  HN  ))
   (  segid    A and resid 23   and name  HE# )
      3.565     1.765     1.765

 assi 
   (( segid    A and resid 4    and name  HA  ))
   (  segid    A and resid 5    and name  HB# )
      3.040     1.240     1.240

 assi 
   (  segid    A and resid 6    and name  HG2#)
   (( segid    A and resid 7    and name  HN  ))
      3.035     1.235     1.235

 assi 
   (( segid    A and resid 12   and name  HB2 ))
   (( segid    A and resid 13   and name  HN  ))
      3.135     1.335     1.335

 assi 
   (  segid    A and resid 11   and name  HD# )
   (( segid    A and resid 12   and name  HN  ))
      3.320     1.520     1.520

 assi 
   (( segid    A and resid 12   and name  HB2 ))
   (  segid    A and resid 12   and name  HD2#)
      2.745     0.945     0.945

 assi 
   (( segid    A and resid 26   and name  HB  ))
   (( segid    A and resid 27   and name  HA  ))
      3.775     1.975     1.975

 assi 
   (( segid    A and resid 26   and name  HG11))
   (( segid    A and resid 27   and name  HA  ))
      3.280     1.480     1.480

 assi 
   (  segid    A and resid 4    and name  HG2#)
   (( segid    A and resid 6    and name  HN  ))
      3.080     1.280     1.280

 assi 
   (( segid    A and resid 22   and name  HB2 ))
   (  segid    A and resid 25   and name  HB# )
      3.545     1.745     1.745

 assi 
   (( segid    A and resid 2    and name  HB2 ))
   (  segid    A and resid 8    and name  HB# )
      3.315     1.515     1.515

 assi 
   (( segid    A and resid 7    and name  HB2 ))
   (  segid    A and resid 8    and name  HB# )
      3.560     1.760     1.760

 assi 
   (  segid    A and resid 5    and name  HB# )
   (  segid    A and resid 9    and name  HG2#)
      2.965     1.165     1.165

 assi 
   (( segid    A and resid 19   and name  HN  ))
   (  segid    A and resid 23   and name  HD# )
      3.735     1.935     1.935

 assi 
   (( segid    A and resid 21   and name  HN  ))
   (  segid    A and resid 23   and name  HD# )
      3.860     2.060     2.060

 assi 
   (  segid    A and resid 6    and name  HG2#)
   (( segid    A and resid 7    and name  HB1 ))
      3.355     1.555     1.555

 assi 
   (( segid    A and resid 9    and name  HB  ))
   (( segid    A and resid 12   and name  HB1 ))
      3.455     1.655     1.655

 assi 
   (( segid    A and resid 12   and name  HB1 ))
   (( segid    A and resid 13   and name  HA  ))
      3.725     1.925     1.925

 assi 
   (( segid    A and resid 7    and name  HA  ))
   (( segid    A and resid 10   and name  HB2 ))
      3.230     1.430     1.430

 assi 
   (( segid    A and resid 14   and name  HA  ))
   (( segid    A and resid 17   and name  HB  ))
      3.275     1.475     1.475

 assi 
   (( segid    A and resid 9    and name  HA  ))
   (  segid    A and resid 9    and name  HG2#)
      2.820     1.020     1.020

 assi 
   (( segid    A and resid 10   and name  HA  ))
   (  segid    A and resid 13   and name  HB# )
      2.710     0.910     0.910

 assi 
   (  segid    A and resid 12   and name  HD2#)
   (  segid    A and resid 15   and name  HD# )
      2.830     1.030     1.030

 assi 
   (  segid    A and resid 12   and name  HD2#)
   (  segid    A and resid 15   and name  HE# )
      3.170     1.370     1.370

 assi 
   (  segid    A and resid 15   and name  HE# )
   (  segid    A and resid 16   and name  HD2#)
      2.880     1.080     1.080

 assi 
   (  segid    A and resid 15   and name  HD# )
   (  segid    A and resid 16   and name  HD2#)
      2.810     1.010     1.010

 assi 
   (( segid    A and resid 5    and name  HN  ))
   (( segid    A and resid 6    and name  HA  ))
      3.490     1.690     1.690

 assi 
   (( segid    A and resid 30   and name  HN  ))
   (( segid    A and resid 30   and name  HB  ))
      2.830     1.030     1.030

 assi 
   (( segid    A and resid 14   and name  HA  ))
   (  segid    A and resid 17   and name  HG1#)
      2.990     1.190     1.190

 assi 
   (  segid    A and resid 17   and name  HG1#)
   (( segid    A and resid 19   and name  HA  ))
      3.310     1.510     1.510

 assi 
   (( segid    A and resid 36   and name  HN  ))
   (( segid    A and resid 37   and name  HN  ))
      2.970     1.170     1.170

 assi 
   (( segid    A and resid 22   and name  HA  ))
   (  segid    A and resid 26   and name  HD1#)
      3.495     1.695     1.695

 assi 
   (( segid    A and resid 28   and name  HN  ))
   (( segid    A and resid 28   and name  HB2 ))
      2.960     1.160     1.160

 assi 
   (( segid    A and resid 19   and name  HB2 ))
   (  segid    A and resid 23   and name  HE# )
      3.365     1.565     1.565

 assi 
   (( segid    A and resid 19   and name  HB1 ))
   (  segid    A and resid 23   and name  HE# )
      3.420     1.620     1.620

 assi 
   (  segid    A and resid 8    and name  HB# )
   (( segid    A and resid 10   and name  HN  ))
      3.230     1.430     1.430

 assi 
   (( segid    A and resid 12   and name  HB2 ))
   (( segid    A and resid 13   and name  HA  ))
      3.040     1.240     1.240

 assi 
   (  segid    A and resid 9    and name  HG2#)
   (  segid    A and resid 12   and name  HD2#)
      3.700     1.900     1.900

 assi 
   (  segid    A and resid 4    and name  HG2#)
   (  segid    A and resid 8    and name  HB# )
      3.150     1.350     1.350

 assi 
   (  segid    A and resid 1    and name  HB# )
   (  segid    A and resid 1    and name  HE# )
      3.095     1.295     1.295

 assi 
   (( segid    A and resid 24   and name  HA1 ))
   (  segid    A and resid 25   and name  HB# )
      3.250     1.450     1.450

 assi 
   (( segid    A and resid 4    and name  HA  ))
   (( segid    A and resid 6    and name  HN  ))
      3.145     1.345     1.345

 assi 
   (( segid    A and resid 22   and name  HN  ))
   (( segid    A and resid 23   and name  HN  ))
      2.700     0.900     0.900

 assi 
   (  segid    A and resid 8    and name  HB# )
   (  segid    A and resid 12   and name  HD2#)
      3.745     1.945     1.945

 assi 
   (  segid    A and resid 25   and name  HB# )
   (( segid    A and resid 26   and name  HA  ))
      3.190     1.390     1.390

 assi 
   (( segid    A and resid 7    and name  HA  ))
   (  segid    A and resid 8    and name  HB# )
      3.500     1.700     1.700

 assi 
   (  segid    A and resid 31   and name  HB# )
   (( segid    A and resid 32   and name  HN  ))
      3.300     1.500     1.500

 assi 
   (  segid    A and resid 30   and name  HG2#)
   (( segid    A and resid 31   and name  HD21))
      3.455     1.655     1.655

 assi 
   (  segid    A and resid 12   and name  HD2#)
   (( segid    A and resid 15   and name  HB2 ))
      3.305     1.505     1.505

 assi 
   (  segid    A and resid 1    and name  HB# )
   (( segid    A and resid 2    and name  HN  ))
      3.450     1.650     1.650

 assi 
   (( segid    A and resid 11   and name  HN  ))
   (( segid    A and resid 12   and name  HN  ))
      2.965     1.165     1.165

 assi 
   (( segid    A and resid 13   and name  HA  ))
   (( segid    A and resid 14   and name  HD21))
      3.195     1.395     1.395

 assi 
   (( segid    A and resid 3    and name  HN  ))
   (( segid    A and resid 4    and name  HA  ))
      3.395     1.595     1.595

 assi 
   (( segid    A and resid 5    and name  HN  ))
   (  segid    A and resid 8    and name  HB# )
      3.250     1.450     1.450

 assi 
   (( segid    A and resid 20   and name  HA  ))
   (( segid    A and resid 23   and name  HN  ))
      3.235     1.435     1.435

 assi 
   (( segid    A and resid 12   and name  HA  ))
   (( segid    A and resid 15   and name  HB1 ))
      3.110     1.310     1.310

 assi 
   (( segid    A and resid 12   and name  HA  ))
   (( segid    A and resid 15   and name  HB2 ))
      3.300     1.500     1.500

 assi 
   (( segid    A and resid 36   and name  HB  ))
   (( segid    A and resid 37   and name  HN  ))
      3.155     1.355     1.355

 assi 
   (( segid    A and resid 4    and name  HB  ))
   (( segid    A and resid 5    and name  HN  ))
      2.810     1.010     1.010

 assi 
   (( segid    A and resid 4    and name  HB  ))
   (( segid    A and resid 6    and name  HB  ))
      3.605     1.805     1.805

 assi 
   (( segid    A and resid 13   and name  HA  ))
   (( segid    A and resid 14   and name  HA  ))
      3.750     1.950     1.950

 assi 
   (( segid    A and resid 19   and name  HA  ))
   (  segid    A and resid 23   and name  HE# )
      3.735     1.935     1.935

 assi 
   (( segid    A and resid 20   and name  HA  ))
   (  segid    A and resid 23   and name  HE# )
      3.900     2.100     2.100

 assi 
   (( segid    A and resid 5    and name  HN  ))
   (  segid    A and resid 6    and name  HG2#)
      3.850     2.050     2.050

 assi 
   (( segid    A and resid 7    and name  HA  ))
   (( segid    A and resid 10   and name  HB1 ))
      3.300     1.500     1.500

 assi 
   (( segid    A and resid 26   and name  HG12))
   (( segid    A and resid 27   and name  HA  ))
      3.180     1.380     1.380

 assi 
   (( segid    A and resid 8    and name  HA  ))
   (( segid    A and resid 11   and name  HG2 ))
      3.300     1.500     1.500

 assi 
   (( segid    A and resid 16   and name  HN  ))
   (( segid    A and resid 17   and name  HN  ))
      3.080     1.280     1.280

 assi 
   (( segid    A and resid 35   and name  HB2 ))
   (( segid    A and resid 36   and name  HN  ))
      3.320     1.520     1.520

 assi 
   (( segid    A and resid 22   and name  HB2 ))
   (( segid    A and resid 23   and name  HN  ))
      3.320     1.520     1.520

 assi 
   (( segid    A and resid 2    and name  HB1 ))
   (( segid    A and resid 4    and name  HN  ))
      3.325     1.525     1.525

 assi 
   (  segid    A and resid 17   and name  HG2#)
   (( segid    A and resid 18   and name  HB1 ))
      3.395     1.595     1.595

 assi 
   (( segid    A and resid 13   and name  HA  ))
   (( segid    A and resid 15   and name  HN  ))
      3.545     1.745     1.745

 assi 
   (( segid    A and resid 13   and name  HA  ))
   (( segid    A and resid 16   and name  HN  ))
      3.695     1.895     1.895

 assi 
   (( segid    A and resid 18   and name  HN  ))
   (( segid    A and resid 18   and name  HD2 ))
      3.215     1.415     1.415

 assi 
   (( segid    A and resid 5    and name  HN  ))
   (( segid    A and resid 7    and name  HN  ))
      3.460     1.660     1.660

 assi 
   (( segid    A and resid 4    and name  HA  ))
   (( segid    A and resid 5    and name  HA  ))
      3.090     1.290     1.290

 assi 
   (( segid    A and resid 6    and name  HA  ))
   (( segid    A and resid 7    and name  HB1 ))
      3.835     2.035     2.035

 assi 
   (( segid    A and resid 7    and name  HB1 ))
   (( segid    A and resid 8    and name  HA  ))
      3.900     2.100     2.100

 assi 
   (  segid    A and resid 6    and name  HG2#)
   (( segid    A and resid 7    and name  HB2 ))
      3.850     2.050     2.050

 assi 
   (( segid    A and resid 7    and name  HB1 ))
   (  segid    A and resid 8    and name  HB# )
      3.585     1.785     1.785

 assi 
   (( segid    A and resid 24   and name  HA1 ))
   (( segid    A and resid 25   and name  HA  ))
      3.170     1.370     1.370

 assi 
   (( segid    A and resid 24   and name  HA2 ))
   (( segid    A and resid 25   and name  HA  ))
      3.325     1.525     1.525

 assi 
   (( segid    A and resid 10   and name  HG1 ))
   (( segid    A and resid 11   and name  HN  ))
      3.420     1.620     1.620

 assi 
   (( segid    A and resid 22   and name  HD21))
   (  segid    A and resid 25   and name  HB# )
      3.170     1.370     1.370

 assi 
   (( segid    A and resid 10   and name  HA  ))
   (( segid    A and resid 14   and name  HD22))
      3.335     1.535     1.535

 assi 
   (  segid    A and resid 9    and name  HG2#)
   (  segid    A and resid 12   and name  HD1#)
      2.990     1.190     1.190

 assi 
   (( segid    A and resid 21   and name  HA  ))
   (( segid    A and resid 21   and name  HD21))
      3.105     1.305     1.305

 assi 
   (  segid    A and resid 12   and name  HD2#)
   (( segid    A and resid 15   and name  HN  ))
      3.665     1.865     1.865

 assi 
   (( segid    A and resid 16   and name  HN  ))
   (  segid    A and resid 17   and name  HG2#)
      3.900     2.100     2.100

 assi 
   (( segid    A and resid 37   and name  HA  ))
   (  segid    A and resid 37   and name  HE# )
      3.245     1.445     1.445

 assi 
   (( segid    A and resid 31   and name  HA  ))
   (( segid    A and resid 31   and name  HD22))
      3.305     1.505     1.505

 assi 
   (( segid    A and resid 33   and name  HN  ))
   (( segid    A and resid 34   and name  HB2 ))
      3.580     1.780     1.780

 assi 
   (( segid    A and resid 34   and name  HB2 ))
   (( segid    A and resid 35   and name  HN  ))
      3.675     1.875     1.875

 assi 
   (( segid    A and resid 18   and name  HA  ))
   (( segid    A and resid 20   and name  HN  ))
      3.575     1.775     1.775

 assi 
   (( segid    A and resid 20   and name  HN  ))
   (( segid    A and resid 21   and name  HA  ))
      3.560     1.760     1.760

 assi 
   (( segid    A and resid 20   and name  HN  ))
   (( segid    A and resid 21   and name  HN  ))
      2.875     1.075     1.075

 assi 
   (( segid    A and resid 20   and name  HN  ))
   (( segid    A and resid 22   and name  HN  ))
      3.205     1.405     1.405

 assi 
   (( segid    A and resid 19   and name  HB2 ))
   (( segid    A and resid 20   and name  HN  ))
      3.225     1.425     1.425

 assi 
   (( segid    A and resid 29   and name  HB2 ))
   (( segid    A and resid 30   and name  HN  ))
      3.250     1.450     1.450

 assi 
   (( segid    A and resid 19   and name  HA  ))
   (( segid    A and resid 21   and name  HB2 ))
      3.330     1.530     1.530

 assi 
   (( segid    A and resid 16   and name  HA  ))
   (( segid    A and resid 19   and name  HB2 ))
      3.245     1.445     1.445

 assi 
   (( segid    A and resid 16   and name  HA  ))
   (( segid    A and resid 19   and name  HB1 ))
      3.380     1.580     1.580

 assi 
   (( segid    A and resid 21   and name  HA  ))
   (( segid    A and resid 21   and name  HD22))
      3.250     1.450     1.450

 assi 
   (( segid    A and resid 31   and name  HN  ))
   (( segid    A and resid 31   and name  HD22))
      3.740     1.940     1.940

 assi 
   (( segid    A and resid 22   and name  HN  ))
   (  segid    A and resid 23   and name  HE# )
      3.635     1.835     1.835

 assi 
   (( segid    A and resid 27   and name  HN  ))
   (( segid    A and resid 27   and name  HG  ))
      3.255     1.455     1.455

 assi 
   (( segid    A and resid 13   and name  HA  ))
   (  segid    A and resid 16   and name  HD1#)
      3.115     1.315     1.315

 assi 
   (( segid    A and resid 13   and name  HA  ))
   (  segid    A and resid 16   and name  HD2#)
      2.940     1.140     1.140

 assi 
   (  segid    A and resid 8    and name  HB# )
   (  segid    A and resid 9    and name  HG2#)
      3.020     1.220     1.220

 assi 
   (( segid    A and resid 37   and name  HN  ))
   (( segid    A and resid 37   and name  HT21))
      3.025     1.225     1.225

 assi 
   (( segid    A and resid 37   and name  HB1 ))
   (( segid    A and resid 37   and name  HT21))
      3.405     1.605     1.605

 assi 
   (( segid    A and resid 37   and name  HB2 ))
   (( segid    A and resid 37   and name  HT21))
      3.365     1.565     1.565

 assi 
   (( segid    A and resid 37   and name  HB2 ))
   (( segid    A and resid 37   and name  HT22))
      3.450     1.650     1.650
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   LYS   1           HT1      LYS   1  11.588   6.758   9.951
    2    H2   LYS   1           HT2      LYS   1  12.183   5.271   9.474
    3    H3   LYS   1           HT3      LYS   1  10.735   5.332  10.328
    4    HA   LYS   1           HA       LYS   1  10.380   4.913   7.994
    5    HB2  LYS   1           HB2      LYS   1   9.651   7.768   8.723
    6    HB3  LYS   1           HB1      LYS   1   8.941   6.843   7.420
    7    HG2  LYS   1           HG2      LYS   1   7.994   5.283   9.068
    8    HG3  LYS   1           HG1      LYS   1   8.686   6.264  10.362
    9    HD2  LYS   1           HD2      LYS   1   7.388   8.194   9.614
   10    HD3  LYS   1           HD1      LYS   1   6.716   7.240   8.295
   11    HE2  LYS   1           HE2      LYS   1   5.670   5.736   9.931
   12    HE3  LYS   1           HE1      LYS   1   6.339   6.709  11.238
   13    HZ1  LYS   1           HZ1      LYS   1   4.482   7.753   9.178
   14    HZ2  LYS   1           HZ2      LYS   1   5.004   8.564  10.562
   15    HZ3  LYS   1           HZ3      LYS   1   3.997   7.228  10.693
   16    H    CYS   2           HN       CYS   2  10.494   5.896   5.792
   17    HA   CYS   2           HA       CYS   2  12.496   7.928   5.458
   18    HB2  CYS   2           HB2      CYS   2  13.535   6.506   3.617
   19    HB3  CYS   2           HB1      CYS   2  13.931   6.059   5.282
   20    H    ASN   3           HN       ASN   3  12.543   8.681   3.153
   21    HA   ASN   3           HA       ASN   3  10.042   8.226   1.730
   22    HB2  ASN   3           HB2      ASN   3   9.585   9.966   3.481
   23    HB3  ASN   3           HB1      ASN   3  10.833  10.970   2.772
   24   HD21  ASN   3          HD21      ASN   3  10.321  12.193   1.016
   25   HD22  ASN   3          HD22      ASN   3   8.755  12.277   0.301
   26    H    THR   4           HN       THR   4  13.053   7.992   1.370
   27    HA   THR   4           HA       THR   4  13.379   9.794  -0.908
   28    HB   THR   4           HB       THR   4  15.289   9.761   0.665
   29    HG1  THR   4           HG1      THR   4  16.305  10.104  -1.117
   30   HG21  THR   4          HG21      THR   4  16.673   7.764   0.954
   31   HG22  THR   4          HG22      THR   4  15.548   6.839  -0.044
   32   HG23  THR   4          HG23      THR   4  15.027   7.460   1.518
   33    H    ALA   5           HN       ALA   5  14.360   8.833  -2.838
   34    HA   ALA   5           HA       ALA   5  12.674   6.816  -3.882
   35    HB1  ALA   5           HB1      ALA   5  13.984   7.030  -5.927
   36    HB2  ALA   5           HB2      ALA   5  15.219   7.936  -5.050
   37    HB3  ALA   5           HB3      ALA   5  13.606   8.617  -5.257
   38    H    THR   6           HN       THR   6  15.641   6.698  -2.271
   39    HA   THR   6           HA       THR   6  16.397   4.091  -3.244
   40    HB   THR   6           HB       THR   6  17.444   5.788  -0.977
   41    HG1  THR   6           HG1      THR   6  18.375   5.470  -3.644
   42   HG21  THR   6          HG21      THR   6  18.076   3.480  -0.738
   43   HG22  THR   6          HG22      THR   6  19.489   4.434  -1.208
   44   HG23  THR   6          HG23      THR   6  18.661   3.414  -2.401
   45    H    CYS   7           HN       CYS   7  14.122   5.179  -0.964
   46    HA   CYS   7           HA       CYS   7  14.509   2.753   0.667
   47    HB2  CYS   7           HB2      CYS   7  15.343   4.968   1.530
   48    HB3  CYS   7           HB1      CYS   7  13.699   5.350   1.756
   49    H    ALA   8           HN       ALA   8  12.278   5.380  -0.247
   50    HA   ALA   8           HA       ALA   8  10.028   4.277   0.966
   51    HB1  ALA   8           HB1      ALA   8  10.227   6.085  -1.446
   52    HB2  ALA   8           HB2      ALA   8  10.132   6.597   0.241
   53    HB3  ALA   8           HB3      ALA   8   8.761   5.778  -0.512
   54    H    THR   9           HN       THR   9  11.753   3.674  -1.891
   55    HA   THR   9           HA       THR   9   9.773   2.253  -3.371
   56    HB   THR   9           HB       THR   9  11.843   1.327  -4.525
   57    HG1  THR   9           HG1      THR   9  13.554   3.145  -3.847
   58   HG21  THR   9          HG21      THR   9  10.506   3.223  -5.368
   59   HG22  THR   9          HG22      THR   9  12.232   3.472  -5.658
   60   HG23  THR   9          HG23      THR   9  11.434   4.313  -4.330
   61    H    GLN  10           HN       GLN  10  12.003   1.468  -0.965
   62    HA   GLN  10           HA       GLN  10  11.836  -1.394  -1.151
   63    HB2  GLN  10           HB2      GLN  10  12.670   0.207   1.271
   64    HB3  GLN  10           HB1      GLN  10  13.103  -1.469   0.919
   65    HG2  GLN  10           HG2      GLN  10  14.084   1.067  -0.344
   66    HG3  GLN  10           HG1      GLN  10  15.013  -0.122   0.557
   67   HE21  GLN  10          HE21      GLN  10  15.412   1.016  -1.986
   68   HE22  GLN  10          HE22      GLN  10  15.505  -0.270  -3.147
   69    H    ARG  11           HN       ARG  11  10.399   1.171   0.658
   70    HA   ARG  11           HA       ARG  11   8.715  -0.394   2.395
   71    HB2  ARG  11           HB2      ARG  11   7.996   2.345   1.341
   72    HB3  ARG  11           HB1      ARG  11   7.542   1.622   2.872
   73    HG2  ARG  11           HG2      ARG  11  10.297   2.586   2.112
   74    HG3  ARG  11           HG1      ARG  11   9.169   3.411   3.187
   75    HD2  ARG  11           HD2      ARG  11  10.421   0.711   3.641
   76    HD3  ARG  11           HD1      ARG  11  10.931   2.225   4.387
   77    HE   ARG  11           HE       ARG  11   8.254   1.933   4.939
   78   HH11  ARG  11          HH11      ARG  11  11.275   0.264   5.704
   79   HH12  ARG  11          HH12      ARG  11  10.711  -0.388   7.170
   80   HH21  ARG  11          HH21      ARG  11   7.493   1.071   6.981
   81   HH22  ARG  11          HH22      ARG  11   8.509   0.065   7.908
   82    H    LEU  12           HN       LEU  12   8.334   1.010  -0.784
   83    HA   LEU  12           HA       LEU  12   5.749   0.198  -1.372
   84    HB2  LEU  12           HB2      LEU  12   8.227   0.690  -2.879
   85    HB3  LEU  12           HB1      LEU  12   6.883   0.180  -3.781
   86    HG   LEU  12           HG       LEU  12   7.156   2.747  -2.191
   87   HD11  LEU  12          HD11      LEU  12   6.692   2.243  -5.124
   88   HD12  LEU  12          HD12      LEU  12   8.219   2.747  -4.407
   89   HD13  LEU  12          HD13      LEU  12   6.823   3.819  -4.357
   90   HD21  LEU  12          HD21      LEU  12   4.880   1.941  -1.882
   91   HD22  LEU  12          HD22      LEU  12   4.724   1.682  -3.615
   92   HD23  LEU  12          HD23      LEU  12   4.893   3.319  -2.982
   93    H    ALA  13           HN       ALA  13   8.863  -1.408  -1.673
   94    HA   ALA  13           HA       ALA  13   7.950  -3.645  -3.019
   95    HB1  ALA  13           HB1      ALA  13  10.320  -3.067  -2.903
   96    HB2  ALA  13           HB2      ALA  13  10.055  -4.726  -2.366
   97    HB3  ALA  13           HB3      ALA  13  10.336  -3.448  -1.182
   98    H    ASN  14           HN       ASN  14   8.079  -2.809   0.343
   99    HA   ASN  14           HA       ASN  14   7.348  -5.443   1.319
  100    HB2  ASN  14           HB2      ASN  14   7.420  -2.783   2.715
  101    HB3  ASN  14           HB1      ASN  14   6.958  -4.310   3.469
  102   HD21  ASN  14          HD21      ASN  14   9.512  -4.194   1.147
  103   HD22  ASN  14          HD22      ASN  14  10.824  -4.388   2.245
  104    H    PHE  15           HN       PHE  15   5.630  -2.969  -0.160
  105    HA   PHE  15           HA       PHE  15   3.257  -3.351   1.422
  106    HB2  PHE  15           HB2      PHE  15   3.083  -1.175   0.833
  107    HB3  PHE  15           HB1      PHE  15   4.381  -1.354  -0.341
  108    HD1  PHE  15           HD1      PHE  15   3.883  -1.600  -2.674
  109    HD2  PHE  15           HD2      PHE  15   0.729  -1.463   0.179
  110    HE1  PHE  15           HE1      PHE  15   2.299  -1.309  -4.473
  111    HE2  PHE  15           HE2      PHE  15  -0.897  -1.160  -1.642
  112    HZ   PHE  15           HZ       PHE  15  -0.121  -1.081  -3.979
  113    H    LEU  16           HN       LEU  16   4.836  -4.366  -1.425
  114    HA   LEU  16           HA       LEU  16   2.417  -5.723  -2.262
  115    HB2  LEU  16           HB2      LEU  16   2.583  -4.750  -4.174
  116    HB3  LEU  16           HB1      LEU  16   3.713  -3.736  -3.443
  117    HG   LEU  16           HG       LEU  16   4.713  -6.155  -4.929
  118   HD11  LEU  16          HD11      LEU  16   3.423  -4.780  -6.463
  119   HD12  LEU  16          HD12      LEU  16   5.154  -4.590  -6.776
  120   HD13  LEU  16          HD13      LEU  16   4.267  -3.340  -5.899
  121   HD21  LEU  16          HD21      LEU  16   6.231  -5.085  -3.333
  122   HD22  LEU  16          HD22      LEU  16   5.931  -3.537  -4.128
  123   HD23  LEU  16          HD23      LEU  16   6.758  -4.835  -5.004
  124    H    VAL  17           HN       VAL  17   4.930  -6.399  -0.670
  125    HA   VAL  17           HA       VAL  17   6.307  -8.447  -2.068
  126    HB   VAL  17           HB       VAL  17   7.252  -7.157  -0.196
  127   HG11  VAL  17          HG11      VAL  17   6.658  -7.748   2.148
  128   HG12  VAL  17          HG12      VAL  17   5.233  -8.589   1.478
  129   HG13  VAL  17          HG13      VAL  17   5.426  -6.874   1.236
  130   HG21  VAL  17          HG21      VAL  17   7.154 -10.115   0.301
  131   HG22  VAL  17          HG22      VAL  17   8.265  -8.964   1.060
  132   HG23  VAL  17          HG23      VAL  17   8.327  -9.217  -0.689
  133    H    HIS  18           HN       HIS  18   3.648  -8.331   0.100
  134    HA   HIS  18           HA       HIS  18   2.781 -11.014  -0.611
  135    HB2  HIS  18           HB2      HIS  18   3.156 -10.142   2.274
  136    HB3  HIS  18           HB1      HIS  18   2.206 -11.538   1.795
  137    HD1  HIS  18           HD1      HIS  18   3.477 -13.684   1.245
  138    HD2  HIS  18           HD2      HIS  18   5.939 -10.439   2.005
  139    HE1  HIS  18           HE1      HIS  18   5.784 -14.643   1.516
  140    HE2  HIS  18           HE2      HIS  18   7.265 -12.620   1.645
  141    H    SER  19           HN       SER  19   2.250  -8.051   1.145
  142    HA   SER  19           HA       SER  19   0.651  -6.484   0.964
  143    HB2  SER  19           HB2      SER  19  -0.332  -8.308  -1.156
  144    HB3  SER  19           HB1      SER  19  -1.007  -6.684  -0.772
  145    HG   SER  19           HG       SER  19   1.128  -5.933  -1.148
  146    H    SER  20           HN       SER  20   0.418  -9.029   2.400
  147    HA   SER  20           HA       SER  20  -2.238  -9.847   2.720
  148    HB2  SER  20           HB2      SER  20   0.007 -10.095   4.701
  149    HB3  SER  20           HB1      SER  20  -1.434 -11.113   4.581
  150    HG   SER  20           HG       SER  20  -0.714 -11.535   2.375
  151    H    ASN  21           HN       ASN  21  -0.944  -6.967   3.704
  152    HA   ASN  21           HA       ASN  21  -2.959  -6.681   5.795
  153    HB2  ASN  21           HB2      ASN  21  -0.148  -5.830   5.608
  154    HB3  ASN  21           HB1      ASN  21  -1.245  -4.880   6.645
  155   HD21  ASN  21          HD21      ASN  21   0.692  -7.702   6.256
  156   HD22  ASN  21          HD22      ASN  21   0.342  -8.411   7.785
  157    H    ASN  22           HN       ASN  22  -2.356  -5.888   2.667
  158    HA   ASN  22           HA       ASN  22  -3.335  -3.157   2.943
  159    HB2  ASN  22           HB2      ASN  22  -0.810  -4.067   1.912
  160    HB3  ASN  22           HB1      ASN  22  -1.824  -3.071   0.852
  161   HD21  ASN  22          HD21      ASN  22  -2.112  -2.817   4.264
  162   HD22  ASN  22          HD22      ASN  22  -1.367  -1.311   4.476
  163    H    PHE  23           HN       PHE  23  -2.801  -5.888   0.971
  164    HA   PHE  23           HA       PHE  23  -3.662  -5.176  -1.460
  165    HB2  PHE  23           HB2      PHE  23  -4.138  -7.594  -1.816
  166    HB3  PHE  23           HB1      PHE  23  -2.612  -7.255  -1.029
  167    HD1  PHE  23           HD1      PHE  23  -3.172  -9.807  -0.997
  168    HD2  PHE  23           HD2      PHE  23  -4.740  -6.808   1.464
  169    HE1  PHE  23           HE1      PHE  23  -3.551 -11.479   0.679
  170    HE2  PHE  23           HE2      PHE  23  -5.213  -8.458   3.229
  171    HZ   PHE  23           HZ       PHE  23  -4.627 -10.853   2.849
  172    H    GLY  24           HN       GLY  24  -5.162  -3.899  -1.573
  173    HA2  GLY  24           HA2      GLY  24  -7.237  -2.906  -1.616
  174    HA3  GLY  24           HA1      GLY  24  -7.923  -4.463  -1.908
  175    H    ALA  25           HN       ALA  25  -6.133  -3.408   0.847
  176    HA   ALA  25           HA       ALA  25  -8.455  -3.760   2.557
  177    HB1  ALA  25           HB1      ALA  25  -6.763  -3.799   4.360
  178    HB2  ALA  25           HB2      ALA  25  -5.520  -3.501   3.145
  179    HB3  ALA  25           HB3      ALA  25  -6.419  -5.022   3.119
  180    H    ILE  26           HN       ILE  26  -5.950  -1.729   1.441
  181    HA   ILE  26           HA       ILE  26  -7.181   0.493   2.740
  182    HB   ILE  26           HB       ILE  26  -5.005   0.222   3.598
  183   HG12  ILE  26          HG12      ILE  26  -4.828   2.151   1.382
  184   HG13  ILE  26          HG11      ILE  26  -5.599   2.547   2.919
  185   HG21  ILE  26          HG21      ILE  26  -4.066  -0.075   0.762
  186   HG22  ILE  26          HG22      ILE  26  -4.102  -1.332   1.995
  187   HG23  ILE  26          HG23      ILE  26  -2.987   0.028   2.155
  188   HD11  ILE  26          HD11      ILE  26  -3.369   3.534   2.865
  189   HD12  ILE  26          HD12      ILE  26  -2.659   1.974   2.448
  190   HD13  ILE  26          HD13      ILE  26  -3.383   2.218   4.038
  191    H    LEU  27           HN       LEU  27  -5.846  -0.795  -0.328
  192    HA   LEU  27           HA       LEU  27  -5.895   1.732  -1.577
  193    HB2  LEU  27           HB2      LEU  27  -5.093   0.506  -3.457
  194    HB3  LEU  27           HB1      LEU  27  -4.141   0.361  -1.999
  195    HG   LEU  27           HG       LEU  27  -5.492  -1.909  -1.802
  196   HD11  LEU  27          HD11      LEU  27  -5.826  -2.975  -3.971
  197   HD12  LEU  27          HD12      LEU  27  -5.444  -1.456  -4.782
  198   HD13  LEU  27          HD13      LEU  27  -6.881  -1.578  -3.762
  199   HD21  LEU  27          HD21      LEU  27  -3.666  -3.041  -2.895
  200   HD22  LEU  27          HD22      LEU  27  -3.096  -1.717  -1.867
  201   HD23  LEU  27          HD23      LEU  27  -3.154  -1.520  -3.627
  202    H    SER  28           HN       SER  28  -8.005  -1.014  -1.393
  203    HA   SER  28           HA       SER  28  -8.910  -0.416  -3.827
  204    HB2  SER  28           HB2      SER  28 -10.179  -2.136  -1.722
  205    HB3  SER  28           HB1      SER  28 -10.911  -1.946  -3.319
  206    HG   SER  28           HG       SER  28  -8.962  -2.626  -4.219
  207    H    SER  29           HN       SER  29  -9.611   0.801  -0.774
  208    HA   SER  29           HA       SER  29 -10.693   2.560   0.084
  209    HB2  SER  29           HB2      SER  29 -11.198   3.309  -2.789
  210    HB3  SER  29           HB1      SER  29 -11.362   4.398  -1.406
  211    HG   SER  29           HG       SER  29  -9.110   3.495  -2.700
  212    H    THR  30           HN       THR  30 -12.548   0.767  -2.122
  213    HA   THR  30           HA       THR  30 -15.161   1.597  -1.357
  214    HB   THR  30           HB       THR  30 -14.676   0.498  -3.496
  215    HG1  THR  30           HG1      THR  30 -16.425  -0.804  -1.690
  216   HG21  THR  30          HG21      THR  30 -14.062  -1.920  -3.550
  217   HG22  THR  30          HG22      THR  30 -13.949  -1.882  -1.775
  218   HG23  THR  30          HG23      THR  30 -12.853  -0.921  -2.726
  219    H    ASN  31           HN       ASN  31 -12.862   0.079   0.512
  220    HA   ASN  31           HA       ASN  31 -14.746  -1.800   1.776
  221    HB2  ASN  31           HB2      ASN  31 -12.963  -3.345   1.992
  222    HB3  ASN  31           HB1      ASN  31 -13.004  -2.843   0.300
  223   HD21  ASN  31          HD21      ASN  31 -11.334  -2.828   3.196
  224   HD22  ASN  31          HD22      ASN  31  -9.889  -2.058   2.683
  225    H    VAL  32           HN       VAL  32 -13.292   1.028   2.159
  226    HA   VAL  32           HA       VAL  32 -12.353   0.507   4.889
  227    HB   VAL  32           HB       VAL  32 -11.187   2.565   4.741
  228   HG11  VAL  32          HG11      VAL  32 -10.009   0.558   4.017
  229   HG12  VAL  32          HG12      VAL  32  -9.449   1.938   3.070
  230   HG13  VAL  32          HG13      VAL  32 -10.590   0.790   2.368
  231   HG21  VAL  32          HG21      VAL  32 -10.914   3.822   2.618
  232   HG22  VAL  32          HG22      VAL  32 -12.567   3.847   3.242
  233   HG23  VAL  32          HG23      VAL  32 -12.148   2.788   1.898
  234    H    GLY  33           HN       GLY  33 -15.045   0.773   4.111
  235    HA2  GLY  33           HA2      GLY  33 -16.870   1.755   5.300
  236    HA3  GLY  33           HA1      GLY  33 -15.853   3.165   5.610
  237    H    SER  34           HN       SER  34 -15.844   1.721   2.559
  238    HA   SER  34           HA       SER  34 -16.181   2.472   0.477
  239    HB2  SER  34           HB2      SER  34 -18.799   3.457   1.636
  240    HB3  SER  34           HB1      SER  34 -18.472   3.120  -0.066
  241    HG   SER  34           HG       SER  34 -18.606   1.327   2.104
  242    H    ASN  35           HN       ASN  35 -14.409   3.952   0.751
  243    HA   ASN  35           HA       ASN  35 -15.260   6.750   0.588
  244    HB2  ASN  35           HB2      ASN  35 -14.371   6.193   2.859
  245    HB3  ASN  35           HB1      ASN  35 -12.862   5.721   2.103
  246   HD21  ASN  35          HD21      ASN  35 -13.080   7.623   4.069
  247   HD22  ASN  35          HD22      ASN  35 -12.574   9.154   3.457
  248    H    THR  36           HN       THR  36 -14.962   6.554  -1.691
  249    HA   THR  36           HA       THR  36 -12.227   6.132  -2.636
  250    HB   THR  36           HB       THR  36 -13.532   6.296  -4.874
  251    HG1  THR  36           HG1      THR  36 -15.763   5.273  -3.814
  252   HG21  THR  36          HG21      THR  36 -14.191   3.907  -4.729
  253   HG22  THR  36          HG22      THR  36 -13.953   3.976  -2.978
  254   HG23  THR  36          HG23      THR  36 -12.586   4.210  -4.067
  255    H    TYC  37           HN       TYC  37 -13.206   8.473  -1.171
  256    HA   TYC  37           HA       TYC  37 -13.532  10.524  -3.210
  257    HB1  TYC  37           HB1      TYC  37 -14.307  11.933  -1.392
  258    HB2  TYC  37           HB2      TYC  37 -13.862  10.700  -0.216
  259    HD1  TYC  37           HD1      TYC  37 -16.212  11.526  -2.941
  260    HD2  TYC  37           HD2      TYC  37 -15.286   8.843   0.219
  261    HE1  TYC  37           HE1      TYC  37 -18.431  10.500  -3.165
  262    HE2  TYC  37           HE2      TYC  37 -17.505   7.808   0.003
  263    HH   TYC  37           HH       TYC  37 -19.700   8.371  -0.838
  264   HT21  TYC  37          HT21      TYC  37 -11.458  10.771  -3.904
  265   HT22  TYC  37          HT22      TYC  37 -10.179  11.406  -2.929
  Start of MODEL    2
    1    H1   LYS   1           HT1      LYS   1  10.554   5.785  10.425
    2    H2   LYS   1           HT2      LYS   1  11.308   7.168   9.797
    3    H3   LYS   1           HT3      LYS   1  12.060   5.689   9.659
    4    HA   LYS   1           HA       LYS   1  10.414   4.906   8.152
    5    HB2  LYS   1           HB2      LYS   1   9.348   7.744   8.331
    6    HB3  LYS   1           HB1      LYS   1   8.737   6.482   7.285
    7    HG2  LYS   1           HG2      LYS   1   8.568   6.518  10.296
    8    HG3  LYS   1           HG1      LYS   1   7.273   6.932   9.186
    9    HD2  LYS   1           HD2      LYS   1   7.336   4.621   8.311
   10    HD3  LYS   1           HD1      LYS   1   8.569   4.225   9.510
   11    HE2  LYS   1           HE2      LYS   1   7.030   4.887  11.304
   12    HE3  LYS   1           HE1      LYS   1   5.796   5.258  10.110
   13    HZ1  LYS   1           HZ1      LYS   1   5.808   2.889   9.473
   14    HZ2  LYS   1           HZ2      LYS   1   5.397   3.130  11.073
   15    HZ3  LYS   1           HZ3      LYS   1   6.945   2.582  10.696
   16    H    CYS   2           HN       CYS   2  10.391   5.893   5.800
   17    HA   CYS   2           HA       CYS   2  12.434   7.881   5.435
   18    HB2  CYS   2           HB2      CYS   2  13.517   6.402   3.683
   19    HB3  CYS   2           HB1      CYS   2  13.847   5.981   5.371
   20    H    ASN   3           HN       ASN   3  12.455   8.732   3.310
   21    HA   ASN   3           HA       ASN   3  10.035   8.254   1.715
   22    HB2  ASN   3           HB2      ASN   3  10.791  10.904   2.958
   23    HB3  ASN   3           HB1      ASN   3   9.734  10.790   1.564
   24   HD21  ASN   3          HD21      ASN   3  10.059  10.238   4.944
   25   HD22  ASN   3          HD22      ASN   3   8.383   9.991   5.274
   26    H    THR   4           HN       THR   4  13.003   7.945   1.469
   27    HA   THR   4           HA       THR   4  13.462   9.759  -0.768
   28    HB   THR   4           HB       THR   4  15.323   9.642   0.842
   29    HG1  THR   4           HG1      THR   4  16.651   9.727  -0.741
   30   HG21  THR   4          HG21      THR   4  16.586   7.570   1.199
   31   HG22  THR   4          HG22      THR   4  15.440   6.706   0.178
   32   HG23  THR   4          HG23      THR   4  14.908   7.376   1.720
   33    H    ALA   5           HN       ALA   5  14.341   8.850  -2.705
   34    HA   ALA   5           HA       ALA   5  12.677   6.841  -3.793
   35    HB1  ALA   5           HB1      ALA   5  13.973   7.129  -5.836
   36    HB2  ALA   5           HB2      ALA   5  15.204   8.019  -4.935
   37    HB3  ALA   5           HB3      ALA   5  13.586   8.696  -5.119
   38    H    THR   6           HN       THR   6  15.638   6.721  -2.171
   39    HA   THR   6           HA       THR   6  16.477   4.181  -3.203
   40    HB   THR   6           HB       THR   6  17.374   5.781  -0.811
   41    HG1  THR   6           HG1      THR   6  17.677   6.084  -3.481
   42   HG21  THR   6          HG21      THR   6  19.485   4.505  -1.084
   43   HG22  THR   6          HG22      THR   6  18.691   3.516  -2.326
   44   HG23  THR   6          HG23      THR   6  18.087   3.517  -0.659
   45    H    CYS   7           HN       CYS   7  14.166   5.188  -0.864
   46    HA   CYS   7           HA       CYS   7  14.540   2.683   0.692
   47    HB2  CYS   7           HB2      CYS   7  15.232   4.977   1.646
   48    HB3  CYS   7           HB1      CYS   7  13.572   5.207   1.782
   49    H    ALA   8           HN       ALA   8  12.284   5.303  -0.182
   50    HA   ALA   8           HA       ALA   8  10.061   4.108   1.017
   51    HB1  ALA   8           HB1      ALA   8  10.224   6.130  -1.216
   52    HB2  ALA   8           HB2      ALA   8  10.136   6.458   0.520
   53    HB3  ALA   8           HB3      ALA   8   8.762   5.716  -0.307
   54    H    THR   9           HN       THR   9  11.747   3.692  -1.883
   55    HA   THR   9           HA       THR   9   9.755   2.387  -3.447
   56    HB   THR   9           HB       THR   9  11.819   1.501  -4.622
   57    HG1  THR   9           HG1      THR   9  13.658   3.020  -3.913
   58   HG21  THR   9          HG21      THR   9  12.274   3.708  -5.634
   59   HG22  THR   9          HG22      THR   9  11.491   4.489  -4.267
   60   HG23  THR   9          HG23      THR   9  10.539   3.489  -5.372
   61    H    GLN  10           HN       GLN  10  12.006   1.453  -1.095
   62    HA   GLN  10           HA       GLN  10  11.779  -1.402  -1.377
   63    HB2  GLN  10           HB2      GLN  10  12.721   0.111   1.061
   64    HB3  GLN  10           HB1      GLN  10  13.112  -1.552   0.623
   65    HG2  GLN  10           HG2      GLN  10  14.032   0.971  -0.719
   66    HG3  GLN  10           HG1      GLN  10  14.997  -0.129   0.255
   67   HE21  GLN  10          HE21      GLN  10  15.236   0.821  -2.436
   68   HE22  GLN  10          HE22      GLN  10  15.379  -0.574  -3.453
   69    H    ARG  11           HN       ARG  11  10.418   1.138   0.521
   70    HA   ARG  11           HA       ARG  11   8.773  -0.494   2.201
   71    HB2  ARG  11           HB2      ARG  11   8.139   2.338   1.341
   72    HB3  ARG  11           HB1      ARG  11   7.557   1.506   2.774
   73    HG2  ARG  11           HG2      ARG  11  10.361   2.460   2.233
   74    HG3  ARG  11           HG1      ARG  11   9.239   3.087   3.438
   75    HD2  ARG  11           HD2      ARG  11  10.508   0.367   3.363
   76    HD3  ARG  11           HD1      ARG  11  10.922   1.702   4.442
   77    HE   ARG  11           HE       ARG  11   8.488   1.449   5.183
   78   HH11  ARG  11          HH11      ARG  11  10.542  -1.264   4.274
   79   HH12  ARG  11          HH12      ARG  11   9.756  -2.398   5.258
   80   HH21  ARG  11          HH21      ARG  11   7.417  -0.069   6.561
   81   HH22  ARG  11          HH22      ARG  11   7.945  -1.683   6.650
   82    H    LEU  12           HN       LEU  12   8.361   1.001  -0.933
   83    HA   LEU  12           HA       LEU  12   5.773   0.191  -1.505
   84    HB2  LEU  12           HB2      LEU  12   8.238   0.669  -3.033
   85    HB3  LEU  12           HB1      LEU  12   6.882   0.197  -3.929
   86    HG   LEU  12           HG       LEU  12   7.254   2.746  -2.337
   87   HD11  LEU  12          HD11      LEU  12   8.188   2.717  -4.605
   88   HD12  LEU  12          HD12      LEU  12   6.843   3.842  -4.467
   89   HD13  LEU  12          HD13      LEU  12   6.605   2.277  -5.242
   90   HD21  LEU  12          HD21      LEU  12   4.975   2.019  -1.884
   91   HD22  LEU  12          HD22      LEU  12   4.698   1.743  -3.598
   92   HD23  LEU  12          HD23      LEU  12   4.949   3.380  -3.004
   93    H    ALA  13           HN       ALA  13   8.886  -1.420  -1.838
   94    HA   ALA  13           HA       ALA  13   7.949  -3.677  -3.124
   95    HB1  ALA  13           HB1      ALA  13  10.056  -4.769  -2.450
   96    HB2  ALA  13           HB2      ALA  13  10.358  -3.458  -1.313
   97    HB3  ALA  13           HB3      ALA  13  10.332  -3.132  -3.045
   98    H    ASN  14           HN       ASN  14   8.111  -2.778   0.226
   99    HA   ASN  14           HA       ASN  14   7.318  -5.357   1.300
  100    HB2  ASN  14           HB2      ASN  14   7.544  -2.638   2.574
  101    HB3  ASN  14           HB1      ASN  14   6.970  -4.064   3.429
  102   HD21  ASN  14          HD21      ASN  14   9.550  -4.188   1.090
  103   HD22  ASN  14          HD22      ASN  14  10.825  -4.499   2.191
  104    H    PHE  15           HN       PHE  15   5.655  -2.968  -0.333
  105    HA   PHE  15           HA       PHE  15   3.323  -3.031   1.325
  106    HB2  PHE  15           HB2      PHE  15   3.393  -0.889   0.584
  107    HB3  PHE  15           HB1      PHE  15   4.548  -1.303  -0.667
  108    HD1  PHE  15           HD1      PHE  15   3.798  -1.791  -2.915
  109    HD2  PHE  15           HD2      PHE  15   1.007  -0.795   0.143
  110    HE1  PHE  15           HE1      PHE  15   2.121  -1.399  -4.613
  111    HE2  PHE  15           HE2      PHE  15  -0.717  -0.389  -1.570
  112    HZ   PHE  15           HZ       PHE  15  -0.170  -0.685  -3.958
  113    H    LEU  16           HN       LEU  16   4.798  -4.490  -1.382
  114    HA   LEU  16           HA       LEU  16   2.297  -5.805  -1.973
  115    HB2  LEU  16           HB2      LEU  16   2.406  -5.142  -4.004
  116    HB3  LEU  16           HB1      LEU  16   3.466  -3.967  -3.414
  117    HG   LEU  16           HG       LEU  16   4.635  -6.474  -4.624
  118   HD11  LEU  16          HD11      LEU  16   3.195  -5.369  -6.274
  119   HD12  LEU  16          HD12      LEU  16   4.904  -5.198  -6.677
  120   HD13  LEU  16          HD13      LEU  16   4.023  -3.844  -5.961
  121   HD21  LEU  16          HD21      LEU  16   6.097  -5.097  -3.216
  122   HD22  LEU  16          HD22      LEU  16   5.668  -3.686  -4.186
  123   HD23  LEU  16          HD23      LEU  16   6.578  -5.011  -4.917
  124    H    VAL  17           HN       VAL  17   4.756  -6.423  -0.357
  125    HA   VAL  17           HA       VAL  17   6.347  -8.279  -1.776
  126    HB   VAL  17           HB       VAL  17   7.181  -6.950   0.089
  127   HG11  VAL  17          HG11      VAL  17   5.635  -8.755   1.925
  128   HG12  VAL  17          HG12      VAL  17   5.348  -7.067   1.627
  129   HG13  VAL  17          HG13      VAL  17   6.847  -7.569   2.430
  130   HG21  VAL  17          HG21      VAL  17   7.593  -9.917   0.235
  131   HG22  VAL  17          HG22      VAL  17   8.521  -8.770   1.206
  132   HG23  VAL  17          HG23      VAL  17   8.589  -8.691  -0.556
  133    H    HIS  18           HN       HIS  18   4.133  -8.993   0.870
  134    HA   HIS  18           HA       HIS  18   3.689 -11.638  -0.381
  135    HB2  HIS  18           HB2      HIS  18   3.757 -11.027   2.604
  136    HB3  HIS  18           HB1      HIS  18   3.182 -12.535   1.912
  137    HD1  HIS  18           HD1      HIS  18   4.908 -14.317   2.200
  138    HD2  HIS  18           HD2      HIS  18   6.473 -10.577   1.553
  139    HE1  HIS  18           HE1      HIS  18   7.382 -14.648   2.313
  140    HE2  HIS  18           HE2      HIS  18   8.340 -12.336   2.113
  141    H    SER  19           HN       SER  19   2.571  -8.868  -0.274
  142    HA   SER  19           HA       SER  19   0.038  -9.019   0.965
  143    HB2  SER  19           HB2      SER  19   0.963  -7.137  -1.180
  144    HB3  SER  19           HB1      SER  19  -0.256  -6.856   0.062
  145    HG   SER  19           HG       SER  19   1.668  -5.871   0.575
  146    H    SER  20           HN       SER  20   1.246 -10.637  -1.607
  147    HA   SER  20           HA       SER  20  -0.099 -10.260  -3.955
  148    HB2  SER  20           HB2      SER  20   0.530 -12.939  -2.778
  149    HB3  SER  20           HB1      SER  20   0.688 -12.412  -4.463
  150    HG   SER  20           HG       SER  20   2.495 -11.259  -3.955
  151    H    ASN  21           HN       ASN  21  -1.078 -11.811  -1.128
  152    HA   ASN  21           HA       ASN  21  -3.360 -13.276  -2.035
  153    HB2  ASN  21           HB2      ASN  21  -2.220 -12.554   0.576
  154    HB3  ASN  21           HB1      ASN  21  -3.868 -13.215   0.567
  155   HD21  ASN  21          HD21      ASN  21  -1.430 -14.285   1.693
  156   HD22  ASN  21          HD22      ASN  21  -1.162 -15.827   0.968
  157    H    ASN  22           HN       ASN  22  -2.860 -10.034  -1.228
  158    HA   ASN  22           HA       ASN  22  -5.738  -9.540  -1.312
  159    HB2  ASN  22           HB2      ASN  22  -3.588  -8.450   0.400
  160    HB3  ASN  22           HB1      ASN  22  -5.067  -7.515   0.263
  161   HD21  ASN  22          HD21      ASN  22  -6.453 -10.336   0.103
  162   HD22  ASN  22          HD22      ASN  22  -6.495 -10.904   1.695
  163    H    PHE  23           HN       PHE  23  -3.308  -9.621  -3.029
  164    HA   PHE  23           HA       PHE  23  -3.517  -7.020  -4.335
  165    HB2  PHE  23           HB2      PHE  23  -1.471  -8.652  -3.389
  166    HB3  PHE  23           HB1      PHE  23  -1.152  -8.490  -5.074
  167    HD1  PHE  23           HD1      PHE  23  -0.245  -6.317  -5.784
  168    HD2  PHE  23           HD2      PHE  23  -1.956  -6.814  -1.954
  169    HE1  PHE  23           HE1      PHE  23   0.530  -4.070  -5.150
  170    HE2  PHE  23           HE2      PHE  23  -1.223  -4.659  -1.280
  171    HZ   PHE  23           HZ       PHE  23   0.054  -3.210  -2.881
  172    H    GLY  24           HN       GLY  24  -5.220  -9.263  -4.577
  173    HA2  GLY  24           HA2      GLY  24  -6.381  -9.839  -6.545
  174    HA3  GLY  24           HA1      GLY  24  -4.956  -9.908  -7.486
  175    H    ALA  25           HN       ALA  25  -6.182 -11.224  -4.502
  176    HA   ALA  25           HA       ALA  25  -5.844 -13.919  -5.607
  177    HB1  ALA  25           HB1      ALA  25  -5.763 -14.652  -3.206
  178    HB2  ALA  25           HB2      ALA  25  -5.752 -12.943  -2.733
  179    HB3  ALA  25           HB3      ALA  25  -4.428 -13.603  -3.677
  180    H    ILE  26           HN       ILE  26  -7.504 -12.117  -3.203
  181    HA   ILE  26           HA       ILE  26  -9.966 -13.327  -3.583
  182    HB   ILE  26           HB       ILE  26  -9.695 -12.418  -1.458
  183   HG12  ILE  26          HG12      ILE  26 -11.095 -10.308  -2.951
  184   HG13  ILE  26          HG11      ILE  26 -11.894 -11.786  -2.399
  185   HG21  ILE  26          HG21      ILE  26  -8.642  -9.948  -2.757
  186   HG22  ILE  26          HG22      ILE  26  -7.720 -11.065  -1.739
  187   HG23  ILE  26          HG23      ILE  26  -8.968 -10.038  -1.034
  188   HD11  ILE  26          HD11      ILE  26 -11.400 -11.050  -0.042
  189   HD12  ILE  26          HD12      ILE  26 -12.500  -9.975  -0.902
  190   HD13  ILE  26          HD13      ILE  26 -10.805  -9.523  -0.698
  191    H    LEU  27           HN       LEU  27  -8.432 -10.369  -4.752
  192    HA   LEU  27           HA       LEU  27 -10.576  -9.317  -6.230
  193    HB2  LEU  27           HB2      LEU  27  -9.037  -7.718  -6.062
  194    HB3  LEU  27           HB1      LEU  27  -7.733  -8.832  -5.851
  195    HG   LEU  27           HG       LEU  27  -7.615  -9.021  -8.363
  196   HD11  LEU  27          HD11      LEU  27  -8.592  -7.326  -9.680
  197   HD12  LEU  27          HD12      LEU  27  -9.469  -6.673  -8.276
  198   HD13  LEU  27          HD13      LEU  27  -9.836  -8.303  -8.897
  199   HD21  LEU  27          HD21      LEU  27  -7.222  -6.287  -7.174
  200   HD22  LEU  27          HD22      LEU  27  -6.493  -6.878  -8.665
  201   HD23  LEU  27          HD23      LEU  27  -6.072  -7.623  -7.122
  202    H    SER  28           HN       SER  28  -7.998 -11.469  -7.018
  203    HA   SER  28           HA       SER  28  -8.711 -11.715  -9.763
  204    HB2  SER  28           HB2      SER  28  -6.441 -12.181  -8.947
  205    HB3  SER  28           HB1      SER  28  -7.045 -13.590  -8.075
  206    HG   SER  28           HG       SER  28  -7.551 -13.357 -10.807
  207    H    SER  29           HN       SER  29  -9.581 -13.450  -6.856
  208    HA   SER  29           HA       SER  29 -11.259 -14.727  -6.290
  209    HB2  SER  29           HB2      SER  29 -12.602 -13.235  -7.559
  210    HB3  SER  29           HB1      SER  29 -12.374 -14.157  -9.046
  211    HG   SER  29           HG       SER  29 -14.360 -14.622  -8.039
  212    H    THR  30           HN       THR  30  -9.326 -15.597  -8.852
  213    HA   THR  30           HA       THR  30 -10.144 -18.272  -9.133
  214    HB   THR  30           HB       THR  30  -8.659 -17.174 -10.778
  215    HG1  THR  30           HG1      THR  30  -6.946 -18.854 -10.770
  216   HG21  THR  30          HG21      THR  30  -6.294 -16.745 -10.263
  217   HG22  THR  30          HG22      THR  30  -6.583 -17.278  -8.599
  218   HG23  THR  30          HG23      THR  30  -7.379 -15.832  -9.200
  219    H    ASN  31           HN       ASN  31  -8.491 -16.553  -6.616
  220    HA   ASN  31           HA       ASN  31  -7.404 -18.988  -5.490
  221    HB2  ASN  31           HB2      ASN  31  -7.314 -16.130  -4.524
  222    HB3  ASN  31           HB1      ASN  31  -6.637 -17.476  -3.620
  223   HD21  ASN  31          HD21      ASN  31  -4.654 -16.628  -3.706
  224   HD22  ASN  31          HD22      ASN  31  -3.661 -16.582  -5.130
  225    H    VAL  32           HN       VAL  32 -10.224 -17.280  -5.419
  226    HA   VAL  32           HA       VAL  32 -10.992 -18.181  -2.763
  227    HB   VAL  32           HB       VAL  32 -12.694 -16.753  -4.846
  228   HG11  VAL  32          HG11      VAL  32 -14.065 -16.073  -2.916
  229   HG12  VAL  32          HG12      VAL  32 -13.045 -17.061  -1.869
  230   HG13  VAL  32          HG13      VAL  32 -14.015 -17.825  -3.127
  231   HG21  VAL  32          HG21      VAL  32 -10.738 -15.398  -4.300
  232   HG22  VAL  32          HG22      VAL  32 -11.105 -15.548  -2.581
  233   HG23  VAL  32          HG23      VAL  32 -12.208 -14.677  -3.644
  234    H    GLY  33           HN       GLY  33 -10.975 -19.238  -5.942
  235    HA2  GLY  33           HA2      GLY  33 -11.552 -21.374  -6.700
  236    HA3  GLY  33           HA1      GLY  33 -12.537 -21.584  -5.254
  237    H    SER  34           HN       SER  34 -12.894 -18.685  -6.987
  238    HA   SER  34           HA       SER  34 -15.501 -19.631  -7.932
  239    HB2  SER  34           HB2      SER  34 -14.524 -16.805  -7.523
  240    HB3  SER  34           HB1      SER  34 -16.185 -17.308  -7.846
  241    HG   SER  34           HG       SER  34 -16.091 -18.497  -5.888
  242    H    ASN  35           HN       ASN  35 -12.620 -17.851  -8.890
  243    HA   ASN  35           HA       ASN  35 -13.482 -17.943 -11.685
  244    HB2  ASN  35           HB2      ASN  35 -11.468 -16.231 -10.254
  245    HB3  ASN  35           HB1      ASN  35 -11.417 -16.409 -12.001
  246   HD21  ASN  35          HD21      ASN  35 -11.839 -14.216 -12.241
  247   HD22  ASN  35          HD22      ASN  35 -13.404 -13.539 -11.993
  248    H    THR  36           HN       THR  36 -12.398 -20.238 -10.133
  249    HA   THR  36           HA       THR  36  -9.918 -20.833 -11.386
  250    HB   THR  36           HB       THR  36 -10.926 -23.173 -10.434
  251    HG1  THR  36           HG1      THR  36 -12.372 -22.826  -8.929
  252   HG21  THR  36          HG21      THR  36  -9.642 -22.705  -8.382
  253   HG22  THR  36          HG22      THR  36  -9.594 -20.994  -8.807
  254   HG23  THR  36          HG23      THR  36  -8.764 -22.179  -9.816
  255    H    TYC  37           HN       ATY  37 -10.189 -20.859 -13.555
  256    HA   TYC  37           HA       ATY  37 -12.280 -22.614 -14.613
  257    HB1  TYC  37           HB1      ATY  37 -12.295 -21.250 -16.648
  258    HB2  TYC  37           HB2      ATY  37 -10.993 -20.258 -16.022
  259    HD1  TYC  37           HD1      ATY  37 -11.699 -18.147 -15.455
  260    HD2  TYC  37           HD2      ATY  37 -14.281 -21.422 -14.645
  261    HE1  TYC  37           HE1      ATY  37 -13.313 -16.612 -14.416
  262    HE2  TYC  37           HE2      ATY  37 -15.910 -19.895 -13.610
  263    HH   TYC  37           HH       ATY  37 -15.875 -17.652 -12.515
  264   HT21  TYC  37          HT21      ATY  37  -9.293 -21.236 -15.906
  265   HT22  TYC  37          HT22      ATY  37  -8.617 -22.756 -16.386
  Start of MODEL    3
    1    H1   LYS   1           HT1      LYS   1   9.571   3.948   8.638
    2    H2   LYS   1           HT2      LYS   1   7.881   3.849   8.486
    3    H3   LYS   1           HT3      LYS   1   8.655   5.350   8.674
    4    HA   LYS   1           HA       LYS   1   9.114   3.540   6.418
    5    HB2  LYS   1           HB2      LYS   1   7.793   5.091   5.063
    6    HB3  LYS   1           HB1      LYS   1   6.818   4.411   6.350
    7    HG2  LYS   1           HG2      LYS   1   6.840   6.453   7.562
    8    HG3  LYS   1           HG1      LYS   1   8.093   7.127   6.522
    9    HD2  LYS   1           HD2      LYS   1   5.899   8.051   5.967
   10    HD3  LYS   1           HD1      LYS   1   6.550   7.109   4.629
   11    HE2  LYS   1           HE2      LYS   1   5.129   5.208   5.340
   12    HE3  LYS   1           HE1      LYS   1   4.456   6.233   6.609
   13    HZ1  LYS   1           HZ1      LYS   1   3.009   6.212   4.682
   14    HZ2  LYS   1           HZ2      LYS   1   4.266   6.715   3.691
   15    HZ3  LYS   1           HZ3      LYS   1   3.675   7.752   4.855
   16    H    CYS   2           HN       CYS   2   9.668   5.422   4.562
   17    HA   CYS   2           HA       CYS   2  11.521   7.347   5.582
   18    HB2  CYS   2           HB2      CYS   2  13.272   6.362   3.936
   19    HB3  CYS   2           HB1      CYS   2  13.090   5.621   5.523
   20    H    ASN   3           HN       ASN   3  12.510   8.505   3.500
   21    HA   ASN   3           HA       ASN   3  10.135   8.829   1.786
   22    HB2  ASN   3           HB2      ASN   3  10.205  11.267   2.015
   23    HB3  ASN   3           HB1      ASN   3   9.935  10.484   3.563
   24   HD21  ASN   3          HD21      ASN   3  11.533  10.599   5.138
   25   HD22  ASN   3          HD22      ASN   3  12.858  11.698   5.026
   26    H    THR   4           HN       THR   4  13.103   7.983   1.549
   27    HA   THR   4           HA       THR   4  13.677   9.790  -0.648
   28    HB   THR   4           HB       THR   4  15.537   9.618   0.925
   29    HG1  THR   4           HG1      THR   4  16.509   9.834  -0.908
   30   HG21  THR   4          HG21      THR   4  15.493   6.676   0.316
   31   HG22  THR   4          HG22      THR   4  15.013   7.412   1.848
   32   HG23  THR   4          HG23      THR   4  16.700   7.497   1.306
   33    H    ALA   5           HN       ALA   5  14.385   8.888  -2.605
   34    HA   ALA   5           HA       ALA   5  12.701   6.887  -3.673
   35    HB1  ALA   5           HB1      ALA   5  13.586   8.743  -4.979
   36    HB2  ALA   5           HB2      ALA   5  13.998   7.189  -5.712
   37    HB3  ALA   5           HB3      ALA   5  15.212   8.089  -4.794
   38    H    THR   6           HN       THR   6  15.719   6.758  -2.145
   39    HA   THR   6           HA       THR   6  16.601   4.259  -3.210
   40    HB   THR   6           HB       THR   6  17.404   5.725  -0.700
   41    HG1  THR   6           HG1      THR   6  17.765   6.257  -3.368
   42   HG21  THR   6          HG21      THR   6  18.226   3.479  -0.823
   43   HG22  THR   6          HG22      THR   6  19.572   4.604  -1.089
   44   HG23  THR   6          HG23      THR   6  18.847   3.736  -2.454
   45    H    CYS   7           HN       CYS   7  14.246   5.178  -0.894
   46    HA   CYS   7           HA       CYS   7  14.629   2.675   0.644
   47    HB2  CYS   7           HB2      CYS   7  15.389   4.904   1.616
   48    HB3  CYS   7           HB1      CYS   7  13.748   5.256   1.685
   49    H    ALA   8           HN       ALA   8  12.351   5.336  -0.097
   50    HA   ALA   8           HA       ALA   8  10.127   4.069   1.039
   51    HB1  ALA   8           HB1      ALA   8   8.833   5.733  -0.208
   52    HB2  ALA   8           HB2      ALA   8  10.305   6.194  -1.091
   53    HB3  ALA   8           HB3      ALA   8  10.200   6.430   0.658
   54    H    THR   9           HN       THR   9  11.786   3.762  -1.867
   55    HA   THR   9           HA       THR   9   9.733   2.509  -3.428
   56    HB   THR   9           HB       THR   9  11.690   1.639  -4.760
   57    HG1  THR   9           HG1      THR   9  13.544   3.287  -3.952
   58   HG21  THR   9          HG21      THR   9  11.496   4.609  -4.234
   59   HG22  THR   9          HG22      THR   9  10.469   3.696  -5.341
   60   HG23  THR   9          HG23      THR   9  12.193   3.877  -5.677
   61    H    GLN  10           HN       GLN  10  12.018   1.480  -1.177
   62    HA   GLN  10           HA       GLN  10  11.836  -1.369  -1.575
   63    HB2  GLN  10           HB2      GLN  10  12.734   0.077   0.929
   64    HB3  GLN  10           HB1      GLN  10  13.151  -1.570   0.457
   65    HG2  GLN  10           HG2      GLN  10  14.041   0.978  -0.877
   66    HG3  GLN  10           HG1      GLN  10  15.012  -0.038   0.176
   67   HE21  GLN  10          HE21      GLN  10  15.295   0.816  -2.559
   68   HE22  GLN  10          HE22      GLN  10  15.533  -0.612  -3.516
   69    H    ARG  11           HN       ARG  11  10.499   1.066   0.459
   70    HA   ARG  11           HA       ARG  11   8.893  -0.616   2.137
   71    HB2  ARG  11           HB2      ARG  11   8.247   2.238   1.412
   72    HB3  ARG  11           HB1      ARG  11   7.763   1.362   2.854
   73    HG2  ARG  11           HG2      ARG  11  10.552   2.263   2.152
   74    HG3  ARG  11           HG1      ARG  11   9.510   2.952   3.390
   75    HD2  ARG  11           HD2      ARG  11  10.601   0.157   3.355
   76    HD3  ARG  11           HD1      ARG  11  11.239   1.525   4.274
   77    HE   ARG  11           HE       ARG  11   8.560   1.277   4.930
   78   HH11  ARG  11          HH11      ARG  11  11.473  -0.734   5.370
   79   HH12  ARG  11          HH12      ARG  11  10.946  -1.378   6.848
   80   HH21  ARG  11          HH21      ARG  11   7.878   0.383   6.948
   81   HH22  ARG  11          HH22      ARG  11   8.854  -0.730   7.772
   82    H    LEU  12           HN       LEU  12   8.412   0.961  -0.930
   83    HA   LEU  12           HA       LEU  12   5.739   0.323  -1.395
   84    HB2  LEU  12           HB2      LEU  12   8.153   0.724  -3.001
   85    HB3  LEU  12           HB1      LEU  12   6.764   0.362  -3.879
   86    HG   LEU  12           HG       LEU  12   7.338   2.822  -2.220
   87   HD11  LEU  12          HD11      LEU  12   6.932   4.002  -4.300
   88   HD12  LEU  12          HD12      LEU  12   6.519   2.484  -5.091
   89   HD13  LEU  12          HD13      LEU  12   8.162   2.760  -4.542
   90   HD21  LEU  12          HD21      LEU  12   5.038   2.223  -1.688
   91   HD22  LEU  12          HD22      LEU  12   4.671   2.033  -3.401
   92   HD23  LEU  12          HD23      LEU  12   5.058   3.626  -2.756
   93    H    ALA  13           HN       ALA  13   8.763  -1.418  -1.955
   94    HA   ALA  13           HA       ALA  13   7.562  -3.574  -3.250
   95    HB1  ALA  13           HB1      ALA  13   9.938  -3.105  -3.495
   96    HB2  ALA  13           HB2      ALA  13   9.703  -4.749  -2.906
   97    HB3  ALA  13           HB3      ALA  13  10.200  -3.474  -1.793
   98    H    ASN  14           HN       ASN  14   8.107  -2.750   0.030
   99    HA   ASN  14           HA       ASN  14   7.420  -5.324   1.209
  100    HB2  ASN  14           HB2      ASN  14   7.817  -2.585   2.395
  101    HB3  ASN  14           HB1      ASN  14   7.297  -3.967   3.343
  102   HD21  ASN  14          HD21      ASN  14   9.597  -4.234   0.756
  103   HD22  ASN  14          HD22      ASN  14  10.983  -4.540   1.733
  104    H    PHE  15           HN       PHE  15   5.604  -2.973  -0.284
  105    HA   PHE  15           HA       PHE  15   3.415  -3.129   1.574
  106    HB2  PHE  15           HB2      PHE  15   3.331  -0.982   0.851
  107    HB3  PHE  15           HB1      PHE  15   4.420  -1.341  -0.484
  108    HD1  PHE  15           HD1      PHE  15   3.566  -1.729  -2.671
  109    HD2  PHE  15           HD2      PHE  15   0.898  -1.130   0.585
  110    HE1  PHE  15           HE1      PHE  15   1.728  -1.451  -4.255
  111    HE2  PHE  15           HE2      PHE  15  -0.962  -0.837  -0.992
  112    HZ   PHE  15           HZ       PHE  15  -0.556  -0.996  -3.419
  113    H    LEU  16           HN       LEU  16   4.736  -4.485  -1.257
  114    HA   LEU  16           HA       LEU  16   2.293  -5.899  -1.624
  115    HB2  LEU  16           HB2      LEU  16   2.128  -5.239  -3.651
  116    HB3  LEU  16           HB1      LEU  16   3.136  -3.972  -3.150
  117    HG   LEU  16           HG       LEU  16   4.263  -6.350  -4.629
  118   HD11  LEU  16          HD11      LEU  16   3.457  -3.626  -5.642
  119   HD12  LEU  16          HD12      LEU  16   2.675  -5.157  -6.039
  120   HD13  LEU  16          HD13      LEU  16   4.328  -4.846  -6.567
  121   HD21  LEU  16          HD21      LEU  16   6.175  -4.872  -4.971
  122   HD22  LEU  16          HD22      LEU  16   5.849  -5.095  -3.245
  123   HD23  LEU  16          HD23      LEU  16   5.353  -3.606  -4.054
  124    H    VAL  17           HN       VAL  17   4.680  -6.533  -0.143
  125    HA   VAL  17           HA       VAL  17   6.344  -8.268  -1.655
  126    HB   VAL  17           HB       VAL  17   7.262  -6.980   0.158
  127   HG11  VAL  17          HG11      VAL  17   5.346  -7.054   1.692
  128   HG12  VAL  17          HG12      VAL  17   6.885  -7.371   2.492
  129   HG13  VAL  17          HG13      VAL  17   5.778  -8.695   2.148
  130   HG21  VAL  17          HG21      VAL  17   8.548  -8.804   1.320
  131   HG22  VAL  17          HG22      VAL  17   8.539  -8.828  -0.440
  132   HG23  VAL  17          HG23      VAL  17   7.524  -9.954   0.443
  133    H    HIS  18           HN       HIS  18   4.379  -9.142   1.129
  134    HA   HIS  18           HA       HIS  18   4.120 -11.850  -0.021
  135    HB2  HIS  18           HB2      HIS  18   3.568 -10.893   2.816
  136    HB3  HIS  18           HB1      HIS  18   3.187 -12.494   2.228
  137    HD1  HIS  18           HD1      HIS  18   4.775 -14.000   3.353
  138    HD2  HIS  18           HD2      HIS  18   6.567 -10.546   1.973
  139    HE1  HIS  18           HE1      HIS  18   7.210 -14.285   3.882
  140    HE2  HIS  18           HE2      HIS  18   8.320 -12.327   2.804
  141    H    SER  19           HN       SER  19   2.810  -9.040  -0.106
  142    HA   SER  19           HA       SER  19   0.218  -9.313   0.681
  143    HB2  SER  19           HB2      SER  19   1.321  -7.494  -1.394
  144    HB3  SER  19           HB1      SER  19  -0.065  -7.195  -0.349
  145    HG   SER  19           HG       SER  19   1.568  -6.159   0.612
  146    H    SER  20           HN       SER  20   1.946 -10.583  -1.946
  147    HA   SER  20           HA       SER  20   0.293 -10.450  -4.224
  148    HB2  SER  20           HB2      SER  20   2.246 -12.570  -3.434
  149    HB3  SER  20           HB1      SER  20   1.816 -12.084  -5.083
  150    HG   SER  20           HG       SER  20   3.838 -11.191  -4.165
  151    H    ASN  21           HN       ASN  21  -0.277 -11.846  -1.458
  152    HA   ASN  21           HA       ASN  21  -1.711 -14.250  -2.348
  153    HB2  ASN  21           HB2      ASN  21  -0.983 -13.162   0.331
  154    HB3  ASN  21           HB1      ASN  21  -2.208 -14.438   0.205
  155   HD21  ASN  21          HD21      ASN  21   1.119 -13.628   0.232
  156   HD22  ASN  21          HD22      ASN  21   1.740 -15.217   0.024
  157    H    ASN  22           HN       ASN  22  -2.222 -11.043  -1.968
  158    HA   ASN  22           HA       ASN  22  -5.124 -11.348  -1.959
  159    HB2  ASN  22           HB2      ASN  22  -3.327  -9.545  -0.462
  160    HB3  ASN  22           HB1      ASN  22  -4.739  -8.782  -1.163
  161   HD21  ASN  22          HD21      ASN  22  -4.841 -12.113  -0.152
  162   HD22  ASN  22          HD22      ASN  22  -5.823 -11.864   1.225
  163    H    PHE  23           HN       PHE  23  -2.407  -9.455  -2.735
  164    HA   PHE  23           HA       PHE  23  -3.261  -7.904  -4.823
  165    HB2  PHE  23           HB2      PHE  23  -0.900  -8.990  -3.756
  166    HB3  PHE  23           HB1      PHE  23  -0.539  -8.467  -5.354
  167    HD1  PHE  23           HD1      PHE  23  -0.290  -6.019  -5.657
  168    HD2  PHE  23           HD2      PHE  23  -1.880  -7.603  -2.060
  169    HE1  PHE  23           HE1      PHE  23  -0.151  -3.793  -4.612
  170    HE2  PHE  23           HE2      PHE  23  -1.749  -5.466  -1.004
  171    HZ   PHE  23           HZ       PHE  23  -0.879  -3.490  -2.270
  172    H    GLY  24           HN       GLY  24  -4.435  -8.722  -6.130
  173    HA2  GLY  24           HA2      GLY  24  -5.286  -9.735  -7.942
  174    HA3  GLY  24           HA1      GLY  24  -3.729 -10.146  -8.532
  175    H    ALA  25           HN       ALA  25  -5.184 -11.037  -5.494
  176    HA   ALA  25           HA       ALA  25  -5.522 -13.777  -6.422
  177    HB1  ALA  25           HB1      ALA  25  -4.108 -13.508  -4.452
  178    HB2  ALA  25           HB2      ALA  25  -5.624 -14.295  -3.986
  179    HB3  ALA  25           HB3      ALA  25  -5.370 -12.579  -3.653
  180    H    ILE  26           HN       ILE  26  -6.805 -11.272  -4.448
  181    HA   ILE  26           HA       ILE  26  -9.453 -12.100  -4.947
  182    HB   ILE  26           HB       ILE  26  -9.171 -11.368  -2.714
  183   HG12  ILE  26          HG12      ILE  26 -10.130  -9.020  -4.195
  184   HG13  ILE  26          HG11      ILE  26 -11.170 -10.404  -3.881
  185   HG21  ILE  26          HG21      ILE  26  -8.149  -9.159  -2.127
  186   HG22  ILE  26          HG22      ILE  26  -7.716  -9.004  -3.850
  187   HG23  ILE  26          HG23      ILE  26  -7.029 -10.291  -2.893
  188   HD11  ILE  26          HD11      ILE  26 -10.883  -9.934  -1.426
  189   HD12  ILE  26          HD12      ILE  26 -11.702  -8.644  -2.304
  190   HD13  ILE  26          HD13      ILE  26 -10.000  -8.474  -1.869
  191    H    LEU  27           HN       LEU  27  -7.197  -9.570  -5.781
  192    HA   LEU  27           HA       LEU  27  -8.857  -7.848  -7.204
  193    HB2  LEU  27           HB2      LEU  27  -6.890  -6.857  -6.792
  194    HB3  LEU  27           HB1      LEU  27  -6.017  -8.353  -6.808
  195    HG   LEU  27           HG       LEU  27  -5.841  -8.199  -9.296
  196   HD11  LEU  27          HD11      LEU  27  -7.036  -5.473  -8.970
  197   HD12  LEU  27          HD12      LEU  27  -7.770  -6.898  -9.757
  198   HD13  LEU  27          HD13      LEU  27  -6.284  -6.191 -10.412
  199   HD21  LEU  27          HD21      LEU  27  -4.208  -6.401  -9.343
  200   HD22  LEU  27          HD22      LEU  27  -4.040  -7.404  -7.903
  201   HD23  LEU  27          HD23      LEU  27  -4.802  -5.818  -7.788
  202    H    SER  28           HN       SER  28  -7.100 -10.657  -8.135
  203    HA   SER  28           HA       SER  28  -8.062 -10.388 -10.870
  204    HB2  SER  28           HB2      SER  28  -5.702 -11.133 -10.487
  205    HB3  SER  28           HB1      SER  28  -6.312 -12.616  -9.771
  206    HG   SER  28           HG       SER  28  -7.018 -11.819 -12.387
  207    H    SER  29           HN       SER  29  -9.303 -11.544  -8.098
  208    HA   SER  29           HA       SER  29 -11.001 -12.821  -7.431
  209    HB2  SER  29           HB2      SER  29 -11.724 -12.854 -10.350
  210    HB3  SER  29           HB1      SER  29 -12.830 -13.183  -9.014
  211    HG   SER  29           HG       SER  29 -12.823 -11.095  -8.442
  212    H    THR  30           HN       THR  30  -8.506 -14.164  -8.502
  213    HA   THR  30           HA       THR  30  -9.471 -16.650  -9.543
  214    HB   THR  30           HB       THR  30  -7.377 -15.698 -10.404
  215    HG1  THR  30           HG1      THR  30  -6.316 -17.555 -10.511
  216   HG21  THR  30          HG21      THR  30  -6.574 -14.605  -8.371
  217   HG22  THR  30          HG22      THR  30  -5.334 -15.673  -9.033
  218   HG23  THR  30          HG23      THR  30  -6.278 -16.177  -7.630
  219    H    ASN  31           HN       ASN  31  -9.185 -15.375  -6.431
  220    HA   ASN  31           HA       ASN  31  -9.008 -18.092  -5.327
  221    HB2  ASN  31           HB2      ASN  31  -7.704 -15.608  -4.195
  222    HB3  ASN  31           HB1      ASN  31  -7.880 -17.101  -3.294
  223   HD21  ASN  31          HD21      ASN  31  -7.272 -18.811  -5.626
  224   HD22  ASN  31          HD22      ASN  31  -5.587 -18.620  -5.903
  225    H    VAL  32           HN       VAL  32 -11.165 -16.050  -5.971
  226    HA   VAL  32           HA       VAL  32 -12.236 -15.701  -3.259
  227    HB   VAL  32           HB       VAL  32 -13.578 -13.968  -4.104
  228   HG11  VAL  32          HG11      VAL  32 -11.456 -13.273  -3.317
  229   HG12  VAL  32          HG12      VAL  32 -11.806 -12.314  -4.763
  230   HG13  VAL  32          HG13      VAL  32 -10.701 -13.692  -4.851
  231   HG21  VAL  32          HG21      VAL  32 -13.340 -13.057  -6.391
  232   HG22  VAL  32          HG22      VAL  32 -14.037 -14.677  -6.345
  233   HG23  VAL  32          HG23      VAL  32 -12.347 -14.457  -6.796
  234    H    GLY  33           HN       GLY  33 -12.421 -17.850  -5.442
  235    HA2  GLY  33           HA2      GLY  33 -14.003 -19.544  -5.733
  236    HA3  GLY  33           HA1      GLY  33 -15.200 -18.527  -4.925
  237    H    SER  34           HN       SER  34 -13.179 -17.586  -7.585
  238    HA   SER  34           HA       SER  34 -15.531 -17.597  -9.325
  239    HB2  SER  34           HB2      SER  34 -13.488 -15.389  -9.064
  240    HB3  SER  34           HB1      SER  34 -14.773 -15.448 -10.274
  241    HG   SER  34           HG       SER  34 -16.033 -15.864  -8.141
  242    H    ASN  35           HN       ASN  35 -12.740 -18.951  -8.807
  243    HA   ASN  35           HA       ASN  35 -12.361 -19.545 -11.602
  244    HB2  ASN  35           HB2      ASN  35 -10.622 -17.893 -11.207
  245    HB3  ASN  35           HB1      ASN  35 -10.052 -18.760  -9.777
  246   HD21  ASN  35          HD21      ASN  35  -7.978 -18.989 -10.634
  247   HD22  ASN  35          HD22      ASN  35  -7.633 -20.069 -11.930
  248    H    THR  36           HN       THR  36 -13.671 -21.197 -10.701
  249    HA   THR  36           HA       THR  36 -11.975 -23.403  -9.903
  250    HB   THR  36           HB       THR  36 -14.656 -22.845  -8.587
  251    HG1  THR  36           HG1      THR  36 -12.065 -22.043  -8.011
  252   HG21  THR  36          HG21      THR  36 -13.942 -25.215  -8.683
  253   HG22  THR  36          HG22      THR  36 -13.966 -24.590  -7.034
  254   HG23  THR  36          HG23      THR  36 -12.429 -24.770  -7.886
  255    H    TYC  37           HN       ATY  37 -12.283 -23.599 -12.208
  256    HA   TYC  37           HA       ATY  37 -14.976 -24.334 -13.051
  257    HB1  TYC  37           HB1      ATY  37 -14.209 -24.084 -15.298
  258    HB2  TYC  37           HB2      ATY  37 -12.519 -24.134 -14.802
  259    HD1  TYC  37           HD1      ATY  37 -15.441 -22.100 -13.611
  260    HD2  TYC  37           HD2      ATY  37 -11.528 -22.106 -15.270
  261    HE1  TYC  37           HE1      ATY  37 -15.366 -19.651 -13.448
  262    HE2  TYC  37           HE2      ATY  37 -11.451 -19.660 -15.103
  263    HH   TYC  37           HH       ATY  37 -13.618 -17.927 -13.239
  264   HT21  TYC  37          HT21      ATY  37 -15.099 -26.277 -12.002
  265   HT22  TYC  37          HT22      ATY  37 -14.230 -27.683 -12.508
  Start of MODEL    4
    1    H1   LYS   1           HT1      LYS   1   9.322   5.666   9.320
    2    H2   LYS   1           HT2      LYS   1  10.126   4.256   8.866
    3    H3   LYS   1           HT3      LYS   1   8.465   4.218   9.117
    4    HA   LYS   1           HA       LYS   1   9.031   4.192   6.793
    5    HB2  LYS   1           HB2      LYS   1   7.761   6.743   7.782
    6    HB3  LYS   1           HB1      LYS   1   7.766   6.267   6.097
    7    HG2  LYS   1           HG2      LYS   1   6.553   4.219   6.701
    8    HG3  LYS   1           HG1      LYS   1   6.495   4.767   8.374
    9    HD2  LYS   1           HD2      LYS   1   5.263   6.763   7.650
   10    HD3  LYS   1           HD1      LYS   1   5.309   6.173   5.989
   11    HE2  LYS   1           HE2      LYS   1   4.060   4.186   6.649
   12    HE3  LYS   1           HE1      LYS   1   4.041   4.753   8.317
   13    HZ1  LYS   1           HZ1      LYS   1   1.977   5.235   7.200
   14    HZ2  LYS   1           HZ2      LYS   1   2.768   6.110   6.007
   15    HZ3  LYS   1           HZ3      LYS   1   2.751   6.676   7.597
   16    H    CYS   2           HN       CYS   2   9.639   5.700   4.958
   17    HA   CYS   2           HA       CYS   2  11.652   7.652   5.566
   18    HB2  CYS   2           HB2      CYS   2  13.255   6.499   3.954
   19    HB3  CYS   2           HB1      CYS   2  13.106   5.786   5.554
   20    H    ASN   3           HN       ASN   3  12.476   8.554   3.347
   21    HA   ASN   3           HA       ASN   3  10.050   8.809   1.699
   22    HB2  ASN   3           HB2      ASN   3  10.016  10.514   3.530
   23    HB3  ASN   3           HB1      ASN   3  11.521  11.167   2.915
   24   HD21  ASN   3          HD21      ASN   3  11.449  12.533   1.128
   25   HD22  ASN   3          HD22      ASN   3   9.982  13.090   0.419
   26    H    THR   4           HN       THR   4  13.141   8.025   1.528
   27    HA   THR   4           HA       THR   4  13.656   9.712  -0.794
   28    HB   THR   4           HB       THR   4  15.508   9.630   0.827
   29    HG1  THR   4           HG1      THR   4  16.683   9.812  -0.821
   30   HG21  THR   4          HG21      THR   4  15.077   7.410   1.778
   31   HG22  THR   4          HG22      THR   4  16.754   7.558   1.242
   32   HG23  THR   4          HG23      THR   4  15.580   6.674   0.256
   33    H    ALA   5           HN       ALA   5  14.394   8.746  -2.699
   34    HA   ALA   5           HA       ALA   5  12.736   6.703  -3.667
   35    HB1  ALA   5           HB1      ALA   5  13.584   8.520  -5.059
   36    HB2  ALA   5           HB2      ALA   5  13.958   6.935  -5.746
   37    HB3  ALA   5           HB3      ALA   5  15.208   7.851  -4.902
   38    H    THR   6           HN       THR   6  15.736   6.577  -2.122
   39    HA   THR   6           HA       THR   6  16.463   4.009  -3.200
   40    HB   THR   6           HB       THR   6  17.581   5.611  -0.894
   41    HG1  THR   6           HG1      THR   6  18.379   5.357  -3.608
   42   HG21  THR   6          HG21      THR   6  18.144   3.279  -0.731
   43   HG22  THR   6          HG22      THR   6  19.590   4.202  -1.163
   44   HG23  THR   6          HG23      THR   6  18.737   3.244  -2.393
   45    H    CYS   7           HN       CYS   7  14.279   5.086  -0.854
   46    HA   CYS   7           HA       CYS   7  14.624   2.644   0.789
   47    HB2  CYS   7           HB2      CYS   7  15.358   4.897   1.668
   48    HB3  CYS   7           HB1      CYS   7  13.718   5.277   1.671
   49    H    ALA   8           HN       ALA   8  12.361   5.296  -0.028
   50    HA   ALA   8           HA       ALA   8  10.123   4.040   1.115
   51    HB1  ALA   8           HB1      ALA   8  10.236   6.413   0.759
   52    HB2  ALA   8           HB2      ALA   8   8.849   5.732  -0.101
   53    HB3  ALA   8           HB3      ALA   8  10.322   6.176  -0.986
   54    H    THR   9           HN       THR   9  11.758   3.767  -1.798
   55    HA   THR   9           HA       THR   9   9.675   2.586  -3.377
   56    HB   THR   9           HB       THR   9  11.617   1.678  -4.701
   57    HG1  THR   9           HG1      THR   9  13.532   3.196  -3.934
   58   HG21  THR   9          HG21      THR   9  11.463   4.655  -4.174
   59   HG22  THR   9          HG22      THR   9  10.455   3.756  -5.311
   60   HG23  THR   9          HG23      THR   9  12.189   3.921  -5.601
   61    H    GLN  10           HN       GLN  10  11.960   1.504  -1.153
   62    HA   GLN  10           HA       GLN  10  11.692  -1.325  -1.589
   63    HB2  GLN  10           HB2      GLN  10  12.697  -0.003   0.930
   64    HB3  GLN  10           HB1      GLN  10  13.059  -1.630   0.363
   65    HG2  GLN  10           HG2      GLN  10  14.032   0.988  -0.730
   66    HG3  GLN  10           HG1      GLN  10  14.974  -0.254   0.078
   67   HE21  GLN  10          HE21      GLN  10  15.245   1.007  -2.464
   68   HE22  GLN  10          HE22      GLN  10  15.319  -0.243  -3.659
   69    H    ARG  11           HN       ARG  11  10.447   1.125   0.521
   70    HA   ARG  11           HA       ARG  11   8.856  -0.556   2.162
   71    HB2  ARG  11           HB2      ARG  11   8.208   2.305   1.403
   72    HB3  ARG  11           HB1      ARG  11   7.613   1.431   2.802
   73    HG2  ARG  11           HG2      ARG  11  10.437   2.342   2.301
   74    HG3  ARG  11           HG1      ARG  11   9.322   2.986   3.502
   75    HD2  ARG  11           HD2      ARG  11  10.536   0.264   3.373
   76    HD3  ARG  11           HD1      ARG  11  10.909   1.546   4.534
   77    HE   ARG  11           HE       ARG  11   8.440   1.263   5.164
   78   HH11  ARG  11          HH11      ARG  11  10.566  -1.436   4.256
   79   HH12  ARG  11          HH12      ARG  11   9.662  -2.610   5.081
   80   HH21  ARG  11          HH21      ARG  11   7.220  -0.337   6.278
   81   HH22  ARG  11          HH22      ARG  11   7.685  -1.981   6.265
   82    H    LEU  12           HN       LEU  12   8.291   1.091  -0.872
   83    HA   LEU  12           HA       LEU  12   5.649   0.354  -1.356
   84    HB2  LEU  12           HB2      LEU  12   8.053   0.847  -2.938
   85    HB3  LEU  12           HB1      LEU  12   6.672   0.492  -3.835
   86    HG   LEU  12           HG       LEU  12   7.207   2.895  -2.075
   87   HD11  LEU  12          HD11      LEU  12   6.408   2.699  -4.966
   88   HD12  LEU  12          HD12      LEU  12   8.063   2.864  -4.408
   89   HD13  LEU  12          HD13      LEU  12   6.902   4.152  -4.096
   90   HD21  LEU  12          HD21      LEU  12   4.944   3.697  -2.633
   91   HD22  LEU  12          HD22      LEU  12   4.913   2.261  -1.617
   92   HD23  LEU  12          HD23      LEU  12   4.577   2.126  -3.346
   93    H    ALA  13           HN       ALA  13   8.724  -1.232  -1.980
   94    HA   ALA  13           HA       ALA  13   7.697  -3.435  -3.344
   95    HB1  ALA  13           HB1      ALA  13  10.050  -2.781  -3.483
   96    HB2  ALA  13           HB2      ALA  13   9.916  -4.459  -2.955
   97    HB3  ALA  13           HB3      ALA  13  10.273  -3.192  -1.787
   98    H    ASN  14           HN       ASN  14   8.199  -2.737   0.022
   99    HA   ASN  14           HA       ASN  14   7.616  -5.413   0.958
  100    HB2  ASN  14           HB2      ASN  14   7.902  -2.825   2.480
  101    HB3  ASN  14           HB1      ASN  14   7.512  -4.383   3.199
  102   HD21  ASN  14          HD21      ASN  14   9.780  -4.063   0.607
  103   HD22  ASN  14          HD22      ASN  14  11.197  -4.400   1.527
  104    H    PHE  15           HN       PHE  15   5.654  -3.011  -0.270
  105    HA   PHE  15           HA       PHE  15   3.644  -3.220   1.754
  106    HB2  PHE  15           HB2      PHE  15   3.502  -1.053   1.122
  107    HB3  PHE  15           HB1      PHE  15   4.464  -1.353  -0.315
  108    HD1  PHE  15           HD1      PHE  15   3.449  -1.618  -2.423
  109    HD2  PHE  15           HD2      PHE  15   1.040  -1.283   1.058
  110    HE1  PHE  15           HE1      PHE  15   1.467  -1.311  -3.836
  111    HE2  PHE  15           HE2      PHE  15  -0.956  -0.971  -0.343
  112    HZ   PHE  15           HZ       PHE  15  -0.744  -0.984  -2.802
  113    H    LEU  16           HN       LEU  16   4.677  -4.534  -1.200
  114    HA   LEU  16           HA       LEU  16   2.160  -5.884  -1.392
  115    HB2  LEU  16           HB2      LEU  16   1.880  -5.232  -3.405
  116    HB3  LEU  16           HB1      LEU  16   2.861  -3.933  -2.933
  117    HG   LEU  16           HG       LEU  16   4.015  -6.253  -4.500
  118   HD11  LEU  16          HD11      LEU  16   3.125  -3.541  -5.465
  119   HD12  LEU  16          HD12      LEU  16   2.360  -5.084  -5.848
  120   HD13  LEU  16          HD13      LEU  16   3.990  -4.742  -6.421
  121   HD21  LEU  16          HD21      LEU  16   5.064  -3.496  -3.891
  122   HD22  LEU  16          HD22      LEU  16   5.849  -4.708  -4.905
  123   HD23  LEU  16          HD23      LEU  16   5.643  -5.004  -3.174
  124    H    VAL  17           HN       VAL  17   4.891  -6.519  -0.277
  125    HA   VAL  17           HA       VAL  17   6.185  -8.214  -2.177
  126    HB   VAL  17           HB       VAL  17   7.432  -6.846  -0.573
  127   HG11  VAL  17          HG11      VAL  17   6.569  -8.782   1.549
  128   HG12  VAL  17          HG12      VAL  17   6.174  -7.082   1.433
  129   HG13  VAL  17          HG13      VAL  17   7.848  -7.577   1.723
  130   HG21  VAL  17          HG21      VAL  17   8.605  -8.532  -1.695
  131   HG22  VAL  17          HG22      VAL  17   8.025  -9.771  -0.594
  132   HG23  VAL  17          HG23      VAL  17   9.144  -8.515  -0.014
  133    H    HIS  18           HN       HIS  18   4.827  -9.028   0.959
  134    HA   HIS  18           HA       HIS  18   4.126 -11.667  -0.160
  135    HB2  HIS  18           HB2      HIS  18   5.118 -11.117   2.669
  136    HB3  HIS  18           HB1      HIS  18   4.381 -12.628   2.149
  137    HD1  HIS  18           HD1      HIS  18   6.067 -14.386   1.637
  138    HD2  HIS  18           HD2      HIS  18   7.400 -10.555   0.961
  139    HE1  HIS  18           HE1      HIS  18   8.439 -14.673   0.866
  140    HE2  HIS  18           HE2      HIS  18   9.185 -12.335   0.262
  141    H    SER  19           HN       SER  19   3.041  -8.984   0.261
  142    HA   SER  19           HA       SER  19   0.989  -9.091   2.145
  143    HB2  SER  19           HB2      SER  19   1.215  -7.398  -0.319
  144    HB3  SER  19           HB1      SER  19   0.319  -7.035   1.163
  145    HG   SER  19           HG       SER  19   2.139  -5.975   1.396
  146    H    SER  20           HN       SER  20   1.538 -10.699  -0.710
  147    HA   SER  20           HA       SER  20  -0.624 -10.745  -2.340
  148    HB2  SER  20           HB2      SER  20   0.968 -13.150  -1.561
  149    HB3  SER  20           HB1      SER  20   0.473 -12.599  -3.170
  150    HG   SER  20           HG       SER  20   2.452 -11.823  -3.192
  151    H    ASN  21           HN       ASN  21  -0.131 -12.020   0.775
  152    HA   ASN  21           HA       ASN  21  -2.150 -13.980   0.839
  153    HB2  ASN  21           HB2      ASN  21  -0.503 -12.608   2.866
  154    HB3  ASN  21           HB1      ASN  21  -1.819 -13.669   3.432
  155   HD21  ASN  21          HD21      ASN  21   1.370 -13.380   2.171
  156   HD22  ASN  21          HD22      ASN  21   1.724 -15.060   2.097
  157    H    ASN  22           HN       ASN  22  -2.094 -10.555   1.423
  158    HA   ASN  22           HA       ASN  22  -4.889 -10.753   2.224
  159    HB2  ASN  22           HB2      ASN  22  -2.627  -9.186   3.092
  160    HB3  ASN  22           HB1      ASN  22  -4.174  -8.322   3.223
  161   HD21  ASN  22          HD21      ASN  22  -2.269 -11.051   4.177
  162   HD22  ASN  22          HD22      ASN  22  -3.203 -11.646   5.479
  163    H    PHE  23           HN       PHE  23  -3.084 -10.407  -0.113
  164    HA   PHE  23           HA       PHE  23  -4.585  -8.451  -1.633
  165    HB2  PHE  23           HB2      PHE  23  -2.067  -9.645  -1.500
  166    HB3  PHE  23           HB1      PHE  23  -2.513  -9.857  -3.134
  167    HD1  PHE  23           HD1      PHE  23  -1.967  -7.591  -0.337
  168    HD2  PHE  23           HD2      PHE  23  -2.416  -7.789  -4.549
  169    HE1  PHE  23           HE1      PHE  23  -1.169  -5.313  -0.492
  170    HE2  PHE  23           HE2      PHE  23  -1.613  -5.463  -4.748
  171    HZ   PHE  23           HZ       PHE  23  -0.982  -4.206  -2.719
  172    H    GLY  24           HN       GLY  24  -4.651 -11.577  -0.631
  173    HA2  GLY  24           HA2      GLY  24  -6.893 -12.467  -1.283
  174    HA3  GLY  24           HA1      GLY  24  -6.310 -12.581  -2.901
  175    H    ALA  25           HN       ALA  25  -5.390 -13.432   0.353
  176    HA   ALA  25           HA       ALA  25  -5.197 -16.216  -0.548
  177    HB1  ALA  25           HB1      ALA  25  -3.853 -14.749   1.716
  178    HB2  ALA  25           HB2      ALA  25  -3.086 -15.539   0.325
  179    HB3  ALA  25           HB3      ALA  25  -3.853 -16.514   1.588
  180    H    ILE  26           HN       ILE  26  -6.016 -14.023   1.976
  181    HA   ILE  26           HA       ILE  26  -7.969 -15.824   2.982
  182    HB   ILE  26           HB       ILE  26  -6.600 -14.817   4.630
  183   HG12  ILE  26          HG12      ILE  26  -9.110 -13.315   4.502
  184   HG13  ILE  26          HG11      ILE  26  -9.058 -14.975   5.103
  185   HG21  ILE  26          HG21      ILE  26  -5.713 -12.939   3.437
  186   HG22  ILE  26          HG22      ILE  26  -6.491 -12.303   4.897
  187   HG23  ILE  26          HG23      ILE  26  -7.305 -12.213   3.326
  188   HD11  ILE  26          HD11      ILE  26  -7.545 -14.169   6.940
  189   HD12  ILE  26          HD12      ILE  26  -9.159 -13.462   7.002
  190   HD13  ILE  26          HD13      ILE  26  -7.809 -12.521   6.368
  191    H    LEU  27           HN       LEU  27  -7.744 -12.654   1.319
  192    HA   LEU  27           HA       LEU  27 -10.372 -11.826   1.787
  193    HB2  LEU  27           HB2      LEU  27  -9.675  -9.948   0.738
  194    HB3  LEU  27           HB1      LEU  27  -8.147 -10.775   0.741
  195    HG   LEU  27           HG       LEU  27  -8.519 -11.460  -1.643
  196   HD11  LEU  27          HD11      LEU  27 -10.144 -10.247  -2.982
  197   HD12  LEU  27          HD12      LEU  27 -10.862  -9.569  -1.510
  198   HD13  LEU  27          HD13      LEU  27 -10.897 -11.316  -1.804
  199   HD21  LEU  27          HD21      LEU  27  -8.002  -9.255  -2.552
  200   HD22  LEU  27          HD22      LEU  27  -7.122  -9.577  -1.060
  201   HD23  LEU  27          HD23      LEU  27  -8.532  -8.514  -1.041
  202    H    SER  28           HN       SER  28  -8.882 -13.607  -0.746
  203    HA   SER  28           HA       SER  28 -10.809 -13.600  -2.543
  204    HB2  SER  28           HB2      SER  28  -9.023 -15.906  -1.899
  205    HB3  SER  28           HB1      SER  28  -9.812 -15.656  -3.467
  206    HG   SER  28           HG       SER  28  -8.420 -14.130  -3.917
  207    H    SER  29           HN       SER  29 -10.621 -15.649   0.331
  208    HA   SER  29           HA       SER  29 -12.117 -16.737   1.575
  209    HB2  SER  29           HB2      SER  29 -14.139 -15.655  -0.305
  210    HB3  SER  29           HB1      SER  29 -14.498 -16.318   1.290
  211    HG   SER  29           HG       SER  29 -13.032 -13.950   0.667
  212    H    THR  30           HN       THR  30 -11.713 -17.524  -1.616
  213    HA   THR  30           HA       THR  30 -13.563 -19.501  -2.091
  214    HB   THR  30           HB       THR  30 -12.304 -18.640  -3.933
  215    HG1  THR  30           HG1      THR  30 -12.084 -20.455  -4.974
  216   HG21  THR  30          HG21      THR  30  -9.829 -19.769  -2.633
  217   HG22  THR  30          HG22      THR  30 -10.236 -18.062  -2.774
  218   HG23  THR  30          HG23      THR  30  -9.882 -19.009  -4.226
  219    H    ASN  31           HN       ASN  31 -10.553 -19.638  -0.439
  220    HA   ASN  31           HA       ASN  31 -10.867 -22.516   0.020
  221    HB2  ASN  31           HB2      ASN  31  -8.672 -22.035  -0.805
  222    HB3  ASN  31           HB1      ASN  31  -8.459 -20.714   0.330
  223   HD21  ASN  31          HD21      ASN  31  -7.709 -21.145   2.319
  224   HD22  ASN  31          HD22      ASN  31  -7.217 -22.715   2.862
  225    H    VAL  32           HN       VAL  32 -11.199 -19.577   1.518
  226    HA   VAL  32           HA       VAL  32 -10.898 -20.305   4.258
  227    HB   VAL  32           HB       VAL  32 -12.780 -18.180   3.182
  228   HG11  VAL  32          HG11      VAL  32 -11.403 -18.425   5.846
  229   HG12  VAL  32          HG12      VAL  32 -13.119 -18.663   5.525
  230   HG13  VAL  32          HG13      VAL  32 -12.401 -17.064   5.329
  231   HG21  VAL  32          HG21      VAL  32  -9.864 -17.926   3.861
  232   HG22  VAL  32          HG22      VAL  32 -10.961 -16.599   3.420
  233   HG23  VAL  32          HG23      VAL  32 -10.612 -17.891   2.262
  234    H    GLY  33           HN       GLY  33 -13.505 -20.444   1.982
  235    HA2  GLY  33           HA2      GLY  33 -14.766 -22.660   2.769
  236    HA3  GLY  33           HA1      GLY  33 -15.332 -21.519   3.978
  237    H    SER  34           HN       SER  34 -14.943 -19.685   1.230
  238    HA   SER  34           HA       SER  34 -17.782 -19.761   0.879
  239    HB2  SER  34           HB2      SER  34 -15.714 -18.020  -0.459
  240    HB3  SER  34           HB1      SER  34 -17.462 -17.768  -0.495
  241    HG   SER  34           HG       SER  34 -16.952 -18.007   2.002
  242    H    ASN  35           HN       ASN  35 -15.104 -21.198  -0.743
  243    HA   ASN  35           HA       ASN  35 -16.897 -21.993  -2.941
  244    HB2  ASN  35           HB2      ASN  35 -14.058 -21.025  -3.220
  245    HB3  ASN  35           HB1      ASN  35 -14.965 -21.807  -4.505
  246   HD21  ASN  35          HD21      ASN  35 -16.468 -20.639  -5.615
  247   HD22  ASN  35          HD22      ASN  35 -16.723 -18.946  -5.405
  248    H    THR  36           HN       THR  36 -15.878 -23.259  -0.466
  249    HA   THR  36           HA       THR  36 -14.012 -25.224  -1.418
  250    HB   THR  36           HB       THR  36 -14.374 -26.185   0.907
  251    HG1  THR  36           HG1      THR  36 -16.459 -24.929   1.003
  252   HG21  THR  36          HG21      THR  36 -13.452 -23.312   0.672
  253   HG22  THR  36          HG22      THR  36 -12.460 -24.741   0.377
  254   HG23  THR  36          HG23      THR  36 -13.064 -24.403   2.000
  255    H    TYC  37           HN       ATY  37 -15.079 -26.339  -2.959
  256    HA   TYC  37           HA       ATY  37 -17.492 -27.749  -2.107
  257    HB1  TYC  37           HB1      ATY  37 -18.050 -27.949  -4.528
  258    HB2  TYC  37           HB2      ATY  37 -16.609 -27.015  -4.911
  259    HD1  TYC  37           HD1      ATY  37 -16.923 -24.766  -5.355
  260    HD2  TYC  37           HD2      ATY  37 -19.583 -26.726  -2.690
  261    HE1  TYC  37           HE1      ATY  37 -18.199 -22.676  -5.086
  262    HE2  TYC  37           HE2      ATY  37 -20.866 -24.664  -2.425
  263    HH   TYC  37           HH       ATY  37 -20.545 -22.043  -4.447
  264   HT21  TYC  37          HT21      ATY  37 -15.481 -28.518  -4.852
  265   HT22  TYC  37          HT22      ATY  37 -14.957 -30.055  -4.265
  Start of MODEL    5
    1    H1   LYS   1           HT1      LYS   1  11.277   5.179   9.755
    2    H2   LYS   1           HT2      LYS   1  11.515   3.895   8.727
    3    H3   LYS   1           HT3      LYS   1  10.144   3.929   9.701
    4    HA   LYS   1           HA       LYS   1   9.667   4.489   7.393
    5    HB2  LYS   1           HB2      LYS   1   9.409   6.855   9.276
    6    HB3  LYS   1           HB1      LYS   1   8.546   6.675   7.758
    7    HG2  LYS   1           HG2      LYS   1   7.480   4.627   8.660
    8    HG3  LYS   1           HG1      LYS   1   8.269   4.942  10.200
    9    HD2  LYS   1           HD2      LYS   1   5.999   5.741  10.282
   10    HD3  LYS   1           HD1      LYS   1   7.090   7.128  10.306
   11    HE2  LYS   1           HE2      LYS   1   6.648   7.563   7.966
   12    HE3  LYS   1           HE1      LYS   1   5.705   6.083   7.828
   13    HZ1  LYS   1           HZ1      LYS   1   5.004   8.474   9.446
   14    HZ2  LYS   1           HZ2      LYS   1   4.099   7.063   9.403
   15    HZ3  LYS   1           HZ3      LYS   1   4.254   7.994   8.023
   16    H    CYS   2           HN       CYS   2  10.135   5.634   5.552
   17    HA   CYS   2           HA       CYS   2  12.197   7.620   5.651
   18    HB2  CYS   2           HB2      CYS   2  13.507   6.331   3.877
   19    HB3  CYS   2           HB1      CYS   2  13.633   5.735   5.533
   20    H    ASN   3           HN       ASN   3  12.559   8.550   3.404
   21    HA   ASN   3           HA       ASN   3  10.129   8.373   1.771
   22    HB2  ASN   3           HB2      ASN   3  11.013  10.823   3.258
   23    HB3  ASN   3           HB1      ASN   3  10.165  10.981   1.729
   24   HD21  ASN   3          HD21      ASN   3   8.514   8.616   2.240
   25   HD22  ASN   3          HD22      ASN   3   7.341   9.123   3.396
   26    H    THR   4           HN       THR   4  13.136   7.915   1.492
   27    HA   THR   4           HA       THR   4  13.545   9.740  -0.747
   28    HB   THR   4           HB       THR   4  15.435   9.556   0.834
   29    HG1  THR   4           HG1      THR   4  16.959   9.365  -0.673
   30   HG21  THR   4          HG21      THR   4  16.666   7.491   1.121
   31   HG22  THR   4          HG22      THR   4  15.571   6.678  -0.004
   32   HG23  THR   4          HG23      THR   4  14.962   7.238   1.544
   33    H    ALA   5           HN       ALA   5  14.372   8.835  -2.711
   34    HA   ALA   5           HA       ALA   5  12.646   6.864  -3.751
   35    HB1  ALA   5           HB1      ALA   5  13.515   8.743  -5.085
   36    HB2  ALA   5           HB2      ALA   5  13.798   7.184  -5.853
   37    HB3  ALA   5           HB3      ALA   5  15.121   8.013  -5.030
   38    H    THR   6           HN       THR   6  15.661   6.671  -2.263
   39    HA   THR   6           HA       THR   6  16.296   4.060  -3.330
   40    HB   THR   6           HB       THR   6  17.569   5.804  -1.219
   41    HG1  THR   6           HG1      THR   6  17.764   5.521  -3.947
   42   HG21  THR   6          HG21      THR   6  19.539   4.311  -1.384
   43   HG22  THR   6          HG22      THR   6  18.611   3.230  -2.444
   44   HG23  THR   6          HG23      THR   6  18.103   3.487  -0.769
   45    H    CYS   7           HN       CYS   7  14.193   5.172  -0.925
   46    HA   CYS   7           HA       CYS   7  14.560   2.692   0.659
   47    HB2  CYS   7           HB2      CYS   7  15.380   4.917   1.601
   48    HB3  CYS   7           HB1      CYS   7  13.730   5.266   1.777
   49    H    ALA   8           HN       ALA   8  12.324   5.355  -0.107
   50    HA   ALA   8           HA       ALA   8  10.111   4.134   1.106
   51    HB1  ALA   8           HB1      ALA   8   8.819   5.818  -0.096
   52    HB2  ALA   8           HB2      ALA   8  10.257   6.224  -1.061
   53    HB3  ALA   8           HB3      ALA   8  10.243   6.510   0.680
   54    H    THR   9           HN       THR   9  11.756   3.719  -1.789
   55    HA   THR   9           HA       THR   9   9.727   2.491  -3.383
   56    HB   THR   9           HB       THR   9  11.803   1.554  -4.548
   57    HG1  THR   9           HG1      THR   9  13.667   2.917  -3.921
   58   HG21  THR   9          HG21      THR   9  11.411   4.538  -4.249
   59   HG22  THR   9          HG22      THR   9  10.513   3.490  -5.350
   60   HG23  THR   9          HG23      THR   9  12.245   3.746  -5.585
   61    H    GLN  10           HN       GLN  10  11.927   1.510  -1.030
   62    HA   GLN  10           HA       GLN  10  11.696  -1.329  -1.417
   63    HB2  GLN  10           HB2      GLN  10  12.716   0.122   1.029
   64    HB3  GLN  10           HB1      GLN  10  13.048  -1.554   0.580
   65    HG2  GLN  10           HG2      GLN  10  14.011   0.946  -0.787
   66    HG3  GLN  10           HG1      GLN  10  14.967  -0.217   0.128
   67   HE21  GLN  10          HE21      GLN  10  15.055   0.759  -2.618
   68   HE22  GLN  10          HE22      GLN  10  15.091  -0.653  -3.620
   69    H    ARG  11           HN       ARG  11  10.373   1.161   0.537
   70    HA   ARG  11           HA       ARG  11   8.684  -0.466   2.136
   71    HB2  ARG  11           HB2      ARG  11   8.131   2.369   1.226
   72    HB3  ARG  11           HB1      ARG  11   7.371   1.552   2.580
   73    HG2  ARG  11           HG2      ARG  11  10.222   2.450   2.344
   74    HG3  ARG  11           HG1      ARG  11   8.998   3.075   3.445
   75    HD2  ARG  11           HD2      ARG  11  10.301   0.405   3.396
   76    HD3  ARG  11           HD1      ARG  11  10.466   1.648   4.639
   77    HE   ARG  11           HE       ARG  11   7.878   1.167   4.854
   78   HH11  ARG  11          HH11      ARG  11  10.490  -1.170   4.474
   79   HH12  ARG  11          HH12      ARG  11   9.659  -2.479   5.159
   80   HH21  ARG  11          HH21      ARG  11   6.695  -0.643   5.858
   81   HH22  ARG  11          HH22      ARG  11   7.466  -2.157   6.014
   82    H    LEU  12           HN       LEU  12   8.334   1.036  -1.013
   83    HA   LEU  12           HA       LEU  12   5.737   0.257  -1.621
   84    HB2  LEU  12           HB2      LEU  12   8.220   0.721  -3.123
   85    HB3  LEU  12           HB1      LEU  12   6.857   0.286  -4.027
   86    HG   LEU  12           HG       LEU  12   7.274   2.806  -2.402
   87   HD11  LEU  12          HD11      LEU  12   6.915   3.932  -4.531
   88   HD12  LEU  12          HD12      LEU  12   6.653   2.381  -5.318
   89   HD13  LEU  12          HD13      LEU  12   8.236   2.772  -4.663
   90   HD21  LEU  12          HD21      LEU  12   4.974   2.105  -2.000
   91   HD22  LEU  12          HD22      LEU  12   4.716   1.894  -3.729
   92   HD23  LEU  12          HD23      LEU  12   5.003   3.504  -3.073
   93    H    ALA  13           HN       ALA  13   8.846  -1.345  -1.939
   94    HA   ALA  13           HA       ALA  13   7.900  -3.616  -3.218
   95    HB1  ALA  13           HB1      ALA  13  10.324  -3.353  -1.434
   96    HB2  ALA  13           HB2      ALA  13  10.275  -3.056  -3.170
   97    HB3  ALA  13           HB3      ALA  13  10.025  -4.686  -2.550
   98    H    ASN  14           HN       ASN  14   8.063  -2.668   0.119
   99    HA   ASN  14           HA       ASN  14   7.328  -5.258   1.165
  100    HB2  ASN  14           HB2      ASN  14   7.613  -2.588   2.542
  101    HB3  ASN  14           HB1      ASN  14   7.033  -4.037   3.354
  102   HD21  ASN  14          HD21      ASN  14   9.521  -4.081   0.949
  103   HD22  ASN  14          HD22      ASN  14  10.833  -4.460   1.997
  104    H    PHE  15           HN       PHE  15   5.602  -2.957  -0.424
  105    HA   PHE  15           HA       PHE  15   3.275  -3.031   1.256
  106    HB2  PHE  15           HB2      PHE  15   3.284  -0.891   0.468
  107    HB3  PHE  15           HB1      PHE  15   4.456  -1.297  -0.772
  108    HD1  PHE  15           HD1      PHE  15   0.899  -0.907   0.006
  109    HD2  PHE  15           HD2      PHE  15   3.737  -1.907  -2.994
  110    HE1  PHE  15           HE1      PHE  15  -0.837  -0.688  -1.716
  111    HE2  PHE  15           HE2      PHE  15   2.029  -1.700  -4.715
  112    HZ   PHE  15           HZ       PHE  15  -0.286  -1.079  -4.085
  113    H    LEU  16           HN       LEU  16   4.814  -4.623  -1.314
  114    HA   LEU  16           HA       LEU  16   2.376  -6.000  -1.875
  115    HB2  LEU  16           HB2      LEU  16   2.411  -5.458  -3.925
  116    HB3  LEU  16           HB1      LEU  16   3.276  -4.101  -3.390
  117    HG   LEU  16           HG       LEU  16   4.638  -6.464  -4.729
  118   HD11  LEU  16          HD11      LEU  16   4.928  -4.946  -6.615
  119   HD12  LEU  16          HD12      LEU  16   3.972  -3.722  -5.783
  120   HD13  LEU  16          HD13      LEU  16   3.221  -5.235  -6.285
  121   HD21  LEU  16          HD21      LEU  16   6.572  -4.991  -4.852
  122   HD22  LEU  16          HD22      LEU  16   6.077  -5.230  -3.169
  123   HD23  LEU  16          HD23      LEU  16   5.668  -3.732  -4.009
  124    H    VAL  17           HN       VAL  17   4.655  -6.633  -0.156
  125    HA   VAL  17           HA       VAL  17   6.282  -8.492  -1.676
  126    HB   VAL  17           HB       VAL  17   7.461  -6.944  -0.161
  127   HG11  VAL  17          HG11      VAL  17   7.406  -7.189   2.249
  128   HG12  VAL  17          HG12      VAL  17   6.186  -8.444   2.088
  129   HG13  VAL  17          HG13      VAL  17   5.796  -6.788   1.627
  130   HG21  VAL  17          HG21      VAL  17   8.927  -8.523   0.918
  131   HG22  VAL  17          HG22      VAL  17   8.494  -9.059  -0.718
  132   HG23  VAL  17          HG23      VAL  17   7.722  -9.793   0.697
  133    H    HIS  18           HN       HIS  18   4.127  -8.552   1.068
  134    HA   HIS  18           HA       HIS  18   3.659 -11.360   0.597
  135    HB2  HIS  18           HB2      HIS  18   3.826 -11.890   2.837
  136    HB3  HIS  18           HB1      HIS  18   5.372 -11.167   2.404
  137    HD1  HIS  18           HD1      HIS  18   3.728 -11.454   5.320
  138    HD2  HIS  18           HD2      HIS  18   4.507  -8.061   3.099
  139    HE1  HIS  18           HE1      HIS  18   3.657  -9.565   6.960
  140    HE2  HIS  18           HE2      HIS  18   3.712  -7.544   5.497
  141    H    SER  19           HN       SER  19   2.398  -8.662   0.254
  142    HA   SER  19           HA       SER  19   0.566  -8.306   2.351
  143    HB2  SER  19           HB2      SER  19   0.689  -7.008  -0.330
  144    HB3  SER  19           HB1      SER  19  -0.065  -6.394   1.143
  145    HG   SER  19           HG       SER  19   1.814  -5.458   1.248
  146    H    SER  20           HN       SER  20   0.437  -9.672  -0.838
  147    HA   SER  20           HA       SER  20  -2.386  -9.723  -1.029
  148    HB2  SER  20           HB2      SER  20  -0.327 -11.408  -2.421
  149    HB3  SER  20           HB1      SER  20  -2.017 -11.262  -2.916
  150    HG   SER  20           HG       SER  20  -1.598  -9.459  -3.814
  151    H    ASN  21           HN       ASN  21  -0.724 -11.204   1.197
  152    HA   ASN  21           HA       ASN  21  -2.562 -13.469   1.442
  153    HB2  ASN  21           HB2      ASN  21   0.338 -13.201   1.973
  154    HB3  ASN  21           HB1      ASN  21  -0.610 -14.486   2.757
  155   HD21  ASN  21          HD21      ASN  21   1.021 -13.423  -0.100
  156   HD22  ASN  21          HD22      ASN  21   0.690 -14.816  -1.049
  157    H    ASN  22           HN       ASN  22  -1.773 -10.460   2.633
  158    HA   ASN  22           HA       ASN  22  -2.172 -11.160   5.437
  159    HB2  ASN  22           HB2      ASN  22   0.134 -10.129   4.122
  160    HB3  ASN  22           HB1      ASN  22  -0.519  -9.125   5.430
  161   HD21  ASN  22          HD21      ASN  22  -1.017 -12.547   5.342
  162   HD22  ASN  22          HD22      ASN  22   0.039 -12.970   6.599
  163    H    PHE  23           HN       PHE  23  -2.152  -8.809   2.970
  164    HA   PHE  23           HA       PHE  23  -2.604  -6.507   4.268
  165    HB2  PHE  23           HB2      PHE  23  -3.391  -5.646   2.101
  166    HB3  PHE  23           HB1      PHE  23  -1.952  -6.645   2.024
  167    HD1  PHE  23           HD1      PHE  23  -4.165  -9.042   2.365
  168    HD2  PHE  23           HD2      PHE  23  -3.125  -6.047  -0.381
  169    HE1  PHE  23           HE1      PHE  23  -5.150 -10.422   0.528
  170    HE2  PHE  23           HE2      PHE  23  -4.037  -7.342  -2.222
  171    HZ   PHE  23           HZ       PHE  23  -5.079  -9.550  -1.794
  172    H    GLY  24           HN       GLY  24  -3.836  -6.405   5.798
  173    HA2  GLY  24           HA2      GLY  24  -5.618  -6.296   7.142
  174    HA3  GLY  24           HA1      GLY  24  -6.656  -5.872   5.823
  175    H    ALA  25           HN       ALA  25  -4.784  -8.775   6.095
  176    HA   ALA  25           HA       ALA  25  -7.175 -10.366   6.425
  177    HB1  ALA  25           HB1      ALA  25  -4.356 -11.120   5.661
  178    HB2  ALA  25           HB2      ALA  25  -5.683 -10.877   4.534
  179    HB3  ALA  25           HB3      ALA  25  -5.734 -12.231   5.683
  180    H    ILE  26           HN       ILE  26  -4.020  -9.652   7.560
  181    HA   ILE  26           HA       ILE  26  -4.596 -10.972   9.992
  182    HB   ILE  26           HB       ILE  26  -2.395 -11.498   9.293
  183   HG12  ILE  26          HG12      ILE  26  -2.093  -9.170  11.066
  184   HG13  ILE  26          HG11      ILE  26  -2.536 -10.757  11.689
  185   HG21  ILE  26          HG21      ILE  26  -2.004  -8.570   8.716
  186   HG22  ILE  26          HG22      ILE  26  -2.129  -9.864   7.529
  187   HG23  ILE  26          HG23      ILE  26  -0.729  -9.781   8.597
  188   HD11  ILE  26          HD11      ILE  26  -0.323 -11.605  10.848
  189   HD12  ILE  26          HD12      ILE  26  -0.160 -10.371  12.098
  190   HD13  ILE  26          HD13      ILE  26   0.090  -9.951  10.403
  191    H    LEU  27           HN       LEU  27  -3.864  -7.857   8.628
  192    HA   LEU  27           HA       LEU  27  -3.837  -6.226  10.892
  193    HB2  LEU  27           HB2      LEU  27  -2.949  -5.114   9.148
  194    HB3  LEU  27           HB1      LEU  27  -3.879  -6.066   8.025
  195    HG   LEU  27           HG       LEU  27  -5.781  -4.503   8.288
  196   HD11  LEU  27          HD11      LEU  27  -3.882  -2.801   9.857
  197   HD12  LEU  27          HD12      LEU  27  -5.324  -3.654  10.464
  198   HD13  LEU  27          HD13      LEU  27  -5.498  -2.385   9.244
  199   HD21  LEU  27          HD21      LEU  27  -4.802  -2.704   6.991
  200   HD22  LEU  27          HD22      LEU  27  -4.241  -4.289   6.459
  201   HD23  LEU  27          HD23      LEU  27  -3.189  -3.264   7.433
  202    H    SER  28           HN       SER  28  -6.368  -7.114   8.698
  203    HA   SER  28           HA       SER  28  -8.255  -5.733  10.440
  204    HB2  SER  28           HB2      SER  28  -8.477  -6.351   7.531
  205    HB3  SER  28           HB1      SER  28  -9.699  -5.560   8.532
  206    HG   SER  28           HG       SER  28  -8.050  -3.988   9.030
  207    H    SER  29           HN       SER  29  -7.268  -8.644   9.677
  208    HA   SER  29           HA       SER  29  -7.869 -10.767  10.205
  209    HB2  SER  29           HB2      SER  29 -10.338  -9.535  11.465
  210    HB3  SER  29           HB1      SER  29  -9.702 -11.153  11.773
  211    HG   SER  29           HG       SER  29  -9.154  -9.421  13.299
  212    H    THR  30           HN       THR  30  -8.931  -9.217   7.779
  213    HA   THR  30           HA       THR  30 -10.139  -9.387   5.987
  214    HB   THR  30           HB       THR  30  -8.683 -11.248   5.485
  215    HG1  THR  30           HG1      THR  30 -11.217 -12.175   4.715
  216   HG21  THR  30          HG21      THR  30 -10.699 -13.083   6.794
  217   HG22  THR  30          HG22      THR  30  -9.107 -12.663   7.421
  218   HG23  THR  30          HG23      THR  30  -9.241 -13.594   5.926
  219    H    ASN  31           HN       ASN  31 -11.717  -9.888   8.635
  220    HA   ASN  31           HA       ASN  31 -14.262 -10.145   7.246
  221    HB2  ASN  31           HB2      ASN  31 -13.536 -11.335   9.939
  222    HB3  ASN  31           HB1      ASN  31 -15.189 -11.182   9.363
  223   HD21  ASN  31          HD21      ASN  31 -13.589 -13.534  10.036
  224   HD22  ASN  31          HD22      ASN  31 -13.631 -14.553   8.634
  225    H    VAL  32           HN       VAL  32 -14.266  -8.061   7.064
  226    HA   VAL  32           HA       VAL  32 -14.304  -6.392   9.477
  227    HB   VAL  32           HB       VAL  32 -13.795  -5.673   6.587
  228   HG11  VAL  32          HG11      VAL  32 -14.666  -3.764   7.837
  229   HG12  VAL  32          HG12      VAL  32 -12.962  -3.516   7.455
  230   HG13  VAL  32          HG13      VAL  32 -13.440  -4.001   9.080
  231   HG21  VAL  32          HG21      VAL  32 -12.017  -7.052   7.437
  232   HG22  VAL  32          HG22      VAL  32 -11.831  -5.994   8.835
  233   HG23  VAL  32          HG23      VAL  32 -11.453  -5.397   7.217
  234    H    GLY  33           HN       GLY  33 -16.186  -7.823   7.111
  235    HA2  GLY  33           HA2      GLY  33 -18.565  -7.548   7.109
  236    HA3  GLY  33           HA1      GLY  33 -18.322  -5.843   7.494
  237    H    SER  34           HN       SER  34 -15.966  -6.375   5.406
  238    HA   SER  34           HA       SER  34 -17.406  -5.257   3.174
  239    HB2  SER  34           HB2      SER  34 -14.479  -5.998   3.454
  240    HB3  SER  34           HB1      SER  34 -15.197  -5.008   2.183
  241    HG   SER  34           HG       SER  34 -14.566  -3.521   3.522
  242    H    ASN  35           HN       ASN  35 -17.172  -8.147   4.324
  243    HA   ASN  35           HA       ASN  35 -16.525  -9.857   2.126
  244    HB2  ASN  35           HB2      ASN  35 -18.220 -10.438   4.564
  245    HB3  ASN  35           HB1      ASN  35 -17.404 -11.623   3.545
  246   HD21  ASN  35          HD21      ASN  35 -15.124 -11.859   3.775
  247   HD22  ASN  35          HD22      ASN  35 -14.305 -11.245   5.162
  248    H    THR  36           HN       THR  36 -19.008  -7.755   2.693
  249    HA   THR  36           HA       THR  36 -21.214  -9.262   1.678
  250    HB   THR  36           HB       THR  36 -22.277  -6.920   1.843
  251    HG1  THR  36           HG1      THR  36 -20.279  -6.152   3.583
  252   HG21  THR  36          HG21      THR  36 -22.407  -7.027   4.308
  253   HG22  THR  36          HG22      THR  36 -21.068  -8.175   4.325
  254   HG23  THR  36          HG23      THR  36 -22.608  -8.624   3.594
  255    H    TYC  37           HN       ATY  37 -18.689  -7.743   0.404
  256    HA   TYC  37           HA       ATY  37 -19.978  -6.628  -1.948
  257    HB1  TYC  37           HB1      ATY  37 -17.588  -6.210  -2.740
  258    HB2  TYC  37           HB2      ATY  37 -17.069  -6.764  -1.155
  259    HD1  TYC  37           HD1      ATY  37 -18.426  -4.016  -3.054
  260    HD2  TYC  37           HD2      ATY  37 -17.706  -5.451   0.883
  261    HE1  TYC  37           HE1      ATY  37 -18.689  -1.732  -2.182
  262    HE2  TYC  37           HE2      ATY  37 -17.973  -3.172   1.767
  263    HH   TYC  37           HH       ATY  37 -19.220  -0.606  -0.145
  264   HT21  TYC  37          HT21      ATY  37 -17.129  -8.686  -1.944
  265   HT22  TYC  37          HT22      ATY  37 -17.722  -9.793  -3.129
  Start of MODEL    6
    1    H1   LYS   1           HT1      LYS   1  11.478   6.247   9.909
    2    H2   LYS   1           HT2      LYS   1  11.983   4.735   9.404
    3    H3   LYS   1           HT3      LYS   1  10.511   4.884  10.219
    4    HA   LYS   1           HA       LYS   1  10.219   4.537   7.855
    5    HB2  LYS   1           HB2      LYS   1   8.753   6.424   7.375
    6    HB3  LYS   1           HB1      LYS   1   8.582   5.991   9.067
    7    HG2  LYS   1           HG2      LYS   1   9.953   7.878   9.725
    8    HG3  LYS   1           HG1      LYS   1  10.267   8.268   8.035
    9    HD2  LYS   1           HD2      LYS   1   7.842   8.644   7.709
   10    HD3  LYS   1           HD1      LYS   1   7.590   8.338   9.427
   11    HE2  LYS   1           HE2      LYS   1   8.998  10.219   9.998
   12    HE3  LYS   1           HE1      LYS   1   9.349  10.509   8.294
   13    HZ1  LYS   1           HZ1      LYS   1   7.690  12.017   9.096
   14    HZ2  LYS   1           HZ2      LYS   1   6.690  10.766   9.610
   15    HZ3  LYS   1           HZ3      LYS   1   6.981  11.000   7.966
   16    H    CYS   2           HN       CYS   2  10.243   5.975   5.702
   17    HA   CYS   2           HA       CYS   2  12.520   7.658   5.533
   18    HB2  CYS   2           HB2      CYS   2  13.507   6.243   3.682
   19    HB3  CYS   2           HB1      CYS   2  13.761   5.670   5.336
   20    H    ASN   3           HN       ASN   3  12.758   8.531   3.312
   21    HA   ASN   3           HA       ASN   3  10.232   8.490   1.845
   22    HB2  ASN   3           HB2      ASN   3   9.975  10.917   2.011
   23    HB3  ASN   3           HB1      ASN   3   9.936  10.161   3.594
   24   HD21  ASN   3          HD21      ASN   3  11.580  12.365   1.546
   25   HD22  ASN   3          HD22      ASN   3  12.755  12.900   2.692
   26    H    THR   4           HN       THR   4  13.232   7.948   1.435
   27    HA   THR   4           HA       THR   4  13.666   9.772  -0.814
   28    HB   THR   4           HB       THR   4  15.585   9.620   0.722
   29    HG1  THR   4           HG1      THR   4  16.724   9.790  -1.038
   30   HG21  THR   4          HG21      THR   4  15.157   7.364   1.606
   31   HG22  THR   4          HG22      THR   4  16.816   7.533   1.033
   32   HG23  THR   4          HG23      THR   4  15.623   6.678   0.053
   33    H    ALA   5           HN       ALA   5  14.671   8.707  -2.722
   34    HA   ALA   5           HA       ALA   5  12.872   6.751  -3.777
   35    HB1  ALA   5           HB1      ALA   5  14.188   6.897  -5.833
   36    HB2  ALA   5           HB2      ALA   5  15.430   7.814  -4.976
   37    HB3  ALA   5           HB3      ALA   5  13.819   8.498  -5.196
   38    H    THR   6           HN       THR   6  15.836   6.607  -2.160
   39    HA   THR   6           HA       THR   6  16.597   3.995  -3.033
   40    HB   THR   6           HB       THR   6  17.440   5.595  -0.608
   41    HG1  THR   6           HG1      THR   6  18.891   5.381  -3.007
   42   HG21  THR   6          HG21      THR   6  18.783   3.295  -2.058
   43   HG22  THR   6          HG22      THR   6  18.069   3.249  -0.452
   44   HG23  THR   6          HG23      THR   6  19.511   4.228  -0.741
   45    H    CYS   7           HN       CYS   7  14.169   5.171  -0.917
   46    HA   CYS   7           HA       CYS   7  14.291   2.643   0.598
   47    HB2  CYS   7           HB2      CYS   7  15.275   4.682   1.602
   48    HB3  CYS   7           HB1      CYS   7  13.662   5.227   1.802
   49    H    ALA   8           HN       ALA   8  12.253   5.436  -0.306
   50    HA   ALA   8           HA       ALA   8   9.900   4.466   0.851
   51    HB1  ALA   8           HB1      ALA   8  10.161   6.760   0.120
   52    HB2  ALA   8           HB2      ALA   8   8.768   6.016  -0.675
   53    HB3  ALA   8           HB3      ALA   8  10.284   6.239  -1.563
   54    H    THR   9           HN       THR   9  11.666   3.764  -1.914
   55    HA   THR   9           HA       THR   9   9.701   2.465  -3.533
   56    HB   THR   9           HB       THR   9  11.762   1.457  -4.551
   57    HG1  THR   9           HG1      THR   9  13.683   2.760  -3.822
   58   HG21  THR   9          HG21      THR   9  12.405   3.620  -5.586
   59   HG22  THR   9          HG22      THR   9  11.518   4.467  -4.318
   60   HG23  THR   9          HG23      THR   9  10.656   3.437  -5.461
   61    H    GLN  10           HN       GLN  10  11.820   1.567  -1.054
   62    HA   GLN  10           HA       GLN  10  11.599  -1.287  -1.283
   63    HB2  GLN  10           HB2      GLN  10  12.454   0.286   1.152
   64    HB3  GLN  10           HB1      GLN  10  12.817  -1.398   0.803
   65    HG2  GLN  10           HG2      GLN  10  13.828   1.003  -0.691
   66    HG3  GLN  10           HG1      GLN  10  14.748  -0.010   0.418
   67   HE21  GLN  10          HE21      GLN  10  15.001   0.691  -2.399
   68   HE22  GLN  10          HE22      GLN  10  15.191  -0.786  -3.255
   69    H    ARG  11           HN       ARG  11  10.177   1.272   0.519
   70    HA   ARG  11           HA       ARG  11   8.527  -0.296   2.230
   71    HB2  ARG  11           HB2      ARG  11   7.796   2.424   1.109
   72    HB3  ARG  11           HB1      ARG  11   7.230   1.709   2.605
   73    HG2  ARG  11           HG2      ARG  11  10.034   2.651   2.048
   74    HG3  ARG  11           HG1      ARG  11   8.822   3.510   2.996
   75    HD2  ARG  11           HD2      ARG  11  10.069   0.847   3.618
   76    HD3  ARG  11           HD1      ARG  11  10.377   2.400   4.410
   77    HE   ARG  11           HE       ARG  11   7.631   1.797   4.531
   78   HH11  ARG  11          HH11      ARG  11  10.681   0.851   6.070
   79   HH12  ARG  11          HH12      ARG  11   9.965   0.309   7.502
   80   HH21  ARG  11          HH21      ARG  11   6.637   1.069   6.426
   81   HH22  ARG  11          HH22      ARG  11   7.536   0.430   7.730
   82    H    LEU  12           HN       LEU  12   8.123   1.126  -0.947
   83    HA   LEU  12           HA       LEU  12   5.545   0.310  -1.597
   84    HB2  LEU  12           HB2      LEU  12   8.047   0.808  -3.033
   85    HB3  LEU  12           HB1      LEU  12   6.727   0.417  -4.002
   86    HG   LEU  12           HG       LEU  12   7.120   2.882  -2.287
   87   HD11  LEU  12          HD11      LEU  12   8.093   2.918  -4.531
   88   HD12  LEU  12          HD12      LEU  12   6.776   4.073  -4.370
   89   HD13  LEU  12          HD13      LEU  12   6.510   2.549  -5.212
   90   HD21  LEU  12          HD21      LEU  12   4.831   2.194  -1.918
   91   HD22  LEU  12          HD22      LEU  12   4.573   2.036  -3.655
   92   HD23  LEU  12          HD23      LEU  12   4.872   3.624  -2.948
   93    H    ALA  13           HN       ALA  13   8.660  -1.292  -1.802
   94    HA   ALA  13           HA       ALA  13   7.705  -3.525  -3.189
   95    HB1  ALA  13           HB1      ALA  13  10.195  -3.289  -1.497
   96    HB2  ALA  13           HB2      ALA  13  10.072  -2.919  -3.216
   97    HB3  ALA  13           HB3      ALA  13   9.862  -4.577  -2.654
   98    H    ASN  14           HN       ASN  14   7.948  -2.658   0.154
   99    HA   ASN  14           HA       ASN  14   7.441  -5.314   1.221
  100    HB2  ASN  14           HB2      ASN  14   7.565  -2.621   2.589
  101    HB3  ASN  14           HB1      ASN  14   7.199  -4.123   3.423
  102   HD21  ASN  14          HD21      ASN  14   9.547  -3.964   0.870
  103   HD22  ASN  14          HD22      ASN  14  10.948  -4.154   1.840
  104    H    PHE  15           HN       PHE  15   5.534  -3.021  -0.196
  105    HA   PHE  15           HA       PHE  15   3.282  -3.407   1.537
  106    HB2  PHE  15           HB2      PHE  15   3.009  -1.249   0.915
  107    HB3  PHE  15           HB1      PHE  15   4.247  -1.395  -0.311
  108    HD1  PHE  15           HD1      PHE  15   3.650  -1.938  -2.593
  109    HD2  PHE  15           HD2      PHE  15   0.673  -1.339   0.379
  110    HE1  PHE  15           HE1      PHE  15   1.999  -1.665  -4.344
  111    HE2  PHE  15           HE2      PHE  15  -1.027  -1.052  -1.377
  112    HZ   PHE  15           HZ       PHE  15  -0.377  -1.208  -3.748
  113    H    LEU  16           HN       LEU  16   4.783  -4.711  -1.198
  114    HA   LEU  16           HA       LEU  16   2.386  -6.163  -1.853
  115    HB2  LEU  16           HB2      LEU  16   2.318  -5.279  -3.771
  116    HB3  LEU  16           HB1      LEU  16   3.426  -4.131  -3.209
  117    HG   LEU  16           HG       LEU  16   4.429  -6.554  -4.717
  118   HD11  LEU  16          HD11      LEU  16   2.942  -5.266  -6.166
  119   HD12  LEU  16          HD12      LEU  16   4.626  -5.040  -6.649
  120   HD13  LEU  16          HD13      LEU  16   3.793  -3.786  -5.727
  121   HD21  LEU  16          HD21      LEU  16   6.415  -5.113  -5.010
  122   HD22  LEU  16          HD22      LEU  16   6.063  -5.421  -3.306
  123   HD23  LEU  16          HD23      LEU  16   5.616  -3.881  -4.029
  124    H    VAL  17           HN       VAL  17   4.843  -6.776  -0.282
  125    HA   VAL  17           HA       VAL  17   6.697  -8.230  -1.932
  126    HB   VAL  17           HB       VAL  17   7.539  -6.927  -0.082
  127   HG11  VAL  17          HG11      VAL  17   7.112  -7.536   2.274
  128   HG12  VAL  17          HG12      VAL  17   5.943  -8.747   1.700
  129   HG13  VAL  17          HG13      VAL  17   5.634  -7.061   1.421
  130   HG21  VAL  17          HG21      VAL  17   8.961  -8.576   1.031
  131   HG22  VAL  17          HG22      VAL  17   8.834  -8.897  -0.702
  132   HG23  VAL  17          HG23      VAL  17   7.909  -9.867   0.452
  133    H    HIS  18           HN       HIS  18   4.416  -9.034   0.545
  134    HA   HIS  18           HA       HIS  18   4.214 -11.711  -0.527
  135    HB2  HIS  18           HB2      HIS  18   3.999 -12.567   1.659
  136    HB3  HIS  18           HB1      HIS  18   5.625 -11.896   1.506
  137    HD1  HIS  18           HD1      HIS  18   4.471 -12.554   4.288
  138    HD2  HIS  18           HD2      HIS  18   3.999  -8.844   2.498
  139    HE1  HIS  18           HE1      HIS  18   4.093 -10.954   6.160
  140    HE2  HIS  18           HE2      HIS  18   3.514  -8.795   5.026
  141    H    SER  19           HN       SER  19   2.959  -9.189  -0.772
  142    HA   SER  19           HA       SER  19   0.464  -9.586   0.640
  143    HB2  SER  19           HB2      SER  19   1.723  -7.175  -0.477
  144    HB3  SER  19           HB1      SER  19   0.160  -7.197   0.315
  145    HG   SER  19           HG       SER  19   1.156  -7.462   2.233
  146    H    SER  20           HN       SER  20   1.516 -10.511  -1.981
  147    HA   SER  20           HA       SER  20   0.671  -9.064  -4.171
  148    HB2  SER  20           HB2      SER  20   1.018 -12.042  -3.984
  149    HB3  SER  20           HB1      SER  20   1.180 -11.035  -5.428
  150    HG   SER  20           HG       SER  20   2.943 -10.055  -4.572
  151    H    ASN  21           HN       ASN  21  -1.111 -10.925  -2.027
  152    HA   ASN  21           HA       ASN  21  -3.487 -11.091  -3.771
  153    HB2  ASN  21           HB2      ASN  21  -2.400 -12.809  -1.613
  154    HB3  ASN  21           HB1      ASN  21  -4.087 -12.995  -2.136
  155   HD21  ASN  21          HD21      ASN  21  -0.773 -13.590  -2.757
  156   HD22  ASN  21          HD22      ASN  21  -0.957 -14.576  -4.166
  157    H    ASN  22           HN       ASN  22  -2.350  -9.028  -1.687
  158    HA   ASN  22           HA       ASN  22  -4.588  -8.993   0.178
  159    HB2  ASN  22           HB2      ASN  22  -1.806  -9.471   0.632
  160    HB3  ASN  22           HB1      ASN  22  -2.436  -8.144   1.590
  161   HD21  ASN  22          HD21      ASN  22  -4.381 -10.812   0.460
  162   HD22  ASN  22          HD22      ASN  22  -4.608 -11.555   1.972
  163    H    PHE  23           HN       PHE  23  -1.931  -7.405  -1.270
  164    HA   PHE  23           HA       PHE  23  -2.181  -5.008  -0.015
  165    HB2  PHE  23           HB2      PHE  23  -0.413  -4.269  -1.397
  166    HB3  PHE  23           HB1      PHE  23  -0.315  -6.006  -1.233
  167    HD1  PHE  23           HD1      PHE  23  -0.647  -3.377  -3.651
  168    HD2  PHE  23           HD2      PHE  23  -0.908  -7.385  -2.738
  169    HE1  PHE  23           HE1      PHE  23  -0.395  -3.889  -6.069
  170    HE2  PHE  23           HE2      PHE  23  -0.671  -8.045  -4.921
  171    HZ   PHE  23           HZ       PHE  23  -0.401  -6.268  -6.787
  172    H    GLY  24           HN       GLY  24  -3.751  -3.963   0.114
  173    HA2  GLY  24           HA2      GLY  24  -5.570  -2.722  -0.207
  174    HA3  GLY  24           HA1      GLY  24  -5.156  -2.365  -1.853
  175    H    ALA  25           HN       ALA  25  -5.606  -5.526  -0.537
  176    HA   ALA  25           HA       ALA  25  -8.169  -5.786  -1.880
  177    HB1  ALA  25           HB1      ALA  25  -7.758  -8.232  -1.546
  178    HB2  ALA  25           HB2      ALA  25  -6.230  -7.814  -0.766
  179    HB3  ALA  25           HB3      ALA  25  -6.469  -7.446  -2.474
  180    H    ILE  26           HN       ILE  26  -6.321  -6.429   0.952
  181    HA   ILE  26           HA       ILE  26  -8.642  -6.557   2.543
  182    HB   ILE  26           HB       ILE  26  -7.067  -8.266   3.065
  183   HG12  ILE  26          HG12      ILE  26  -6.572  -6.116   4.976
  184   HG13  ILE  26          HG11      ILE  26  -8.097  -6.994   5.019
  185   HG21  ILE  26          HG21      ILE  26  -5.093  -7.380   2.036
  186   HG22  ILE  26          HG22      ILE  26  -4.693  -7.682   3.739
  187   HG23  ILE  26          HG23      ILE  26  -5.070  -6.047   3.169
  188   HD11  ILE  26          HD11      ILE  26  -6.737  -9.089   5.474
  189   HD12  ILE  26          HD12      ILE  26  -6.634  -7.883   6.758
  190   HD13  ILE  26          HD13      ILE  26  -5.311  -8.060   5.605
  191    H    LEU  27           HN       LEU  27  -5.800  -4.527   1.978
  192    HA   LEU  27           HA       LEU  27  -6.113  -2.717   4.071
  193    HB2  LEU  27           HB2      LEU  27  -4.126  -2.091   3.119
  194    HB3  LEU  27           HB1      LEU  27  -4.587  -3.001   1.704
  195    HG   LEU  27           HG       LEU  27  -5.579  -0.978   0.687
  196   HD11  LEU  27          HD11      LEU  27  -4.525   0.509   3.062
  197   HD12  LEU  27          HD12      LEU  27  -6.223   0.253   2.569
  198   HD13  LEU  27          HD13      LEU  27  -5.136   1.181   1.533
  199   HD21  LEU  27          HD21      LEU  27  -3.295  -1.583   0.176
  200   HD22  LEU  27          HD22      LEU  27  -2.722  -0.671   1.572
  201   HD23  LEU  27          HD23      LEU  27  -3.481   0.169   0.220
  202    H    SER  28           HN       SER  28  -7.307  -2.732   0.835
  203    HA   SER  28           HA       SER  28  -8.844  -0.372   1.289
  204    HB2  SER  28           HB2      SER  28  -8.787  -2.296  -0.987
  205    HB3  SER  28           HB1      SER  28  -9.639  -0.741  -1.033
  206    HG   SER  28           HG       SER  28  -7.502   0.169  -0.496
  207    H    SER  29           HN       SER  29  -9.199  -3.649   1.672
  208    HA   SER  29           HA       SER  29 -10.724  -5.062   2.538
  209    HB2  SER  29           HB2      SER  29 -12.197  -2.545   3.278
  210    HB3  SER  29           HB1      SER  29 -12.468  -4.136   3.990
  211    HG   SER  29           HG       SER  29  -9.864  -3.672   4.193
  212    H    THR  30           HN       THR  30 -11.028  -3.944  -0.205
  213    HA   THR  30           HA       THR  30 -13.813  -3.910  -0.698
  214    HB   THR  30           HB       THR  30 -12.152  -2.580  -2.016
  215    HG1  THR  30           HG1      THR  30 -13.359  -4.057  -4.000
  216   HG21  THR  30          HG21      THR  30 -10.428  -4.309  -2.272
  217   HG22  THR  30          HG22      THR  30 -10.922  -3.702  -3.853
  218   HG23  THR  30          HG23      THR  30 -11.516  -5.262  -3.277
  219    H    ASN  31           HN       ASN  31 -11.534  -6.370  -0.317
  220    HA   ASN  31           HA       ASN  31 -13.321  -8.314  -1.649
  221    HB2  ASN  31           HB2      ASN  31 -10.358  -8.558  -1.031
  222    HB3  ASN  31           HB1      ASN  31 -11.346  -9.876  -1.640
  223   HD21  ASN  31          HD21      ASN  31  -9.013  -8.664  -2.785
  224   HD22  ASN  31          HD22      ASN  31  -9.449  -8.079  -4.342
  225    H    VAL  32           HN       VAL  32 -13.050  -7.011   1.121
  226    HA   VAL  32           HA       VAL  32 -12.888  -9.458   2.753
  227    HB   VAL  32           HB       VAL  32 -12.827  -6.563   3.656
  228   HG11  VAL  32          HG11      VAL  32 -12.241  -9.090   5.193
  229   HG12  VAL  32          HG12      VAL  32 -13.656  -8.056   5.393
  230   HG13  VAL  32          HG13      VAL  32 -12.050  -7.442   5.794
  231   HG21  VAL  32          HG21      VAL  32 -10.891  -7.134   2.331
  232   HG22  VAL  32          HG22      VAL  32 -10.559  -8.524   3.373
  233   HG23  VAL  32          HG23      VAL  32 -10.451  -6.881   4.021
  234    H    GLY  33           HN       GLY  33 -14.996  -6.929   1.691
  235    HA2  GLY  33           HA2      GLY  33 -17.388  -7.891   2.011
  236    HA3  GLY  33           HA1      GLY  33 -16.984  -7.632   3.703
  237    H    SER  34           HN       SER  34 -15.330  -5.265   2.678
  238    HA   SER  34           HA       SER  34 -17.394  -3.345   3.138
  239    HB2  SER  34           HB2      SER  34 -15.097  -2.983   3.986
  240    HB3  SER  34           HB1      SER  34 -14.495  -2.941   2.335
  241    HG   SER  34           HG       SER  34 -16.529  -1.164   2.769
  242    H    ASN  35           HN       ASN  35 -15.333  -4.195   0.412
  243    HA   ASN  35           HA       ASN  35 -15.480  -3.906  -1.834
  244    HB2  ASN  35           HB2      ASN  35 -17.515  -5.233  -1.533
  245    HB3  ASN  35           HB1      ASN  35 -18.438  -3.771  -1.256
  246   HD21  ASN  35          HD21      ASN  35 -15.917  -4.249  -3.784
  247   HD22  ASN  35          HD22      ASN  35 -17.026  -4.032  -5.078
  248    H    THR  36           HN       THR  36 -14.399  -1.992  -2.038
  249    HA   THR  36           HA       THR  36 -15.966   0.438  -1.940
  250    HB   THR  36           HB       THR  36 -13.559   1.420  -1.984
  251    HG1  THR  36           HG1      THR  36 -12.013   0.027  -1.275
  252   HG21  THR  36          HG21      THR  36 -14.581  -0.123   0.416
  253   HG22  THR  36          HG22      THR  36 -15.061   1.515  -0.036
  254   HG23  THR  36          HG23      THR  36 -13.403   1.190   0.464
  255    H    TYC  37           HN       ATY  37 -15.140  -1.735  -4.046
  256    HA   TYC  37           HA       ATY  37 -14.980   0.192  -6.249
  257    HB1  TYC  37           HB1      ATY  37 -13.533  -1.415  -7.500
  258    HB2  TYC  37           HB2      ATY  37 -13.487  -2.439  -6.074
  259    HD1  TYC  37           HD1      ATY  37 -12.012  -2.003  -4.307
  260    HD2  TYC  37           HD2      ATY  37 -12.478   0.863  -7.396
  261    HE1  TYC  37           HE1      ATY  37 -10.090  -0.770  -3.429
  262    HE2  TYC  37           HE2      ATY  37 -10.548   2.114  -6.535
  263    HH   TYC  37           HH       ATY  37  -9.376   2.369  -4.339
  264   HT21  TYC  37          HT21      ATY  37 -17.176   0.019  -6.479
  265   HT22  TYC  37          HT22      ATY  37 -17.950  -1.397  -7.109
  Start of MODEL    7
    1    H1   LYS   1           HT1      LYS   1  11.146   6.868   9.858
    2    H2   LYS   1           HT2      LYS   1  11.560   5.358   9.286
    3    H3   LYS   1           HT3      LYS   1  10.141   5.546  10.187
    4    HA   LYS   1           HA       LYS   1   9.704   5.315   7.833
    5    HB2  LYS   1           HB2      LYS   1   8.206   6.741   9.228
    6    HB3  LYS   1           HB1      LYS   1   9.218   8.125   8.853
    7    HG2  LYS   1           HG2      LYS   1   8.606   7.975   6.508
    8    HG3  LYS   1           HG1      LYS   1   7.657   6.528   6.830
    9    HD2  LYS   1           HD2      LYS   1   6.186   8.444   6.661
   10    HD3  LYS   1           HD1      LYS   1   6.199   7.850   8.320
   11    HE2  LYS   1           HE2      LYS   1   7.768   9.643   8.937
   12    HE3  LYS   1           HE1      LYS   1   7.747  10.218   7.269
   13    HZ1  LYS   1           HZ1      LYS   1   6.236  11.509   8.666
   14    HZ2  LYS   1           HZ2      LYS   1   5.413  10.118   9.100
   15    HZ3  LYS   1           HZ3      LYS   1   5.367  10.649   7.514
   16    H    CYS   2           HN       CYS   2  10.305   5.782   5.726
   17    HA   CYS   2           HA       CYS   2  12.216   7.932   5.406
   18    HB2  CYS   2           HB2      CYS   2  13.422   6.466   3.762
   19    HB3  CYS   2           HB1      CYS   2  13.577   5.987   5.450
   20    H    ASN   3           HN       ASN   3  12.371   8.746   3.226
   21    HA   ASN   3           HA       ASN   3   9.954   8.338   1.626
   22    HB2  ASN   3           HB2      ASN   3   9.442  10.740   1.587
   23    HB3  ASN   3           HB1      ASN   3   9.401  10.132   3.236
   24   HD21  ASN   3          HD21      ASN   3  10.997  12.191   0.985
   25   HD22  ASN   3          HD22      ASN   3  12.015  13.016   2.111
   26    H    THR   4           HN       THR   4  12.962   7.996   1.439
   27    HA   THR   4           HA       THR   4  13.456   9.733  -0.853
   28    HB   THR   4           HB       THR   4  15.297   9.724   0.770
   29    HG1  THR   4           HG1      THR   4  16.701   9.681  -0.758
   30   HG21  THR   4          HG21      THR   4  15.447   6.758   0.287
   31   HG22  THR   4          HG22      THR   4  14.882   7.516   1.777
   32   HG23  THR   4          HG23      THR   4  16.569   7.695   1.277
   33    H    ALA   5           HN       ALA   5  14.376   8.776  -2.737
   34    HA   ALA   5           HA       ALA   5  12.789   6.704  -3.808
   35    HB1  ALA   5           HB1      ALA   5  13.707   8.510  -5.176
   36    HB2  ALA   5           HB2      ALA   5  14.179   6.929  -5.808
   37    HB3  ALA   5           HB3      ALA   5  15.335   7.893  -4.885
   38    H    THR   6           HN       THR   6  15.736   6.667  -2.123
   39    HA   THR   6           HA       THR   6  16.579   4.095  -3.061
   40    HB   THR   6           HB       THR   6  17.473   5.800  -0.736
   41    HG1  THR   6           HG1      THR   6  18.621   5.468  -3.302
   42   HG21  THR   6          HG21      THR   6  18.127   3.487  -0.467
   43   HG22  THR   6          HG22      THR   6  19.550   4.478  -0.820
   44   HG23  THR   6          HG23      THR   6  18.838   3.453  -2.083
   45    H    CYS   7           HN       CYS   7  14.230   5.161  -0.816
   46    HA   CYS   7           HA       CYS   7  14.562   2.704   0.813
   47    HB2  CYS   7           HB2      CYS   7  15.239   4.994   1.742
   48    HB3  CYS   7           HB1      CYS   7  13.576   5.261   1.810
   49    H    ALA   8           HN       ALA   8  12.320   5.323  -0.106
   50    HA   ALA   8           HA       ALA   8  10.064   4.139   1.032
   51    HB1  ALA   8           HB1      ALA   8  10.260   6.114  -1.242
   52    HB2  ALA   8           HB2      ALA   8  10.215   6.500   0.482
   53    HB3  ALA   8           HB3      ALA   8   8.814   5.752  -0.286
   54    H    THR   9           HN       THR   9  11.806   3.678  -1.810
   55    HA   THR   9           HA       THR   9   9.792   2.434  -3.425
   56    HB   THR   9           HB       THR   9  11.796   1.520  -4.627
   57    HG1  THR   9           HG1      THR   9  13.635   3.140  -3.842
   58   HG21  THR   9          HG21      THR   9  12.346   3.736  -5.586
   59   HG22  THR   9          HG22      THR   9  11.555   4.504  -4.212
   60   HG23  THR   9          HG23      THR   9  10.607   3.538  -5.348
   61    H    GLN  10           HN       GLN  10  12.008   1.451  -1.096
   62    HA   GLN  10           HA       GLN  10  11.785  -1.393  -1.448
   63    HB2  GLN  10           HB2      GLN  10  12.702   0.067   1.029
   64    HB3  GLN  10           HB1      GLN  10  13.107  -1.585   0.557
   65    HG2  GLN  10           HG2      GLN  10  14.022   0.975  -0.733
   66    HG3  GLN  10           HG1      GLN  10  14.982  -0.124   0.247
   67   HE21  GLN  10          HE21      GLN  10  15.254   0.868  -2.451
   68   HE22  GLN  10          HE22      GLN  10  15.459  -0.519  -3.466
   69    H    ARG  11           HN       ARG  11  10.443   1.118   0.523
   70    HA   ARG  11           HA       ARG  11   8.814  -0.489   2.212
   71    HB2  ARG  11           HB2      ARG  11   8.144   2.303   1.221
   72    HB3  ARG  11           HB1      ARG  11   7.501   1.531   2.655
   73    HG2  ARG  11           HG2      ARG  11  10.338   2.424   2.218
   74    HG3  ARG  11           HG1      ARG  11   9.131   3.212   3.237
   75    HD2  ARG  11           HD2      ARG  11  10.320   0.491   3.572
   76    HD3  ARG  11           HD1      ARG  11  10.642   1.920   4.557
   77    HE   ARG  11           HE       ARG  11   7.867   1.318   4.550
   78   HH11  ARG  11          HH11      ARG  11  10.899   0.222   5.955
   79   HH12  ARG  11          HH12      ARG  11  10.193  -0.425   7.362
   80   HH21  ARG  11          HH21      ARG  11   6.854   0.432   6.428
   81   HH22  ARG  11          HH22      ARG  11   7.780  -0.301   7.650
   82    H    LEU  12           HN       LEU  12   8.316   1.072  -0.873
   83    HA   LEU  12           HA       LEU  12   5.704   0.350  -1.429
   84    HB2  LEU  12           HB2      LEU  12   8.155   0.827  -2.959
   85    HB3  LEU  12           HB1      LEU  12   6.781   0.521  -3.883
   86    HG   LEU  12           HG       LEU  12   7.336   2.888  -2.086
   87   HD11  LEU  12          HD11      LEU  12   6.912   4.194  -4.094
   88   HD12  LEU  12          HD12      LEU  12   6.579   2.719  -4.994
   89   HD13  LEU  12          HD13      LEU  12   8.195   3.020  -4.374
   90   HD21  LEU  12          HD21      LEU  12   5.041   2.281  -1.598
   91   HD22  LEU  12          HD22      LEU  12   4.684   2.158  -3.316
   92   HD23  LEU  12          HD23      LEU  12   5.063   3.728  -2.609
   93    H    ALA  13           HN       ALA  13   8.768  -1.305  -1.970
   94    HA   ALA  13           HA       ALA  13   7.664  -3.476  -3.323
   95    HB1  ALA  13           HB1      ALA  13   9.818  -4.604  -2.957
   96    HB2  ALA  13           HB2      ALA  13  10.252  -3.366  -1.776
   97    HB3  ALA  13           HB3      ALA  13  10.042  -2.932  -3.471
   98    H    ASN  14           HN       ASN  14   8.243  -2.803   0.040
   99    HA   ASN  14           HA       ASN  14   7.593  -5.449   1.025
  100    HB2  ASN  14           HB2      ASN  14   7.852  -2.833   2.495
  101    HB3  ASN  14           HB1      ASN  14   7.448  -4.371   3.252
  102   HD21  ASN  14          HD21      ASN  14   9.792  -4.070   0.707
  103   HD22  ASN  14          HD22      ASN  14  11.173  -4.392   1.674
  104    H    PHE  15           HN       PHE  15   5.669  -3.026  -0.239
  105    HA   PHE  15           HA       PHE  15   3.598  -3.249   1.728
  106    HB2  PHE  15           HB2      PHE  15   3.446  -1.086   1.077
  107    HB3  PHE  15           HB1      PHE  15   4.471  -1.384  -0.317
  108    HD1  PHE  15           HD1      PHE  15   0.968  -1.427   0.909
  109    HD2  PHE  15           HD2      PHE  15   3.544  -1.547  -2.475
  110    HE1  PHE  15           HE1      PHE  15  -0.971  -1.100  -0.574
  111    HE2  PHE  15           HE2      PHE  15   1.626  -1.227  -3.964
  112    HZ   PHE  15           HZ       PHE  15  -0.647  -1.002  -3.017
  113    H    LEU  16           HN       LEU  16   4.688  -4.470  -1.264
  114    HA   LEU  16           HA       LEU  16   2.162  -5.829  -1.552
  115    HB2  LEU  16           HB2      LEU  16   1.939  -5.059  -3.542
  116    HB3  LEU  16           HB1      LEU  16   3.012  -3.860  -3.025
  117    HG   LEU  16           HG       LEU  16   4.057  -6.215  -4.598
  118   HD11  LEU  16          HD11      LEU  16   2.465  -4.961  -5.963
  119   HD12  LEU  16          HD12      LEU  16   4.120  -4.689  -6.511
  120   HD13  LEU  16          HD13      LEU  16   3.296  -3.457  -5.559
  121   HD21  LEU  16          HD21      LEU  16   5.184  -3.507  -3.936
  122   HD22  LEU  16          HD22      LEU  16   5.960  -4.718  -4.954
  123   HD23  LEU  16          HD23      LEU  16   5.706  -5.036  -3.235
  124    H    VAL  17           HN       VAL  17   4.965  -6.423  -0.472
  125    HA   VAL  17           HA       VAL  17   6.197  -8.323  -2.161
  126    HB   VAL  17           HB       VAL  17   7.385  -7.042  -0.435
  127   HG11  VAL  17          HG11      VAL  17   5.789  -6.983   1.317
  128   HG12  VAL  17          HG12      VAL  17   7.278  -7.699   1.949
  129   HG13  VAL  17          HG13      VAL  17   5.886  -8.717   1.541
  130   HG21  VAL  17          HG21      VAL  17   8.494  -8.993  -1.228
  131   HG22  VAL  17          HG22      VAL  17   7.574 -10.023  -0.136
  132   HG23  VAL  17          HG23      VAL  17   8.751  -8.865   0.515
  133    H    HIS  18           HN       HIS  18   4.048  -8.592   0.538
  134    HA   HIS  18           HA       HIS  18   3.260 -11.282  -0.278
  135    HB2  HIS  18           HB2      HIS  18   4.041 -10.556   2.567
  136    HB3  HIS  18           HB1      HIS  18   3.109 -11.976   2.141
  137    HD1  HIS  18           HD1      HIS  18   4.418 -14.036   1.670
  138    HD2  HIS  18           HD2      HIS  18   6.713 -10.606   1.488
  139    HE1  HIS  18           HE1      HIS  18   6.775 -14.832   1.435
  140    HE2  HIS  18           HE2      HIS  18   8.156 -12.738   1.585
  141    H    SER  19           HN       SER  19   2.800  -8.750   2.081
  142    HA   SER  19           HA       SER  19   1.013  -7.368   2.578
  143    HB2  SER  19           HB2      SER  19  -0.166  -8.613   0.121
  144    HB3  SER  19           HB1      SER  19  -0.750  -7.112   0.880
  145    HG   SER  19           HG       SER  19   1.222  -6.164   0.281
  146    H    SER  20           HN       SER  20   1.054 -10.557   3.011
  147    HA   SER  20           HA       SER  20  -1.492 -11.551   3.244
  148    HB2  SER  20           HB2      SER  20   0.898 -12.178   4.965
  149    HB3  SER  20           HB1      SER  20  -0.461 -13.243   4.580
  150    HG   SER  20           HG       SER  20   0.180 -13.354   2.516
  151    H    ASN  21           HN       ASN  21   0.314  -9.548   5.389
  152    HA   ASN  21           HA       ASN  21  -1.032  -9.646   7.762
  153    HB2  ASN  21           HB2      ASN  21   1.078  -8.394   6.911
  154    HB3  ASN  21           HB1      ASN  21  -0.068  -7.087   6.611
  155   HD21  ASN  21          HD21      ASN  21   1.473  -9.023   8.851
  156   HD22  ASN  21          HD22      ASN  21   1.038  -8.162  10.261
  157    H    ASN  22           HN       ASN  22  -1.723  -7.947   4.795
  158    HA   ASN  22           HA       ASN  22  -4.043  -6.683   6.054
  159    HB2  ASN  22           HB2      ASN  22  -2.102  -6.016   4.012
  160    HB3  ASN  22           HB1      ASN  22  -3.574  -5.016   4.028
  161   HD21  ASN  22          HD21      ASN  22  -3.318  -5.510   7.162
  162   HD22  ASN  22          HD22      ASN  22  -2.104  -4.434   7.662
  163    H    PHE  23           HN       PHE  23  -3.198  -9.165   4.554
  164    HA   PHE  23           HA       PHE  23  -5.430  -9.357   2.693
  165    HB2  PHE  23           HB2      PHE  23  -2.730 -10.012   2.808
  166    HB3  PHE  23           HB1      PHE  23  -3.502 -11.498   2.448
  167    HD1  PHE  23           HD1      PHE  23  -2.910  -8.028   1.599
  168    HD2  PHE  23           HD2      PHE  23  -4.443 -11.686   0.149
  169    HE1  PHE  23           HE1      PHE  23  -2.925  -7.091  -0.624
  170    HE2  PHE  23           HE2      PHE  23  -4.477 -10.773  -2.135
  171    HZ   PHE  23           HZ       PHE  23  -3.716  -8.465  -2.542
  172    H    GLY  24           HN       GLY  24  -4.798  -9.783   5.724
  173    HA2  GLY  24           HA2      GLY  24  -6.795 -10.981   6.712
  174    HA3  GLY  24           HA1      GLY  24  -6.135 -12.434   6.016
  175    H    ALA  25           HN       ALA  25  -4.627  -9.718   7.750
  176    HA   ALA  25           HA       ALA  25  -4.174 -11.556   9.975
  177    HB1  ALA  25           HB1      ALA  25  -2.344  -9.904  10.599
  178    HB2  ALA  25           HB2      ALA  25  -2.674  -9.098   9.045
  179    HB3  ALA  25           HB3      ALA  25  -2.081 -10.747   9.060
  180    H    ILE  26           HN       ILE  26  -4.634  -8.288   9.013
  181    HA   ILE  26           HA       ILE  26  -5.921  -7.506  11.346
  182    HB   ILE  26           HB       ILE  26  -4.680  -5.897  10.123
  183   HG12  ILE  26          HG12      ILE  26  -7.502  -5.453   9.576
  184   HG13  ILE  26          HG11      ILE  26  -6.819  -5.131  11.169
  185   HG21  ILE  26          HG21      ILE  26  -4.730  -6.866   7.905
  186   HG22  ILE  26          HG22      ILE  26  -5.291  -5.195   7.805
  187   HG23  ILE  26          HG23      ILE  26  -6.452  -6.525   7.762
  188   HD11  ILE  26          HD11      ILE  26  -5.362  -3.387  10.088
  189   HD12  ILE  26          HD12      ILE  26  -7.084  -3.020   9.961
  190   HD13  ILE  26          HD13      ILE  26  -6.218  -3.676   8.574
  191    H    LEU  27           HN       LEU  27  -6.887  -8.687   8.214
  192    HA   LEU  27           HA       LEU  27  -9.620  -7.952   8.514
  193    HB2  LEU  27           HB2      LEU  27  -9.530  -8.100   6.273
  194    HB3  LEU  27           HB1      LEU  27  -7.888  -8.644   6.470
  195    HG   LEU  27           HG       LEU  27  -8.672 -11.017   6.367
  196   HD11  LEU  27          HD11      LEU  27 -10.828 -11.517   5.477
  197   HD12  LEU  27          HD12      LEU  27 -11.337  -9.823   5.692
  198   HD13  LEU  27          HD13      LEU  27 -10.887 -10.825   7.093
  199   HD21  LEU  27          HD21      LEU  27  -9.380  -9.267   4.027
  200   HD22  LEU  27          HD22      LEU  27  -9.101 -11.004   3.964
  201   HD23  LEU  27          HD23      LEU  27  -7.784  -9.920   4.405
  202    H    SER  28           HN       SER  28  -7.761 -10.841   8.631
  203    HA   SER  28           HA       SER  28 -10.005 -12.421   9.065
  204    HB2  SER  28           HB2      SER  28  -7.113 -13.033   9.560
  205    HB3  SER  28           HB1      SER  28  -8.393 -14.258   9.513
  206    HG   SER  28           HG       SER  28  -8.781 -13.679   7.384
  207    H    SER  29           HN       SER  29  -7.444 -11.199  11.226
  208    HA   SER  29           HA       SER  29  -7.181 -10.922  13.386
  209    HB2  SER  29           HB2      SER  29 -10.200 -10.960  13.536
  210    HB3  SER  29           HB1      SER  29  -9.127 -10.342  14.798
  211    HG   SER  29           HG       SER  29 -10.045  -9.074  12.637
  212    H    THR  30           HN       THR  30  -9.220 -13.532  12.662
  213    HA   THR  30           HA       THR  30  -8.957 -15.068  15.035
  214    HB   THR  30           HB       THR  30 -10.824 -15.231  13.456
  215    HG1  THR  30           HG1      THR  30 -10.608 -17.078  14.575
  216   HG21  THR  30          HG21      THR  30  -9.575 -14.792  11.417
  217   HG22  THR  30          HG22      THR  30 -10.556 -16.250  11.239
  218   HG23  THR  30          HG23      THR  30  -8.811 -16.375  11.519
  219    H    ASN  31           HN       ASN  31  -6.392 -14.161  13.928
  220    HA   ASN  31           HA       ASN  31  -5.135 -16.479  12.631
  221    HB2  ASN  31           HB2      ASN  31  -4.011 -13.767  13.395
  222    HB3  ASN  31           HB1      ASN  31  -3.146 -14.996  12.490
  223   HD21  ASN  31          HD21      ASN  31  -3.595 -15.259  10.321
  224   HD22  ASN  31          HD22      ASN  31  -4.559 -14.124   9.438
  225    H    VAL  32           HN       VAL  32  -5.662 -14.907  15.461
  226    HA   VAL  32           HA       VAL  32  -3.422 -15.600  16.998
  227    HB   VAL  32           HB       VAL  32  -4.746 -14.761  18.859
  228   HG11  VAL  32          HG11      VAL  32  -3.568 -13.177  17.448
  229   HG12  VAL  32          HG12      VAL  32  -5.080 -12.482  18.035
  230   HG13  VAL  32          HG13      VAL  32  -4.968 -13.077  16.380
  231   HG21  VAL  32          HG21      VAL  32  -6.936 -15.635  18.263
  232   HG22  VAL  32          HG22      VAL  32  -6.994 -14.560  16.865
  233   HG23  VAL  32          HG23      VAL  32  -7.007 -13.888  18.496
  234    H    GLY  33           HN       GLY  33  -6.379 -17.274  16.214
  235    HA2  GLY  33           HA2      GLY  33  -6.027 -19.172  18.376
  236    HA3  GLY  33           HA1      GLY  33  -7.288 -19.223  17.157
  237    H    SER  34           HN       SER  34  -5.029 -18.788  15.148
  238    HA   SER  34           HA       SER  34  -4.444 -21.614  14.819
  239    HB2  SER  34           HB2      SER  34  -5.298 -20.245  12.885
  240    HB3  SER  34           HB1      SER  34  -3.825 -19.285  12.959
  241    HG   SER  34           HG       SER  34  -4.139 -22.012  12.296
  242    H    ASN  35           HN       ASN  35  -2.726 -18.492  14.954
  243    HA   ASN  35           HA       ASN  35  -0.376 -19.961  15.832
  244    HB2  ASN  35           HB2      ASN  35  -0.638 -17.169  14.701
  245    HB3  ASN  35           HB1      ASN  35   0.815 -17.709  15.530
  246   HD21  ASN  35          HD21      ASN  35   0.647 -20.431  14.451
  247   HD22  ASN  35          HD22      ASN  35   1.089 -20.315  12.792
  248    H    THR  36           HN       THR  36  -0.900 -20.441  17.770
  249    HA   THR  36           HA       THR  36  -2.102 -18.616  19.513
  250    HB   THR  36           HB       THR  36  -1.575 -20.583  21.125
  251    HG1  THR  36           HG1      THR  36  -0.247 -21.898  20.075
  252   HG21  THR  36          HG21      THR  36  -3.415 -20.877  18.738
  253   HG22  THR  36          HG22      THR  36  -3.797 -20.011  20.227
  254   HG23  THR  36          HG23      THR  36  -3.552 -21.757  20.260
  255    H    TYC  37           HN       ATY  37  -0.719 -16.957  19.641
  256    HA   TYC  37           HA       ATY  37   1.592 -17.362  21.407
  257    HB1  TYC  37           HB1      ATY  37   2.195 -14.973  20.700
  258    HB2  TYC  37           HB2      ATY  37   0.984 -15.156  19.440
  259    HD1  TYC  37           HD1      ATY  37   4.278 -16.119  20.582
  260    HD2  TYC  37           HD2      ATY  37   1.346 -16.715  17.575
  261    HE1  TYC  37           HE1      ATY  37   5.970 -17.156  19.164
  262    HE2  TYC  37           HE2      ATY  37   3.023 -17.763  16.140
  263    HH   TYC  37           HH       ATY  37   6.113 -18.697  17.316
  264   HT21  TYC  37          HT21      ATY  37  -0.350 -14.486  20.839
  265   HT22  TYC  37          HT22      ATY  37  -0.862 -14.296  22.483
  Start of MODEL    8
    1    H1   LYS   1           HT1      LYS   1   9.529   5.815  10.125
    2    H2   LYS   1           HT2      LYS   1  10.212   7.265   9.593
    3    H3   LYS   1           HT3      LYS   1  11.169   5.915   9.746
    4    HA   LYS   1           HA       LYS   1  10.063   4.820   7.960
    5    HB2  LYS   1           HB2      LYS   1   8.388   6.001   6.637
    6    HB3  LYS   1           HB1      LYS   1   7.830   5.869   8.295
    7    HG2  LYS   1           HG2      LYS   1   8.467   8.220   8.685
    8    HG3  LYS   1           HG1      LYS   1   9.041   8.322   7.023
    9    HD2  LYS   1           HD2      LYS   1   6.783   7.820   6.212
   10    HD3  LYS   1           HD1      LYS   1   6.213   7.732   7.880
   11    HE2  LYS   1           HE2      LYS   1   6.762  10.070   8.221
   12    HE3  LYS   1           HE1      LYS   1   7.439  10.174   6.597
   13    HZ1  LYS   1           HZ1      LYS   1   5.194  11.071   6.644
   14    HZ2  LYS   1           HZ2      LYS   1   4.586   9.617   7.250
   15    HZ3  LYS   1           HZ3      LYS   1   5.235   9.670   5.714
   16    H    CYS   2           HN       CYS   2  10.482   5.487   5.623
   17    HA   CYS   2           HA       CYS   2  12.410   7.656   5.529
   18    HB2  CYS   2           HB2      CYS   2  13.596   6.195   3.829
   19    HB3  CYS   2           HB1      CYS   2  13.768   5.691   5.524
   20    H    ASN   3           HN       ASN   3  12.584   8.614   3.366
   21    HA   ASN   3           HA       ASN   3  10.159   8.168   1.785
   22    HB2  ASN   3           HB2      ASN   3   9.703   9.875   3.571
   23    HB3  ASN   3           HB1      ASN   3  10.939  10.890   2.848
   24   HD21  ASN   3          HD21      ASN   3   8.651   8.924   0.985
   25   HD22  ASN   3          HD22      ASN   3   7.795  10.262   0.342
   26    H    THR   4           HN       THR   4  13.180   7.934   1.456
   27    HA   THR   4           HA       THR   4  13.470   9.805  -0.764
   28    HB   THR   4           HB       THR   4  15.390   9.614   0.845
   29    HG1  THR   4           HG1      THR   4  16.981   9.030  -0.893
   30   HG21  THR   4          HG21      THR   4  15.629   6.819  -0.259
   31   HG22  THR   4          HG22      THR   4  15.112   7.221   1.366
   32   HG23  THR   4          HG23      THR   4  16.767   7.589   0.849
   33    H    ALA   5           HN       ALA   5  14.456   8.871  -2.732
   34    HA   ALA   5           HA       ALA   5  12.733   6.922  -3.851
   35    HB1  ALA   5           HB1      ALA   5  14.024   7.198  -5.887
   36    HB2  ALA   5           HB2      ALA   5  15.309   7.999  -4.989
   37    HB3  ALA   5           HB3      ALA   5  13.731   8.770  -5.145
   38    H    THR   6           HN       THR   6  15.673   6.700  -2.215
   39    HA   THR   6           HA       THR   6  16.415   4.113  -3.230
   40    HB   THR   6           HB       THR   6  17.460   5.780  -0.927
   41    HG1  THR   6           HG1      THR   6  19.123   6.271  -2.437
   42   HG21  THR   6          HG21      THR   6  18.722   3.411  -2.325
   43   HG22  THR   6          HG22      THR   6  18.020   3.428  -0.702
   44   HG23  THR   6          HG23      THR   6  19.465   4.380  -1.037
   45    H    CYS   7           HN       CYS   7  14.130   5.236  -0.933
   46    HA   CYS   7           HA       CYS   7  14.423   2.732   0.611
   47    HB2  CYS   7           HB2      CYS   7  15.297   4.902   1.572
   48    HB3  CYS   7           HB1      CYS   7  13.658   5.282   1.820
   49    H    ALA   8           HN       ALA   8  12.255   5.417  -0.282
   50    HA   ALA   8           HA       ALA   8  10.031   4.306   0.964
   51    HB1  ALA   8           HB1      ALA   8   8.743   5.842  -0.522
   52    HB2  ALA   8           HB2      ALA   8  10.269   6.238  -1.342
   53    HB3  ALA   8           HB3      ALA   8  10.055   6.616   0.365
   54    H    THR   9           HN       THR   9  11.725   3.752  -1.894
   55    HA   THR   9           HA       THR   9   9.779   2.337  -3.417
   56    HB   THR   9           HB       THR   9  11.879   1.438  -4.567
   57    HG1  THR   9           HG1      THR   9  13.590   3.194  -3.876
   58   HG21  THR   9          HG21      THR   9  10.542   3.374  -5.363
   59   HG22  THR   9          HG22      THR   9  12.268   3.567  -5.682
   60   HG23  THR   9          HG23      THR   9  11.522   4.426  -4.336
   61    H    GLN  10           HN       GLN  10  11.956   1.547  -0.978
   62    HA   GLN  10           HA       GLN  10  11.805  -1.326  -1.192
   63    HB2  GLN  10           HB2      GLN  10  12.648   0.279   1.233
   64    HB3  GLN  10           HB1      GLN  10  13.043  -1.405   0.893
   65    HG2  GLN  10           HG2      GLN  10  14.008   1.021  -0.599
   66    HG3  GLN  10           HG1      GLN  10  14.956   0.004   0.482
   67   HE21  GLN  10          HE21      GLN  10  15.169   0.732  -2.338
   68   HE22  GLN  10          HE22      GLN  10  15.334  -0.756  -3.207
   69    H    ARG  11           HN       ARG  11  10.350   1.206   0.628
   70    HA   ARG  11           HA       ARG  11   8.618  -0.392   2.257
   71    HB2  ARG  11           HB2      ARG  11   7.952   2.382   1.231
   72    HB3  ARG  11           HB1      ARG  11   7.342   1.620   2.687
   73    HG2  ARG  11           HG2      ARG  11  10.132   2.644   2.200
   74    HG3  ARG  11           HG1      ARG  11   8.918   3.339   3.274
   75    HD2  ARG  11           HD2      ARG  11  10.304   0.690   3.541
   76    HD3  ARG  11           HD1      ARG  11  10.592   2.135   4.507
   77    HE   ARG  11           HE       ARG  11   7.866   1.313   4.652
   78   HH11  ARG  11          HH11      ARG  11  11.057   0.571   5.985
   79   HH12  ARG  11          HH12      ARG  11  10.449  -0.140   7.397
   80   HH21  ARG  11          HH21      ARG  11   7.043   0.321   6.560
   81   HH22  ARG  11          HH22      ARG  11   8.113  -0.284   7.744
   82    H    LEU  12           HN       LEU  12   8.335   1.049  -0.936
   83    HA   LEU  12           HA       LEU  12   5.763   0.262  -1.601
   84    HB2  LEU  12           HB2      LEU  12   8.272   0.706  -3.057
   85    HB3  LEU  12           HB1      LEU  12   6.923   0.257  -3.973
   86    HG   LEU  12           HG       LEU  12   7.262   2.803  -2.364
   87   HD11  LEU  12          HD11      LEU  12   6.796   2.306  -5.297
   88   HD12  LEU  12          HD12      LEU  12   8.326   2.793  -4.575
   89   HD13  LEU  12          HD13      LEU  12   6.939   3.878  -4.529
   90   HD21  LEU  12          HD21      LEU  12   5.030   3.456  -3.113
   91   HD22  LEU  12          HD22      LEU  12   4.963   2.032  -2.082
   92   HD23  LEU  12          HD23      LEU  12   4.798   1.862  -3.829
   93    H    ALA  13           HN       ALA  13   8.849  -1.405  -1.776
   94    HA   ALA  13           HA       ALA  13   7.869  -3.626  -3.138
   95    HB1  ALA  13           HB1      ALA  13   9.963  -4.759  -2.451
   96    HB2  ALA  13           HB2      ALA  13  10.295  -3.428  -1.341
   97    HB3  ALA  13           HB3      ALA  13  10.255  -3.137  -3.080
   98    H    ASN  14           HN       ASN  14   8.064  -2.731   0.210
   99    HA   ASN  14           HA       ASN  14   7.263  -5.323   1.221
  100    HB2  ASN  14           HB2      ASN  14   7.500  -2.687   2.671
  101    HB3  ASN  14           HB1      ASN  14   6.922  -4.179   3.413
  102   HD21  ASN  14          HD21      ASN  14   9.547  -3.895   1.117
  103   HD22  ASN  14          HD22      ASN  14  10.778  -4.386   2.216
  104    H    PHE  15           HN       PHE  15   5.612  -2.978  -0.341
  105    HA   PHE  15           HA       PHE  15   3.235  -3.073   1.264
  106    HB2  PHE  15           HB2      PHE  15   3.258  -0.957   0.452
  107    HB3  PHE  15           HB1      PHE  15   4.427  -1.368  -0.790
  108    HD1  PHE  15           HD1      PHE  15   0.851  -1.144   0.042
  109    HD2  PHE  15           HD2      PHE  15   3.730  -1.843  -3.000
  110    HE1  PHE  15           HE1      PHE  15  -0.899  -0.919  -1.667
  111    HE2  PHE  15           HE2      PHE  15   2.001  -1.628  -4.712
  112    HZ   PHE  15           HZ       PHE  15  -0.323  -1.155  -4.052
  113    H    LEU  16           HN       LEU  16   4.814  -4.674  -1.306
  114    HA   LEU  16           HA       LEU  16   2.348  -5.994  -1.883
  115    HB2  LEU  16           HB2      LEU  16   2.350  -5.324  -3.895
  116    HB3  LEU  16           HB1      LEU  16   3.360  -4.091  -3.342
  117    HG   LEU  16           HG       LEU  16   4.584  -6.516  -4.655
  118   HD11  LEU  16          HD11      LEU  16   3.827  -3.867  -5.869
  119   HD12  LEU  16          HD12      LEU  16   3.092  -5.428  -6.238
  120   HD13  LEU  16          HD13      LEU  16   4.779  -5.123  -6.656
  121   HD21  LEU  16          HD21      LEU  16   6.479  -4.988  -4.964
  122   HD22  LEU  16          HD22      LEU  16   6.081  -5.197  -3.255
  123   HD23  LEU  16          HD23      LEU  16   5.595  -3.731  -4.098
  124    H    VAL  17           HN       VAL  17   4.823  -6.558  -0.303
  125    HA   VAL  17           HA       VAL  17   6.356  -8.415  -1.811
  126    HB   VAL  17           HB       VAL  17   7.375  -7.020  -0.087
  127   HG11  VAL  17          HG11      VAL  17   7.157  -7.381   2.281
  128   HG12  VAL  17          HG12      VAL  17   5.988  -8.658   1.995
  129   HG13  VAL  17          HG13      VAL  17   5.581  -7.011   1.565
  130   HG21  VAL  17          HG21      VAL  17   8.607  -8.948  -0.703
  131   HG22  VAL  17          HG22      VAL  17   7.670  -9.966   0.384
  132   HG23  VAL  17          HG23      VAL  17   8.755  -8.726   1.043
  133    H    HIS  18           HN       HIS  18   4.450  -9.041   1.091
  134    HA   HIS  18           HA       HIS  18   3.672 -11.609  -0.154
  135    HB2  HIS  18           HB2      HIS  18   3.949 -11.015   2.821
  136    HB3  HIS  18           HB1      HIS  18   3.316 -12.508   2.151
  137    HD1  HIS  18           HD1      HIS  18   5.000 -14.333   1.963
  138    HD2  HIS  18           HD2      HIS  18   6.648 -10.565   1.898
  139    HE1  HIS  18           HE1      HIS  18   7.476 -14.724   1.994
  140    HE2  HIS  18           HE2      HIS  18   8.471 -12.442   2.197
  141    H    SER  19           HN       SER  19   2.851  -8.652   0.416
  142    HA   SER  19           HA       SER  19   0.266  -8.825   1.547
  143    HB2  SER  19           HB2      SER  19   1.645  -6.691  -0.035
  144    HB3  SER  19           HB1      SER  19   0.124  -6.476   0.816
  145    HG   SER  19           HG       SER  19   1.309  -5.983   2.417
  146    H    SER  20           HN       SER  20   1.551  -9.663  -1.313
  147    HA   SER  20           HA       SER  20   0.054  -8.888  -3.397
  148    HB2  SER  20           HB2      SER  20   0.955 -11.714  -3.002
  149    HB3  SER  20           HB1      SER  20   0.995 -10.724  -4.469
  150    HG   SER  20           HG       SER  20   2.996 -10.414  -3.823
  151    H    ASN  21           HN       ASN  21  -0.870 -11.088  -0.897
  152    HA   ASN  21           HA       ASN  21  -3.049 -12.264  -2.306
  153    HB2  ASN  21           HB2      ASN  21  -1.259 -13.020  -0.441
  154    HB3  ASN  21           HB1      ASN  21  -2.701 -12.695   0.515
  155   HD21  ASN  21          HD21      ASN  21  -1.415 -14.472  -2.104
  156   HD22  ASN  21          HD22      ASN  21  -2.580 -15.713  -2.089
  157    H    ASN  22           HN       ASN  22  -2.634  -9.408  -0.415
  158    HA   ASN  22           HA       ASN  22  -5.331  -9.601   0.683
  159    HB2  ASN  22           HB2      ASN  22  -2.788  -9.457   1.957
  160    HB3  ASN  22           HB1      ASN  22  -3.905  -8.178   2.420
  161   HD21  ASN  22          HD21      ASN  22  -4.977 -11.307   1.335
  162   HD22  ASN  22          HD22      ASN  22  -5.484 -11.920   2.845
  163    H    PHE  23           HN       PHE  23  -2.700  -7.660  -0.270
  164    HA   PHE  23           HA       PHE  23  -3.589  -5.229   0.576
  165    HB2  PHE  23           HB2      PHE  23  -1.633  -4.391  -0.455
  166    HB3  PHE  23           HB1      PHE  23  -1.431  -6.090  -0.166
  167    HD1  PHE  23           HD1      PHE  23  -2.362  -7.539  -2.004
  168    HD2  PHE  23           HD2      PHE  23  -0.635  -3.778  -2.477
  169    HE1  PHE  23           HE1      PHE  23  -1.650  -8.219  -4.200
  170    HE2  PHE  23           HE2      PHE  23   0.118  -4.347  -4.739
  171    HZ   PHE  23           HZ       PHE  23  -0.392  -6.591  -5.665
  172    H    GLY  24           HN       GLY  24  -5.350  -4.507   0.231
  173    HA2  GLY  24           HA2      GLY  24  -7.309  -3.743  -0.664
  174    HA3  GLY  24           HA1      GLY  24  -6.566  -3.360  -2.148
  175    H    ALA  25           HN       ALA  25  -6.801  -6.387  -0.501
  176    HA   ALA  25           HA       ALA  25  -8.803  -7.348  -2.377
  177    HB1  ALA  25           HB1      ALA  25  -7.952  -9.632  -1.783
  178    HB2  ALA  25           HB2      ALA  25  -6.762  -8.867  -0.734
  179    HB3  ALA  25           HB3      ALA  25  -6.685  -8.610  -2.473
  180    H    ILE  26           HN       ILE  26  -7.528  -7.434   0.838
  181    HA   ILE  26           HA       ILE  26 -10.047  -7.998   2.005
  182    HB   ILE  26           HB       ILE  26  -8.229  -9.025   3.186
  183   HG12  ILE  26          HG12      ILE  26  -8.791  -6.516   4.574
  184   HG13  ILE  26          HG11      ILE  26  -9.937  -7.851   4.624
  185   HG21  ILE  26          HG21      ILE  26  -6.914  -6.325   3.194
  186   HG22  ILE  26          HG22      ILE  26  -6.388  -7.736   2.280
  187   HG23  ILE  26          HG23      ILE  26  -6.284  -7.738   4.045
  188   HD11  ILE  26          HD11      ILE  26  -8.648  -7.813   6.709
  189   HD12  ILE  26          HD12      ILE  26  -7.136  -7.765   5.805
  190   HD13  ILE  26          HD13      ILE  26  -8.142  -9.213   5.764
  191    H    LEU  27           HN       LEU  27  -7.772  -5.331   1.656
  192    HA   LEU  27           HA       LEU  27  -9.130  -3.383   3.063
  193    HB2  LEU  27           HB2      LEU  27  -7.091  -2.617   2.553
  194    HB3  LEU  27           HB1      LEU  27  -6.977  -3.599   1.130
  195    HG   LEU  27           HG       LEU  27  -8.240  -1.808  -0.107
  196   HD11  LEU  27          HD11      LEU  27  -9.330  -0.759   1.738
  197   HD12  LEU  27          HD12      LEU  27  -8.335   0.354   0.782
  198   HD13  LEU  27          HD13      LEU  27  -7.756  -0.205   2.368
  199   HD21  LEU  27          HD21      LEU  27  -5.646  -1.015   1.183
  200   HD22  LEU  27          HD22      LEU  27  -6.334  -0.296  -0.273
  201   HD23  LEU  27          HD23      LEU  27  -5.841  -1.987  -0.273
  202    H    SER  28           HN       SER  28  -9.295  -4.364  -0.277
  203    HA   SER  28           HA       SER  28 -11.434  -2.581  -0.872
  204    HB2  SER  28           HB2      SER  28  -9.964  -3.303  -2.670
  205    HB3  SER  28           HB1      SER  28 -10.416  -4.980  -2.409
  206    HG   SER  28           HG       SER  28 -12.346  -3.018  -3.084
  207    H    SER  29           HN       SER  29 -11.166  -5.798   0.352
  208    HA   SER  29           HA       SER  29 -12.549  -7.196   1.365
  209    HB2  SER  29           HB2      SER  29 -14.618  -5.068   1.031
  210    HB3  SER  29           HB1      SER  29 -14.763  -6.450   2.125
  211    HG   SER  29           HG       SER  29 -12.434  -5.249   2.650
  212    H    THR  30           HN       THR  30 -12.757  -6.413  -1.734
  213    HA   THR  30           HA       THR  30 -15.104  -7.737  -2.556
  214    HB   THR  30           HB       THR  30 -14.098  -6.092  -4.033
  215    HG1  THR  30           HG1      THR  30 -15.106  -8.068  -4.990
  216   HG21  THR  30          HG21      THR  30 -11.936  -6.467  -5.146
  217   HG22  THR  30          HG22      THR  30 -11.699  -7.919  -4.169
  218   HG23  THR  30          HG23      THR  30 -11.763  -6.337  -3.397
  219    H    ASN  31           HN       ASN  31 -11.932  -8.778  -1.714
  220    HA   ASN  31           HA       ASN  31 -12.424 -11.451  -2.778
  221    HB2  ASN  31           HB2      ASN  31  -9.982 -10.224  -1.496
  222    HB3  ASN  31           HB1      ASN  31 -10.078 -11.924  -1.950
  223   HD21  ASN  31          HD21      ASN  31 -10.054 -12.461  -4.100
  224   HD22  ASN  31          HD22      ASN  31  -9.597 -11.362  -5.348
  225    H    VAL  32           HN       VAL  32 -13.237  -9.808  -0.192
  226    HA   VAL  32           HA       VAL  32 -12.947 -11.963   1.779
  227    HB   VAL  32           HB       VAL  32 -14.036  -9.128   2.054
  228   HG11  VAL  32          HG11      VAL  32 -13.383 -11.099   4.246
  229   HG12  VAL  32          HG12      VAL  32 -15.001 -10.619   3.745
  230   HG13  VAL  32          HG13      VAL  32 -13.915  -9.433   4.468
  231   HG21  VAL  32          HG21      VAL  32 -11.389 -10.262   2.913
  232   HG22  VAL  32          HG22      VAL  32 -11.961  -8.615   3.208
  233   HG23  VAL  32          HG23      VAL  32 -11.681  -9.179   1.555
  234    H    GLY  33           HN       GLY  33 -15.023 -10.729  -0.551
  235    HA2  GLY  33           HA2      GLY  33 -17.147 -11.343  -1.194
  236    HA3  GLY  33           HA1      GLY  33 -17.226 -12.403   0.213
  237    H    SER  34           HN       SER  34 -16.386  -9.053   0.479
  238    HA   SER  34           HA       SER  34 -19.021  -8.525   1.651
  239    HB2  SER  34           HB2      SER  34 -17.292  -8.957   3.398
  240    HB3  SER  34           HB1      SER  34 -16.339  -7.629   2.754
  241    HG   SER  34           HG       SER  34 -18.215  -6.283   3.202
  242    H    ASN  35           HN       ASN  35 -17.721  -7.958  -1.023
  243    HA   ASN  35           HA       ASN  35 -18.648  -5.390  -1.392
  244    HB2  ASN  35           HB2      ASN  35 -16.536  -4.725  -0.292
  245    HB3  ASN  35           HB1      ASN  35 -15.629  -5.693  -1.452
  246   HD21  ASN  35          HD21      ASN  35 -17.509  -2.830  -0.978
  247   HD22  ASN  35          HD22      ASN  35 -17.040  -2.059  -2.446
  248    H    THR  36           HN       THR  36 -19.171  -5.326  -3.505
  249    HA   THR  36           HA       THR  36 -18.262  -7.621  -5.084
  250    HB   THR  36           HB       THR  36 -20.604  -5.881  -5.810
  251    HG1  THR  36           HG1      THR  36 -20.419  -7.884  -3.777
  252   HG21  THR  36          HG21      THR  36 -21.482  -8.037  -6.589
  253   HG22  THR  36          HG22      THR  36 -20.060  -8.840  -5.916
  254   HG23  THR  36          HG23      THR  36 -19.880  -7.738  -7.284
  255    H    TYC  37           HN       ATY  37 -16.892  -4.876  -4.774
  256    HA   TYC  37           HA       ATY  37 -16.851  -4.185  -7.618
  257    HB1  TYC  37           HB1      ATY  37 -16.251  -1.867  -6.937
  258    HB2  TYC  37           HB2      ATY  37 -16.450  -2.333  -5.252
  259    HD1  TYC  37           HD1      ATY  37 -18.609  -2.501  -4.256
  260    HD2  TYC  37           HD2      ATY  37 -18.243  -1.780  -8.427
  261    HE1  TYC  37           HE1      ATY  37 -21.008  -1.963  -4.367
  262    HE2  TYC  37           HE2      ATY  37 -20.634  -1.238  -8.549
  263    HH   TYC  37           HH       ATY  37 -22.488  -0.670  -5.786
  264   HT21  TYC  37          HT21      ATY  37 -14.768  -3.264  -4.941
  265   HT22  TYC  37          HT22      ATY  37 -13.316  -3.915  -5.615
  Start of MODEL    9
    1    H1   LYS   1           HT1      LYS   1  10.230   7.323   9.621
    2    H2   LYS   1           HT2      LYS   1  11.172   5.958   9.383
    3    H3   LYS   1           HT3      LYS   1   9.574   5.769   9.882
    4    HA   LYS   1           HA       LYS   1   9.857   5.224   7.591
    5    HB2  LYS   1           HB2      LYS   1   8.458   7.892   7.926
    6    HB3  LYS   1           HB1      LYS   1   8.271   6.820   6.555
    7    HG2  LYS   1           HG2      LYS   1   7.326   5.107   8.043
    8    HG3  LYS   1           HG1      LYS   1   7.459   6.238   9.393
    9    HD2  LYS   1           HD2      LYS   1   5.998   7.806   8.196
   10    HD3  LYS   1           HD1      LYS   1   5.852   6.645   6.878
   11    HE2  LYS   1           HE2      LYS   1   4.856   5.027   8.427
   12    HE3  LYS   1           HE1      LYS   1   4.972   6.213   9.728
   13    HZ1  LYS   1           HZ1      LYS   1   3.368   6.508   7.244
   14    HZ2  LYS   1           HZ2      LYS   1   3.464   7.657   8.481
   15    HZ3  LYS   1           HZ3      LYS   1   2.765   6.164   8.770
   16    H    CYS   2           HN       CYS   2  10.416   5.930   5.465
   17    HA   CYS   2           HA       CYS   2  12.307   8.147   5.384
   18    HB2  CYS   2           HB2      CYS   2  13.570   6.694   3.727
   19    HB3  CYS   2           HB1      CYS   2  13.680   6.198   5.420
   20    H    ASN   3           HN       ASN   3  12.581   8.926   3.088
   21    HA   ASN   3           HA       ASN   3  10.047   8.604   1.623
   22    HB2  ASN   3           HB2      ASN   3   9.758  11.026   1.433
   23    HB3  ASN   3           HB1      ASN   3   9.767  10.531   3.120
   24   HD21  ASN   3          HD21      ASN   3  11.479  11.169   4.434
   25   HD22  ASN   3          HD22      ASN   3  12.619  12.364   3.963
   26    H    THR   4           HN       THR   4  13.100   8.123   1.282
   27    HA   THR   4           HA       THR   4  13.445   9.701  -1.140
   28    HB   THR   4           HB       THR   4  15.337   9.759   0.433
   29    HG1  THR   4           HG1      THR   4  16.382   9.896  -1.357
   30   HG21  THR   4          HG21      THR   4  16.673   7.735   0.878
   31   HG22  THR   4          HG22      THR   4  15.479   6.772   0.012
   32   HG23  THR   4          HG23      THR   4  15.034   7.578   1.515
   33    H    ALA   5           HN       ALA   5  14.267   8.620  -2.989
   34    HA   ALA   5           HA       ALA   5  12.631   6.476  -3.780
   35    HB1  ALA   5           HB1      ALA   5  13.791   6.617  -5.911
   36    HB2  ALA   5           HB2      ALA   5  15.028   7.642  -5.182
   37    HB3  ALA   5           HB3      ALA   5  13.368   8.225  -5.322
   38    H    THR   6           HN       THR   6  15.709   6.611  -2.338
   39    HA   THR   6           HA       THR   6  16.611   4.022  -3.128
   40    HB   THR   6           HB       THR   6  17.365   5.681  -0.717
   41    HG1  THR   6           HG1      THR   6  18.007   5.899  -3.421
   42   HG21  THR   6          HG21      THR   6  18.862   3.511  -2.200
   43   HG22  THR   6          HG22      THR   6  18.121   3.397  -0.605
   44   HG23  THR   6          HG23      THR   6  19.502   4.471  -0.851
   45    H    CYS   7           HN       CYS   7  14.251   5.141  -0.876
   46    HA   CYS   7           HA       CYS   7  14.628   2.742   0.831
   47    HB2  CYS   7           HB2      CYS   7  15.296   5.067   1.609
   48    HB3  CYS   7           HB1      CYS   7  13.635   5.340   1.685
   49    H    ALA   8           HN       ALA   8  12.336   5.328  -0.068
   50    HA   ALA   8           HA       ALA   8  10.163   4.165   1.238
   51    HB1  ALA   8           HB1      ALA   8  10.237   6.115  -1.049
   52    HB2  ALA   8           HB2      ALA   8  10.247   6.498   0.678
   53    HB3  ALA   8           HB3      ALA   8   8.823   5.743  -0.048
   54    H    THR   9           HN       THR   9  11.675   3.682  -1.748
   55    HA   THR   9           HA       THR   9   9.582   2.399  -3.222
   56    HB   THR   9           HB       THR   9  11.530   1.446  -4.475
   57    HG1  THR   9           HG1      THR   9  13.501   2.905  -3.769
   58   HG21  THR   9          HG21      THR   9  10.386   3.500  -5.188
   59   HG22  THR   9          HG22      THR   9  12.121   3.645  -5.471
   60   HG23  THR   9          HG23      THR   9  11.384   4.448  -4.085
   61    H    GLN  10           HN       GLN  10  11.914   1.434  -0.932
   62    HA   GLN  10           HA       GLN  10  11.759  -1.416  -1.262
   63    HB2  GLN  10           HB2      GLN  10  12.696   0.131   1.151
   64    HB3  GLN  10           HB1      GLN  10  13.124  -1.528   0.738
   65    HG2  GLN  10           HG2      GLN  10  13.893   0.970  -0.740
   66    HG3  GLN  10           HG1      GLN  10  14.935   0.013   0.299
   67   HE21  GLN  10          HE21      GLN  10  15.091   0.771  -2.470
   68   HE22  GLN  10          HE22      GLN  10  15.340  -0.679  -3.362
   69    H    ARG  11           HN       ARG  11  10.394   1.011   0.730
   70    HA   ARG  11           HA       ARG  11   8.920  -0.756   2.487
   71    HB2  ARG  11           HB2      ARG  11   8.065   2.063   1.892
   72    HB3  ARG  11           HB1      ARG  11   7.920   1.176   3.398
   73    HG2  ARG  11           HG2      ARG  11  10.466   2.280   2.220
   74    HG3  ARG  11           HG1      ARG  11   9.580   2.961   3.573
   75    HD2  ARG  11           HD2      ARG  11  10.876   0.241   3.502
   76    HD3  ARG  11           HD1      ARG  11  11.576   1.694   4.215
   77    HE   ARG  11           HE       ARG  11   9.087   1.323   5.378
   78   HH11  ARG  11          HH11      ARG  11  12.197  -0.380   5.293
   79   HH12  ARG  11          HH12      ARG  11  12.035  -1.076   6.831
   80   HH21  ARG  11          HH21      ARG  11   8.851   0.380   7.503
   81   HH22  ARG  11          HH22      ARG  11  10.079  -0.621   8.130
   82    H    LEU  12           HN       LEU  12   8.249   1.074  -0.433
   83    HA   LEU  12           HA       LEU  12   5.616   0.325  -0.888
   84    HB2  LEU  12           HB2      LEU  12   7.954   1.042  -2.519
   85    HB3  LEU  12           HB1      LEU  12   6.539   0.656  -3.376
   86    HG   LEU  12           HG       LEU  12   6.940   2.955  -1.435
   87   HD11  LEU  12          HD11      LEU  12   7.849   3.326  -3.661
   88   HD12  LEU  12          HD12      LEU  12   6.453   4.355  -3.366
   89   HD13  LEU  12          HD13      LEU  12   6.288   2.916  -4.372
   90   HD21  LEU  12          HD21      LEU  12   4.637   3.636  -1.961
   91   HD22  LEU  12          HD22      LEU  12   4.696   2.121  -1.076
   92   HD23  LEU  12          HD23      LEU  12   4.390   2.116  -2.817
   93    H    ALA  13           HN       ALA  13   8.682  -1.205  -1.536
   94    HA   ALA  13           HA       ALA  13   7.704  -3.249  -3.132
   95    HB1  ALA  13           HB1      ALA  13   9.852  -4.375  -2.734
   96    HB2  ALA  13           HB2      ALA  13  10.189  -3.252  -1.421
   97    HB3  ALA  13           HB3      ALA  13  10.087  -2.661  -3.074
   98    H    ASN  14           HN       ASN  14   8.117  -2.865   0.324
   99    HA   ASN  14           HA       ASN  14   7.418  -5.596   0.911
  100    HB2  ASN  14           HB2      ASN  14   7.680  -3.229   2.747
  101    HB3  ASN  14           HB1      ASN  14   7.172  -4.845   3.266
  102   HD21  ASN  14          HD21      ASN  14   9.671  -4.164   0.907
  103   HD22  ASN  14          HD22      ASN  14  10.970  -4.743   1.879
  104    H    PHE  15           HN       PHE  15   5.637  -3.001  -0.081
  105    HA   PHE  15           HA       PHE  15   3.372  -3.476   1.585
  106    HB2  PHE  15           HB2      PHE  15   3.391  -1.229   1.165
  107    HB3  PHE  15           HB1      PHE  15   4.413  -1.428  -0.243
  108    HD1  PHE  15           HD1      PHE  15   0.947  -1.265   0.977
  109    HD2  PHE  15           HD2      PHE  15   3.476  -1.588  -2.424
  110    HE1  PHE  15           HE1      PHE  15  -0.959  -0.742  -0.492
  111    HE2  PHE  15           HE2      PHE  15   1.614  -1.093  -3.894
  112    HZ   PHE  15           HZ       PHE  15  -0.638  -0.649  -2.935
  113    H    LEU  16           HN       LEU  16   4.821  -4.441  -1.373
  114    HA   LEU  16           HA       LEU  16   2.376  -5.815  -2.011
  115    HB2  LEU  16           HB2      LEU  16   2.193  -4.755  -3.838
  116    HB3  LEU  16           HB1      LEU  16   3.205  -3.616  -3.131
  117    HG   LEU  16           HG       LEU  16   4.367  -5.661  -5.032
  118   HD11  LEU  16          HD11      LEU  16   2.754  -4.246  -6.201
  119   HD12  LEU  16          HD12      LEU  16   4.405  -3.822  -6.661
  120   HD13  LEU  16          HD13      LEU  16   3.518  -2.806  -5.531
  121   HD21  LEU  16          HD21      LEU  16   5.393  -3.039  -3.979
  122   HD22  LEU  16          HD22      LEU  16   6.254  -4.121  -5.084
  123   HD23  LEU  16          HD23      LEU  16   5.919  -4.623  -3.422
  124    H    VAL  17           HN       VAL  17   4.872  -6.632  -0.683
  125    HA   VAL  17           HA       VAL  17   6.306  -8.204  -2.637
  126    HB   VAL  17           HB       VAL  17   7.606  -7.039  -0.904
  127   HG11  VAL  17          HG11      VAL  17   6.277  -8.824   1.084
  128   HG12  VAL  17          HG12      VAL  17   6.015  -7.094   0.920
  129   HG13  VAL  17          HG13      VAL  17   7.599  -7.709   1.428
  130   HG21  VAL  17          HG21      VAL  17   8.594  -9.039  -1.813
  131   HG22  VAL  17          HG22      VAL  17   7.764 -10.010  -0.572
  132   HG23  VAL  17          HG23      VAL  17   8.992  -8.821  -0.102
  133    H    HIS  18           HN       HIS  18   4.387  -8.769   0.206
  134    HA   HIS  18           HA       HIS  18   3.266 -11.117  -0.897
  135    HB2  HIS  18           HB2      HIS  18   3.770 -12.378   1.069
  136    HB3  HIS  18           HB1      HIS  18   5.221 -12.202   0.070
  137    HD1  HIS  18           HD1      HIS  18   6.155 -13.121   2.517
  138    HD2  HIS  18           HD2      HIS  18   4.775  -9.225   2.406
  139    HE1  HIS  18           HE1      HIS  18   7.183 -11.980   4.529
  140    HE2  HIS  18           HE2      HIS  18   6.265  -9.618   4.453
  141    H    SER  19           HN       SER  19   2.547  -8.507  -0.177
  142    HA   SER  19           HA       SER  19   0.867  -8.769   2.253
  143    HB2  SER  19           HB2      SER  19   1.906  -6.388   0.769
  144    HB3  SER  19           HB1      SER  19   0.984  -6.335   2.265
  145    HG   SER  19           HG       SER  19   3.427  -6.196   2.412
  146    H    SER  20           HN       SER  20   0.766  -9.233  -0.793
  147    HA   SER  20           HA       SER  20  -1.112  -7.454  -1.886
  148    HB2  SER  20           HB2      SER  20  -0.250 -10.133  -2.907
  149    HB3  SER  20           HB1      SER  20  -0.841  -8.751  -3.839
  150    HG   SER  20           HG       SER  20   1.469  -9.007  -3.798
  151    H    ASN  21           HN       ASN  21  -1.638  -9.923   0.224
  152    HA   ASN  21           HA       ASN  21  -4.333 -10.451  -0.820
  153    HB2  ASN  21           HB2      ASN  21  -2.419 -12.040   0.789
  154    HB3  ASN  21           HB1      ASN  21  -4.146 -12.452   0.828
  155   HD21  ASN  21          HD21      ASN  21  -1.855 -13.971  -0.059
  156   HD22  ASN  21          HD22      ASN  21  -2.134 -14.369  -1.708
  157    H    ASN  22           HN       ASN  22  -2.683  -8.653   1.545
  158    HA   ASN  22           HA       ASN  22  -4.970  -8.849   3.346
  159    HB2  ASN  22           HB2      ASN  22  -2.208  -9.432   3.833
  160    HB3  ASN  22           HB1      ASN  22  -2.940  -8.254   4.925
  161   HD21  ASN  22          HD21      ASN  22  -4.813 -10.689   3.316
  162   HD22  ASN  22          HD22      ASN  22  -5.139 -11.655   4.679
  163    H    PHE  23           HN       PHE  23  -2.355  -7.038   2.195
  164    HA   PHE  23           HA       PHE  23  -2.251  -4.860   3.781
  165    HB2  PHE  23           HB2      PHE  23  -0.896  -3.906   2.038
  166    HB3  PHE  23           HB1      PHE  23  -0.781  -5.654   2.090
  167    HD1  PHE  23           HD1      PHE  23  -0.167  -3.614  -0.168
  168    HD2  PHE  23           HD2      PHE  23  -3.240  -6.340   0.660
  169    HE1  PHE  23           HE1      PHE  23  -0.508  -3.858  -2.522
  170    HE2  PHE  23           HE2      PHE  23  -3.663  -6.647  -1.708
  171    HZ   PHE  23           HZ       PHE  23  -2.301  -5.371  -3.383
  172    H    GLY  24           HN       GLY  24  -4.129  -4.208   4.357
  173    HA2  GLY  24           HA2      GLY  24  -6.168  -3.061   4.384
  174    HA3  GLY  24           HA1      GLY  24  -5.581  -2.084   3.079
  175    H    ALA  25           HN       ALA  25  -6.037  -5.525   3.238
  176    HA   ALA  25           HA       ALA  25  -8.066  -5.390   1.153
  177    HB1  ALA  25           HB1      ALA  25  -6.108  -6.776   0.670
  178    HB2  ALA  25           HB2      ALA  25  -7.549  -7.794   0.838
  179    HB3  ALA  25           HB3      ALA  25  -6.376  -7.684   2.158
  180    H    ILE  26           HN       ILE  26  -7.080  -6.915   4.060
  181    HA   ILE  26           HA       ILE  26  -9.763  -7.383   4.823
  182    HB   ILE  26           HB       ILE  26  -8.382  -9.246   5.296
  183   HG12  ILE  26          HG12      ILE  26  -8.362  -7.689   7.791
  184   HG13  ILE  26          HG11      ILE  26  -9.838  -8.462   7.223
  185   HG21  ILE  26          HG21      ILE  26  -6.229  -9.047   6.555
  186   HG22  ILE  26          HG22      ILE  26  -6.399  -7.282   6.388
  187   HG23  ILE  26          HG23      ILE  26  -6.227  -8.284   4.964
  188   HD11  ILE  26          HD11      ILE  26  -7.275  -9.811   8.114
  189   HD12  ILE  26          HD12      ILE  26  -8.646 -10.665   7.398
  190   HD13  ILE  26          HD13      ILE  26  -8.830  -9.841   8.943
  191    H    LEU  27           HN       LEU  27  -6.943  -5.465   5.608
  192    HA   LEU  27           HA       LEU  27  -7.799  -4.187   7.930
  193    HB2  LEU  27           HB2      LEU  27  -5.617  -3.869   7.645
  194    HB3  LEU  27           HB1      LEU  27  -5.726  -3.980   5.917
  195    HG   LEU  27           HG       LEU  27  -6.342  -1.540   5.869
  196   HD11  LEU  27          HD11      LEU  27  -5.897  -0.194   7.734
  197   HD12  LEU  27          HD12      LEU  27  -5.583  -1.620   8.750
  198   HD13  LEU  27          HD13      LEU  27  -7.210  -1.324   8.078
  199   HD21  LEU  27          HD21      LEU  27  -4.106  -0.731   6.339
  200   HD22  LEU  27          HD22      LEU  27  -4.095  -2.240   5.427
  201   HD23  LEU  27          HD23      LEU  27  -3.726  -2.248   7.155
  202    H    SER  28           HN       SER  28  -8.216  -3.449   4.599
  203    HA   SER  28           HA       SER  28  -9.783  -1.110   5.296
  204    HB2  SER  28           HB2      SER  28  -8.185  -0.850   3.437
  205    HB3  SER  28           HB1      SER  28  -9.017  -2.104   2.532
  206    HG   SER  28           HG       SER  28 -10.436   0.135   3.416
  207    H    SER  29           HN       SER  29 -10.249  -4.280   5.021
  208    HA   SER  29           HA       SER  29 -11.905  -5.766   4.816
  209    HB2  SER  29           HB2      SER  29 -13.852  -3.512   5.003
  210    HB3  SER  29           HB1      SER  29 -13.966  -5.165   5.626
  211    HG   SER  29           HG       SER  29 -12.736  -2.963   6.705
  212    H    THR  30           HN       THR  30 -11.136  -4.022   2.357
  213    HA   THR  30           HA       THR  30 -13.385  -3.871   0.679
  214    HB   THR  30           HB       THR  30 -11.439  -2.460   0.256
  215    HG1  THR  30           HG1      THR  30 -11.105  -3.740  -2.076
  216   HG21  THR  30          HG21      THR  30  -9.678  -3.982   0.978
  217   HG22  THR  30          HG22      THR  30  -9.339  -3.354  -0.633
  218   HG23  THR  30          HG23      THR  30  -9.956  -4.998  -0.438
  219    H    ASN  31           HN       ASN  31 -11.250  -6.484   1.434
  220    HA   ASN  31           HA       ASN  31 -12.423  -7.991  -0.785
  221    HB2  ASN  31           HB2      ASN  31  -9.905  -8.501   0.775
  222    HB3  ASN  31           HB1      ASN  31 -10.686  -9.813  -0.102
  223   HD21  ASN  31          HD21      ASN  31  -8.885  -6.842  -0.392
  224   HD22  ASN  31          HD22      ASN  31  -8.592  -6.989  -2.083
  225    H    VAL  32           HN       VAL  32 -13.170  -7.363   2.186
  226    HA   VAL  32           HA       VAL  32 -14.186 -10.041   2.793
  227    HB   VAL  32           HB       VAL  32 -14.407  -7.536   4.503
  228   HG11  VAL  32          HG11      VAL  32 -15.922  -9.314   5.135
  229   HG12  VAL  32          HG12      VAL  32 -14.677  -9.106   6.367
  230   HG13  VAL  32          HG13      VAL  32 -14.578 -10.453   5.233
  231   HG21  VAL  32          HG21      VAL  32 -12.215  -9.610   4.615
  232   HG22  VAL  32          HG22      VAL  32 -12.439  -8.297   5.769
  233   HG23  VAL  32          HG23      VAL  32 -12.036  -7.940   4.088
  234    H    GLY  33           HN       GLY  33 -14.938  -7.147   1.287
  235    HA2  GLY  33           HA2      GLY  33 -16.887  -6.616   0.114
  236    HA3  GLY  33           HA1      GLY  33 -17.752  -7.821   1.057
  237    H    SER  34           HN       SER  34 -16.074  -6.245   3.232
  238    HA   SER  34           HA       SER  34 -18.460  -4.929   4.208
  239    HB2  SER  34           HB2      SER  34 -15.812  -5.224   5.548
  240    HB3  SER  34           HB1      SER  34 -17.392  -4.913   6.267
  241    HG   SER  34           HG       SER  34 -17.866  -7.003   4.976
  242    H    ASN  35           HN       ASN  35 -16.285  -3.876   2.191
  243    HA   ASN  35           HA       ASN  35 -15.812  -1.286   3.498
  244    HB2  ASN  35           HB2      ASN  35 -13.919  -2.375   2.223
  245    HB3  ASN  35           HB1      ASN  35 -14.881  -2.230   0.758
  246   HD21  ASN  35          HD21      ASN  35 -13.005  -0.570   3.117
  247   HD22  ASN  35          HD22      ASN  35 -12.872   0.932   2.273
  248    H    THR  36           HN       THR  36 -17.553  -2.986   1.146
  249    HA   THR  36           HA       THR  36 -18.919  -0.657   0.150
  250    HB   THR  36           HB       THR  36 -19.336  -3.567  -0.523
  251    HG1  THR  36           HG1      THR  36 -17.527  -1.641  -1.589
  252   HG21  THR  36          HG21      THR  36 -20.198  -2.683  -2.610
  253   HG22  THR  36          HG22      THR  36 -19.884  -1.034  -2.025
  254   HG23  THR  36          HG23      THR  36 -21.089  -2.055  -1.212
  255    H    TYC  37           HN       ATY  37 -19.375  -3.416   1.955
  256    HA   TYC  37           HA       ATY  37 -22.107  -2.590   2.770
  257    HB1  TYC  37           HB1      ATY  37 -22.607  -4.972   3.251
  258    HB2  TYC  37           HB2      ATY  37 -21.002  -5.409   2.682
  259    HD1  TYC  37           HD1      ATY  37 -24.344  -4.332   1.665
  260    HD2  TYC  37           HD2      ATY  37 -20.459  -5.404   0.330
  261    HE1  TYC  37           HE1      ATY  37 -25.202  -4.571  -0.627
  262    HE2  TYC  37           HE2      ATY  37 -21.305  -5.643  -1.961
  263    HH   TYC  37           HH       ATY  37 -24.388  -4.544  -2.893
  264   HT21  TYC  37          HT21      ATY  37 -21.477  -1.397   4.529
  265   HT22  TYC  37          HT22      ATY  37 -20.801  -2.087   5.954
  Start of MODEL   10
    1    H1   LYS   1           HT1      LYS   1  11.038   7.729   9.927
    2    H2   LYS   1           HT2      LYS   1  12.356   6.698   9.913
    3    H3   LYS   1           HT3      LYS   1  10.938   6.207  10.682
    4    HA   LYS   1           HA       LYS   1  11.211   5.122   8.590
    5    HB2  LYS   1           HB2      LYS   1   9.070   7.270   8.506
    6    HB3  LYS   1           HB1      LYS   1   9.106   5.859   7.468
    7    HG2  LYS   1           HG2      LYS   1   8.873   4.409   9.413
    8    HG3  LYS   1           HG1      LYS   1   8.872   5.819  10.469
    9    HD2  LYS   1           HD2      LYS   1   6.846   6.632   9.358
   10    HD3  LYS   1           HD1      LYS   1   6.840   5.203   8.326
   11    HE2  LYS   1           HE2      LYS   1   6.634   3.779  10.304
   12    HE3  LYS   1           HE1      LYS   1   6.634   5.207  11.333
   13    HZ1  LYS   1           HZ1      LYS   1   4.556   5.912  10.270
   14    HZ2  LYS   1           HZ2      LYS   1   4.407   4.377  10.938
   15    HZ3  LYS   1           HZ3      LYS   1   4.596   4.538   9.284
   16    H    CYS   2           HN       CYS   2  10.843   5.640   6.087
   17    HA   CYS   2           HA       CYS   2  12.510   7.952   5.445
   18    HB2  CYS   2           HB2      CYS   2  13.505   6.543   3.633
   19    HB3  CYS   2           HB1      CYS   2  13.979   6.068   5.274
   20    H    ASN   3           HN       ASN   3  12.382   8.531   3.135
   21    HA   ASN   3           HA       ASN   3   9.944   7.846   1.747
   22    HB2  ASN   3           HB2      ASN   3   9.095  10.181   1.680
   23    HB3  ASN   3           HB1      ASN   3   9.087   9.509   3.303
   24   HD21  ASN   3          HD21      ASN   3  10.542  11.831   1.189
   25   HD22  ASN   3          HD22      ASN   3  11.356  12.738   2.418
   26    H    THR   4           HN       THR   4  12.859   7.829   1.379
   27    HA   THR   4           HA       THR   4  13.224   9.747  -0.798
   28    HB   THR   4           HB       THR   4  15.086   9.722   0.807
   29    HG1  THR   4           HG1      THR   4  15.865  10.047  -1.168
   30   HG21  THR   4          HG21      THR   4  14.770   7.457   1.711
   31   HG22  THR   4          HG22      THR   4  16.440   7.739   1.219
   32   HG23  THR   4          HG23      THR   4  15.366   6.792   0.190
   33    H    ALA   5           HN       ALA   5  14.280   8.886  -2.715
   34    HA   ALA   5           HA       ALA   5  12.677   6.899  -3.921
   35    HB1  ALA   5           HB1      ALA   5  13.606   8.779  -5.161
   36    HB2  ALA   5           HB2      ALA   5  14.087   7.245  -5.893
   37    HB3  ALA   5           HB3      ALA   5  15.231   8.149  -4.905
   38    H    THR   6           HN       THR   6  15.593   6.726  -2.199
   39    HA   THR   6           HA       THR   6  16.337   4.159  -3.310
   40    HB   THR   6           HB       THR   6  17.538   5.896  -1.156
   41    HG1  THR   6           HG1      THR   6  18.123   5.452  -3.886
   42   HG21  THR   6          HG21      THR   6  19.560   4.481  -1.365
   43   HG22  THR   6          HG22      THR   6  18.676   3.410  -2.470
   44   HG23  THR   6          HG23      THR   6  18.152   3.587  -0.789
   45    H    CYS   7           HN       CYS   7  14.154   5.168  -0.968
   46    HA   CYS   7           HA       CYS   7  14.592   2.727   0.648
   47    HB2  CYS   7           HB2      CYS   7  15.385   4.951   1.547
   48    HB3  CYS   7           HB1      CYS   7  13.738   5.313   1.738
   49    H    ALA   8           HN       ALA   8  12.314   5.300  -0.304
   50    HA   ALA   8           HA       ALA   8  10.116   4.132   0.968
   51    HB1  ALA   8           HB1      ALA   8   8.781   5.652  -0.395
   52    HB2  ALA   8           HB2      ALA   8  10.212   6.029  -1.368
   53    HB3  ALA   8           HB3      ALA   8  10.162   6.462   0.347
   54    H    THR   9           HN       THR   9  11.827   3.601  -1.875
   55    HA   THR   9           HA       THR   9   9.873   2.236  -3.446
   56    HB   THR   9           HB       THR   9  11.993   1.284  -4.497
   57    HG1  THR   9           HG1      THR   9  13.847   2.657  -3.881
   58   HG21  THR   9          HG21      THR   9  12.427   3.425  -5.646
   59   HG22  THR   9          HG22      THR   9  11.555   4.275  -4.374
   60   HG23  THR   9          HG23      THR   9  10.694   3.159  -5.437
   61    H    GLN  10           HN       GLN  10  12.034   1.437  -0.991
   62    HA   GLN  10           HA       GLN  10  11.888  -1.427  -1.169
   63    HB2  GLN  10           HB2      GLN  10  12.672   0.199   1.251
   64    HB3  GLN  10           HB1      GLN  10  13.155  -1.460   0.875
   65    HG2  GLN  10           HG2      GLN  10  14.017   1.086  -0.466
   66    HG3  GLN  10           HG1      GLN  10  15.009   0.029   0.529
   67   HE21  GLN  10          HE21      GLN  10  15.325   0.999  -2.167
   68   HE22  GLN  10          HE22      GLN  10  15.478  -0.375  -3.179
   69    H    ARG  11           HN       ARG  11  10.427   1.155   0.601
   70    HA   ARG  11           HA       ARG  11   8.715  -0.388   2.273
   71    HB2  ARG  11           HB2      ARG  11   8.188   2.396   1.204
   72    HB3  ARG  11           HB1      ARG  11   7.479   1.668   2.638
   73    HG2  ARG  11           HG2      ARG  11  10.345   2.505   2.248
   74    HG3  ARG  11           HG1      ARG  11   9.148   3.263   3.304
   75    HD2  ARG  11           HD2      ARG  11  10.332   0.524   3.523
   76    HD3  ARG  11           HD1      ARG  11  10.641   1.913   4.571
   77    HE   ARG  11           HE       ARG  11   8.103   1.755   4.973
   78   HH11  ARG  11          HH11      ARG  11  10.252  -1.055   4.668
   79   HH12  ARG  11          HH12      ARG  11   9.274  -2.080   5.608
   80   HH21  ARG  11          HH21      ARG  11   6.777   0.365   6.226
   81   HH22  ARG  11          HH22      ARG  11   7.231  -1.251   6.543
   82    H    LEU  12           HN       LEU  12   8.417   0.995  -0.933
   83    HA   LEU  12           HA       LEU  12   5.832   0.216  -1.556
   84    HB2  LEU  12           HB2      LEU  12   8.341   0.649  -3.032
   85    HB3  LEU  12           HB1      LEU  12   6.990   0.180  -3.948
   86    HG   LEU  12           HG       LEU  12   7.353   2.735  -2.361
   87   HD11  LEU  12          HD11      LEU  12   8.345   2.695  -4.607
   88   HD12  LEU  12          HD12      LEU  12   6.997   3.823  -4.502
   89   HD13  LEU  12          HD13      LEU  12   6.774   2.257  -5.274
   90   HD21  LEU  12          HD21      LEU  12   5.084   3.371  -3.112
   91   HD22  LEU  12          HD22      LEU  12   5.086   2.054  -1.951
   92   HD23  LEU  12          HD23      LEU  12   4.834   1.715  -3.666
   93    H    ALA  13           HN       ALA  13   8.930  -1.425  -1.783
   94    HA   ALA  13           HA       ALA  13   8.003  -3.683  -3.087
   95    HB1  ALA  13           HB1      ALA  13  10.363  -3.459  -1.216
   96    HB2  ALA  13           HB2      ALA  13  10.384  -3.122  -2.944
   97    HB3  ALA  13           HB3      ALA  13  10.093  -4.763  -2.371
   98    H    ASN  14           HN       ASN  14   8.114  -2.752   0.250
   99    HA   ASN  14           HA       ASN  14   7.287  -5.330   1.287
  100    HB2  ASN  14           HB2      ASN  14   7.519  -2.658   2.661
  101    HB3  ASN  14           HB1      ASN  14   6.956  -4.144   3.430
  102   HD21  ASN  14          HD21      ASN  14   9.570  -4.061   1.139
  103   HD22  ASN  14          HD22      ASN  14  10.828  -4.407   2.269
  104    H    PHE  15           HN       PHE  15   5.662  -2.915  -0.315
  105    HA   PHE  15           HA       PHE  15   3.282  -3.061   1.302
  106    HB2  PHE  15           HB2      PHE  15   3.309  -0.876   0.668
  107    HB3  PHE  15           HB1      PHE  15   4.538  -1.188  -0.541
  108    HD1  PHE  15           HD1      PHE  15   0.956  -0.778   0.094
  109    HD2  PHE  15           HD2      PHE  15   3.912  -1.646  -2.837
  110    HE1  PHE  15           HE1      PHE  15  -0.689  -0.368  -1.693
  111    HE2  PHE  15           HE2      PHE  15   2.306  -1.257  -4.613
  112    HZ   PHE  15           HZ       PHE  15  -0.023  -0.604  -4.057
  113    H    LEU  16           HN       LEU  16   4.848  -4.423  -1.385
  114    HA   LEU  16           HA       LEU  16   2.397  -5.744  -2.084
  115    HB2  LEU  16           HB2      LEU  16   2.483  -4.987  -4.069
  116    HB3  LEU  16           HB1      LEU  16   3.505  -3.790  -3.449
  117    HG   LEU  16           HG       LEU  16   4.644  -6.209  -4.870
  118   HD11  LEU  16          HD11      LEU  16   3.292  -4.883  -6.406
  119   HD12  LEU  16          HD12      LEU  16   5.010  -4.679  -6.757
  120   HD13  LEU  16          HD13      LEU  16   4.130  -3.420  -5.897
  121   HD21  LEU  16          HD21      LEU  16   6.164  -5.094  -3.308
  122   HD22  LEU  16          HD22      LEU  16   5.830  -3.554  -4.107
  123   HD23  LEU  16          HD23      LEU  16   6.666  -4.840  -4.985
  124    H    VAL  17           HN       VAL  17   4.610  -6.489  -0.345
  125    HA   VAL  17           HA       VAL  17   6.180  -8.398  -1.829
  126    HB   VAL  17           HB       VAL  17   7.279  -7.054  -0.062
  127   HG11  VAL  17          HG11      VAL  17   6.920  -7.506   2.304
  128   HG12  VAL  17          HG12      VAL  17   5.588  -8.582   1.871
  129   HG13  VAL  17          HG13      VAL  17   5.467  -6.856   1.529
  130   HG21  VAL  17          HG21      VAL  17   8.269  -9.174  -0.634
  131   HG22  VAL  17          HG22      VAL  17   7.242  -9.975   0.574
  132   HG23  VAL  17          HG23      VAL  17   8.469  -8.800   1.084
  133    H    HIS  18           HN       HIS  18   3.781  -8.425   0.715
  134    HA   HIS  18           HA       HIS  18   2.681 -10.863  -0.265
  135    HB2  HIS  18           HB2      HIS  18   2.867 -11.999   1.685
  136    HB3  HIS  18           HB1      HIS  18   4.523 -11.543   1.331
  137    HD1  HIS  18           HD1      HIS  18   3.453 -12.451   4.199
  138    HD2  HIS  18           HD2      HIS  18   3.939  -8.519   2.989
  139    HE1  HIS  18           HE1      HIS  18   3.716 -11.135   6.305
  140    HE2  HIS  18           HE2      HIS  18   4.291  -8.826   5.533
  141    H    SER  19           HN       SER  19   2.155  -7.968   0.152
  142    HA   SER  19           HA       SER  19   0.481  -7.830   2.563
  143    HB2  SER  19           HB2      SER  19   1.534  -5.673   0.804
  144    HB3  SER  19           HB1      SER  19   0.957  -5.508   2.458
  145    HG   SER  19           HG       SER  19   3.257  -5.603   2.423
  146    H    SER  20           HN       SER  20   0.193  -7.931  -0.753
  147    HA   SER  20           HA       SER  20  -1.993  -6.212  -1.197
  148    HB2  SER  20           HB2      SER  20  -1.203  -8.580  -2.874
  149    HB3  SER  20           HB1      SER  20  -1.975  -7.078  -3.400
  150    HG   SER  20           HG       SER  20  -0.059  -6.322  -3.661
  151    H    ASN  21           HN       ASN  21  -2.190  -8.645   0.721
  152    HA   ASN  21           HA       ASN  21  -4.936  -9.307   0.029
  153    HB2  ASN  21           HB2      ASN  21  -2.683 -11.094   0.663
  154    HB3  ASN  21           HB1      ASN  21  -4.311 -11.632   1.127
  155   HD21  ASN  21          HD21      ASN  21  -2.067 -11.164  -1.460
  156   HD22  ASN  21          HD22      ASN  21  -3.064 -11.776  -2.728
  157    H    ASN  22           HN       ASN  22  -2.948  -7.821   2.234
  158    HA   ASN  22           HA       ASN  22  -4.544  -8.581   4.540
  159    HB2  ASN  22           HB2      ASN  22  -1.741  -8.999   4.054
  160    HB3  ASN  22           HB1      ASN  22  -2.141  -8.130   5.536
  161   HD21  ASN  22          HD21      ASN  22  -4.324 -10.368   4.090
  162   HD22  ASN  22          HD22      ASN  22  -4.191 -11.643   5.189
  163    H    PHE  23           HN       PHE  23  -2.304  -6.448   3.098
  164    HA   PHE  23           HA       PHE  23  -1.922  -4.550   4.950
  165    HB2  PHE  23           HB2      PHE  23  -1.100  -3.175   3.147
  166    HB3  PHE  23           HB1      PHE  23  -0.792  -4.881   2.877
  167    HD1  PHE  23           HD1      PHE  23  -0.732  -2.594   0.873
  168    HD2  PHE  23           HD2      PHE  23  -3.582  -5.506   1.916
  169    HE1  PHE  23           HE1      PHE  23  -1.580  -2.508  -1.391
  170    HE2  PHE  23           HE2      PHE  23  -4.507  -5.463  -0.357
  171    HZ   PHE  23           HZ       PHE  23  -3.510  -3.933  -2.057
  172    H    GLY  24           HN       GLY  24  -3.408  -3.924   6.104
  173    HA2  GLY  24           HA2      GLY  24  -5.262  -2.892   6.953
  174    HA3  GLY  24           HA1      GLY  24  -5.292  -1.781   5.629
  175    H    ALA  25           HN       ALA  25  -5.553  -5.239   5.477
  176    HA   ALA  25           HA       ALA  25  -8.317  -5.025   4.650
  177    HB1  ALA  25           HB1      ALA  25  -7.954  -7.381   3.908
  178    HB2  ALA  25           HB2      ALA  25  -6.302  -7.268   4.518
  179    HB3  ALA  25           HB3      ALA  25  -6.802  -6.253   3.166
  180    H    ILE  26           HN       ILE  26  -6.026  -6.778   6.524
  181    HA   ILE  26           HA       ILE  26  -7.987  -7.695   8.297
  182    HB   ILE  26           HB       ILE  26  -6.298  -9.286   7.840
  183   HG12  ILE  26          HG12      ILE  26  -5.542  -7.996  10.359
  184   HG13  ILE  26          HG11      ILE  26  -6.974  -9.015  10.257
  185   HG21  ILE  26          HG21      ILE  26  -4.320  -7.116   8.473
  186   HG22  ILE  26          HG22      ILE  26  -4.586  -7.874   6.906
  187   HG23  ILE  26          HG23      ILE  26  -3.863  -8.803   8.223
  188   HD11  ILE  26          HD11      ILE  26  -4.078  -9.860   9.965
  189   HD12  ILE  26          HD12      ILE  26  -5.457 -10.919   9.649
  190   HD13  ILE  26          HD13      ILE  26  -5.188 -10.290  11.269
  191    H    LEU  27           HN       LEU  27  -5.345  -5.374   8.202
  192    HA   LEU  27           HA       LEU  27  -5.350  -4.562  10.865
  193    HB2  LEU  27           HB2      LEU  27  -3.587  -3.464   9.980
  194    HB3  LEU  27           HB1      LEU  27  -4.215  -3.752   8.381
  195    HG   LEU  27           HG       LEU  27  -5.472  -1.588   8.531
  196   HD11  LEU  27          HD11      LEU  27  -3.914  -1.153  11.061
  197   HD12  LEU  27          HD12      LEU  27  -5.674  -1.351  10.880
  198   HD13  LEU  27          HD13      LEU  27  -4.868   0.040  10.154
  199   HD21  LEU  27          HD21      LEU  27  -3.334  -1.724   7.396
  200   HD22  LEU  27          HD22      LEU  27  -2.494  -1.403   8.914
  201   HD23  LEU  27          HD23      LEU  27  -3.528  -0.169   8.201
  202    H    SER  28           HN       SER  28  -7.113  -3.428   8.112
  203    HA   SER  28           HA       SER  28  -8.538  -1.607   9.744
  204    HB2  SER  28           HB2      SER  28  -8.704  -2.309   6.888
  205    HB3  SER  28           HB1      SER  28  -9.852  -1.171   7.609
  206    HG   SER  28           HG       SER  28  -8.003   0.020   8.292
  207    H    SER  29           HN       SER  29  -8.992  -4.843   8.955
  208    HA   SER  29           HA       SER  29 -10.609  -6.394   9.343
  209    HB2  SER  29           HB2      SER  29 -11.893  -4.204  11.020
  210    HB3  SER  29           HB1      SER  29 -12.246  -5.927  11.126
  211    HG   SER  29           HG       SER  29 -10.615  -4.767  12.600
  212    H    THR  30           HN       THR  30 -10.755  -4.947   7.024
  213    HA   THR  30           HA       THR  30 -13.378  -3.796   6.672
  214    HB   THR  30           HB       THR  30 -11.278  -2.804   5.684
  215    HG1  THR  30           HG1      THR  30 -12.907  -1.974   4.670
  216   HG21  THR  30          HG21      THR  30 -11.503  -5.105   3.739
  217   HG22  THR  30          HG22      THR  30 -10.258  -4.920   4.964
  218   HG23  THR  30          HG23      THR  30 -10.357  -3.760   3.632
  219    H    ASN  31           HN       ASN  31 -12.253  -6.970   6.549
  220    HA   ASN  31           HA       ASN  31 -14.506  -7.738   4.866
  221    HB2  ASN  31           HB2      ASN  31 -13.186  -9.285   3.515
  222    HB3  ASN  31           HB1      ASN  31 -12.629  -7.633   3.299
  223   HD21  ASN  31          HD21      ASN  31 -11.932 -10.733   4.502
  224   HD22  ASN  31          HD22      ASN  31 -10.276 -10.439   4.854
  225    H    VAL  32           HN       VAL  32 -14.385  -7.819   7.541
  226    HA   VAL  32           HA       VAL  32 -13.718 -10.497   8.415
  227    HB   VAL  32           HB       VAL  32 -15.444  -8.503   9.890
  228   HG11  VAL  32          HG11      VAL  32 -15.581 -10.732  10.787
  229   HG12  VAL  32          HG12      VAL  32 -14.668  -9.702  11.898
  230   HG13  VAL  32          HG13      VAL  32 -13.825 -10.840  10.851
  231   HG21  VAL  32          HG21      VAL  32 -12.454  -8.810  10.017
  232   HG22  VAL  32          HG22      VAL  32 -13.443  -7.809  11.089
  233   HG23  VAL  32          HG23      VAL  32 -13.354  -7.435   9.367
  234    H    GLY  33           HN       GLY  33 -16.637  -8.702   7.550
  235    HA2  GLY  33           HA2      GLY  33 -18.174 -10.521   6.443
  236    HA3  GLY  33           HA1      GLY  33 -18.248 -11.089   8.102
  237    H    SER  34           HN       SER  34 -18.183  -8.327   9.157
  238    HA   SER  34           HA       SER  34 -21.012  -7.760   8.648
  239    HB2  SER  34           HB2      SER  34 -19.155  -6.646  10.784
  240    HB3  SER  34           HB1      SER  34 -20.896  -6.365  10.696
  241    HG   SER  34           HG       SER  34 -20.858  -8.841  10.614
  242    H    ASN  35           HN       ASN  35 -18.040  -5.912   9.125
  243    HA   ASN  35           HA       ASN  35 -16.949  -4.379   7.907
  244    HB2  ASN  35           HB2      ASN  35 -18.735  -5.211   5.646
  245    HB3  ASN  35           HB1      ASN  35 -17.188  -4.375   5.507
  246   HD21  ASN  35          HD21      ASN  35 -18.003  -6.821   4.293
  247   HD22  ASN  35          HD22      ASN  35 -16.939  -8.059   4.831
  248    H    THR  36           HN       THR  36 -19.593  -3.688   9.180
  249    HA   THR  36           HA       THR  36 -20.276  -1.467   7.471
  250    HB   THR  36           HB       THR  36 -22.214  -2.731   8.108
  251    HG1  THR  36           HG1      THR  36 -22.409  -0.470   8.072
  252   HG21  THR  36          HG21      THR  36 -21.467  -2.267  11.004
  253   HG22  THR  36          HG22      THR  36 -21.395  -3.811  10.155
  254   HG23  THR  36          HG23      THR  36 -22.953  -3.036  10.444
  255    H    TYC  37           HN       ATY  37 -18.856   0.059   7.730
  256    HA   TYC  37           HA       ATY  37 -18.361   1.051  10.454
  257    HB1  TYC  37           HB1      ATY  37 -16.080   1.649   9.789
  258    HB2  TYC  37           HB2      ATY  37 -16.379   1.055   8.160
  259    HD1  TYC  37           HD1      ATY  37 -15.957  -1.169   7.607
  260    HD2  TYC  37           HD2      ATY  37 -16.189  -0.069  11.707
  261    HE1  TYC  37           HE1      ATY  37 -15.200  -3.410   8.247
  262    HE2  TYC  37           HE2      ATY  37 -15.433  -2.316  12.357
  263    HH   TYC  37           HH       ATY  37 -14.192  -4.511  10.026
  264   HT21  TYC  37          HT21      ATY  37 -19.831   2.655  10.384
  265   HT22  TYC  37          HT22      ATY  37 -19.770   3.997   9.305
  Start of MODEL   11
    1    H1   LYS   1           HT1      LYS   1  11.753   5.572   9.544
    2    H2   LYS   1           HT2      LYS   1  10.240   5.762  10.270
    3    H3   LYS   1           HT3      LYS   1  11.151   7.105   9.777
    4    HA   LYS   1           HA       LYS   1  10.197   5.057   7.929
    5    HB2  LYS   1           HB2      LYS   1   8.547   6.747   7.154
    6    HB3  LYS   1           HB1      LYS   1   8.252   6.248   8.811
    7    HG2  LYS   1           HG2      LYS   1   9.307   8.311   9.603
    8    HG3  LYS   1           HG1      LYS   1   9.568   8.818   7.931
    9    HD2  LYS   1           HD2      LYS   1   7.139   8.764   7.572
   10    HD3  LYS   1           HD1      LYS   1   6.915   8.276   9.251
   11    HE2  LYS   1           HE2      LYS   1   7.944  10.362   9.991
   12    HE3  LYS   1           HE1      LYS   1   8.167  10.837   8.307
   13    HZ1  LYS   1           HZ1      LYS   1   6.206  11.864   9.311
   14    HZ2  LYS   1           HZ2      LYS   1   5.518  10.349   9.581
   15    HZ3  LYS   1           HZ3      LYS   1   5.785  10.883   8.016
   16    H    CYS   2           HN       CYS   2  10.418   5.846   5.665
   17    HA   CYS   2           HA       CYS   2  12.398   7.932   5.383
   18    HB2  CYS   2           HB2      CYS   2  13.623   6.457   3.726
   19    HB3  CYS   2           HB1      CYS   2  13.818   6.027   5.426
   20    H    ASN   3           HN       ASN   3  12.529   8.771   3.190
   21    HA   ASN   3           HA       ASN   3  10.009   8.394   1.708
   22    HB2  ASN   3           HB2      ASN   3  11.043  11.011   2.812
   23    HB3  ASN   3           HB1      ASN   3   9.805  10.909   1.574
   24   HD21  ASN   3          HD21      ASN   3   8.483   8.599   2.771
   25   HD22  ASN   3          HD22      ASN   3   7.689   9.191   4.175
   26    H    THR   4           HN       THR   4  13.024   8.045   1.393
   27    HA   THR   4           HA       THR   4  13.416   9.743  -0.944
   28    HB   THR   4           HB       THR   4  15.284   9.768   0.641
   29    HG1  THR   4           HG1      THR   4  16.657   9.738  -0.941
   30   HG21  THR   4          HG21      THR   4  14.864   7.565   1.662
   31   HG22  THR   4          HG22      THR   4  16.552   7.757   1.181
   32   HG23  THR   4          HG23      THR   4  15.447   6.798   0.187
   33    H    ALA   5           HN       ALA   5  14.290   8.751  -2.822
   34    HA   ALA   5           HA       ALA   5  12.672   6.662  -3.800
   35    HB1  ALA   5           HB1      ALA   5  13.947   6.896  -5.858
   36    HB2  ALA   5           HB2      ALA   5  15.152   7.860  -4.998
   37    HB3  ALA   5           HB3      ALA   5  13.512   8.476  -5.202
   38    H    THR   6           HN       THR   6  15.667   6.679  -2.230
   39    HA   THR   6           HA       THR   6  16.521   4.111  -3.180
   40    HB   THR   6           HB       THR   6  17.436   5.810  -0.860
   41    HG1  THR   6           HG1      THR   6  17.892   5.842  -3.603
   42   HG21  THR   6          HG21      THR   6  18.146   3.501  -0.674
   43   HG22  THR   6          HG22      THR   6  19.534   4.538  -1.030
   44   HG23  THR   6          HG23      THR   6  18.820   3.532  -2.305
   45    H    CYS   7           HN       CYS   7  14.230   5.173  -0.855
   46    HA   CYS   7           HA       CYS   7  14.611   2.710   0.755
   47    HB2  CYS   7           HB2      CYS   7  15.361   5.013   1.632
   48    HB3  CYS   7           HB1      CYS   7  13.706   5.274   1.806
   49    H    ALA   8           HN       ALA   8  12.339   5.340  -0.076
   50    HA   ALA   8           HA       ALA   8  10.131   4.143   1.165
   51    HB1  ALA   8           HB1      ALA   8  10.301   6.163  -1.053
   52    HB2  ALA   8           HB2      ALA   8  10.233   6.492   0.687
   53    HB3  ALA   8           HB3      ALA   8   8.842   5.774  -0.132
   54    H    THR   9           HN       THR   9  11.748   3.727  -1.762
   55    HA   THR   9           HA       THR   9   9.703   2.450  -3.293
   56    HB   THR   9           HB       THR   9  11.707   1.559  -4.575
   57    HG1  THR   9           HG1      THR   9  13.521   3.200  -3.818
   58   HG21  THR   9          HG21      THR   9  11.407   4.538  -4.138
   59   HG22  THR   9          HG22      THR   9  10.462   3.562  -5.268
   60   HG23  THR   9          HG23      THR   9  12.192   3.793  -5.528
   61    H    GLN  10           HN       GLN  10  11.946   1.488  -0.987
   62    HA   GLN  10           HA       GLN  10  11.773  -1.369  -1.317
   63    HB2  GLN  10           HB2      GLN  10  12.651   0.156   1.145
   64    HB3  GLN  10           HB1      GLN  10  13.046  -1.515   0.743
   65    HG2  GLN  10           HG2      GLN  10  13.990   0.965  -0.665
   66    HG3  GLN  10           HG1      GLN  10  14.942  -0.053   0.405
   67   HE21  GLN  10          HE21      GLN  10  15.259   0.728  -2.326
   68   HE22  GLN  10          HE22      GLN  10  15.459  -0.743  -3.243
   69    H    ARG  11           HN       ARG  11  10.404   1.116   0.623
   70    HA   ARG  11           HA       ARG  11   8.720  -0.511   2.277
   71    HB2  ARG  11           HB2      ARG  11   8.112   2.313   1.386
   72    HB3  ARG  11           HB1      ARG  11   7.480   1.492   2.806
   73    HG2  ARG  11           HG2      ARG  11  10.291   2.449   2.338
   74    HG3  ARG  11           HG1      ARG  11   9.126   3.059   3.518
   75    HD2  ARG  11           HD2      ARG  11  10.447   0.373   3.440
   76    HD3  ARG  11           HD1      ARG  11  10.750   1.671   4.596
   77    HE   ARG  11           HE       ARG  11   8.198   1.274   5.057
   78   HH11  ARG  11          HH11      ARG  11  10.780  -1.124   4.728
   79   HH12  ARG  11          HH12      ARG  11   9.923  -2.351   5.553
   80   HH21  ARG  11          HH21      ARG  11   7.047  -0.424   6.215
   81   HH22  ARG  11          HH22      ARG  11   7.786  -1.940   6.420
   82    H    LEU  12           HN       LEU  12   8.311   1.025  -0.824
   83    HA   LEU  12           HA       LEU  12   5.695   0.290  -1.398
   84    HB2  LEU  12           HB2      LEU  12   8.161   0.770  -2.936
   85    HB3  LEU  12           HB1      LEU  12   6.762   0.399  -3.823
   86    HG   LEU  12           HG       LEU  12   7.244   2.829  -2.078
   87   HD11  LEU  12          HD11      LEU  12   8.180   2.934  -4.356
   88   HD12  LEU  12          HD12      LEU  12   6.867   4.081  -4.124
   89   HD13  LEU  12          HD13      LEU  12   6.579   2.580  -4.997
   90   HD21  LEU  12          HD21      LEU  12   4.959   2.148  -1.675
   91   HD22  LEU  12          HD22      LEU  12   4.676   1.985  -3.406
   92   HD23  LEU  12          HD23      LEU  12   4.980   3.575  -2.709
   93    H    ALA  13           HN       ALA  13   8.780  -1.351  -1.832
   94    HA   ALA  13           HA       ALA  13   7.745  -3.548  -3.174
   95    HB1  ALA  13           HB1      ALA  13   9.860  -4.684  -2.634
   96    HB2  ALA  13           HB2      ALA  13  10.254  -3.395  -1.499
   97    HB3  ALA  13           HB3      ALA  13  10.130  -3.043  -3.226
   98    H    ASN  14           HN       ASN  14   8.057  -2.734   0.188
   99    HA   ASN  14           HA       ASN  14   7.402  -5.377   1.157
  100    HB2  ASN  14           HB2      ASN  14   7.566  -2.757   2.619
  101    HB3  ASN  14           HB1      ASN  14   7.110  -4.306   3.345
  102   HD21  ASN  14          HD21      ASN  14   9.508  -4.194   0.905
  103   HD22  ASN  14          HD22      ASN  14  10.872  -4.471   1.928
  104    H    PHE  15           HN       PHE  15   5.575  -2.997  -0.237
  105    HA   PHE  15           HA       PHE  15   3.317  -3.303   1.498
  106    HB2  PHE  15           HB2      PHE  15   3.165  -1.141   0.813
  107    HB3  PHE  15           HB1      PHE  15   4.321  -1.419  -0.479
  108    HD1  PHE  15           HD1      PHE  15   0.732  -1.525   0.421
  109    HD2  PHE  15           HD2      PHE  15   3.601  -1.688  -2.717
  110    HE1  PHE  15           HE1      PHE  15  -1.067  -1.285  -1.244
  111    HE2  PHE  15           HE2      PHE  15   1.841  -1.462  -4.366
  112    HZ   PHE  15           HZ       PHE  15  -0.520  -1.254  -3.643
  113    H    LEU  16           HN       LEU  16   4.755  -4.406  -1.405
  114    HA   LEU  16           HA       LEU  16   2.349  -5.890  -1.981
  115    HB2  LEU  16           HB2      LEU  16   2.319  -5.071  -3.955
  116    HB3  LEU  16           HB1      LEU  16   3.371  -3.898  -3.354
  117    HG   LEU  16           HG       LEU  16   4.530  -6.285  -4.790
  118   HD11  LEU  16          HD11      LEU  16   4.689  -4.820  -6.751
  119   HD12  LEU  16          HD12      LEU  16   3.800  -3.567  -5.880
  120   HD13  LEU  16          HD13      LEU  16   3.004  -5.086  -6.295
  121   HD21  LEU  16          HD21      LEU  16   6.040  -5.007  -3.346
  122   HD22  LEU  16          HD22      LEU  16   5.545  -3.525  -4.166
  123   HD23  LEU  16          HD23      LEU  16   6.434  -4.764  -5.054
  124    H    VAL  17           HN       VAL  17   5.128  -6.353  -0.642
  125    HA   VAL  17           HA       VAL  17   6.395  -8.405  -2.083
  126    HB   VAL  17           HB       VAL  17   7.605  -7.197  -0.337
  127   HG11  VAL  17          HG11      VAL  17   5.852  -6.735   1.189
  128   HG12  VAL  17          HG12      VAL  17   7.151  -7.568   2.061
  129   HG13  VAL  17          HG13      VAL  17   5.684  -8.435   1.572
  130   HG21  VAL  17          HG21      VAL  17   8.418  -9.426  -0.779
  131   HG22  VAL  17          HG22      VAL  17   7.291 -10.069   0.447
  132   HG23  VAL  17          HG23      VAL  17   8.604  -8.972   0.924
  133    H    HIS  18           HN       HIS  18   4.167  -8.575   0.575
  134    HA   HIS  18           HA       HIS  18   3.417 -11.251  -0.382
  135    HB2  HIS  18           HB2      HIS  18   2.833 -10.011   2.346
  136    HB3  HIS  18           HB1      HIS  18   2.313 -11.599   1.806
  137    HD1  HIS  18           HD1      HIS  18   3.907 -13.537   2.182
  138    HD2  HIS  18           HD2      HIS  18   5.676  -9.834   2.814
  139    HE1  HIS  18           HE1      HIS  18   6.117 -14.020   3.230
  140    HE2  HIS  18           HE2      HIS  18   7.211 -11.787   3.533
  141    H    SER  19           HN       SER  19   2.600  -8.004   0.029
  142    HA   SER  19           HA       SER  19   1.028  -6.648  -0.733
  143    HB2  SER  19           HB2      SER  19   1.217  -8.296  -2.712
  144    HB3  SER  19           HB1      SER  19  -0.325  -8.943  -2.124
  145    HG   SER  19           HG       SER  19  -0.143  -7.033  -3.745
  146    H    SER  20           HN       SER  20   0.788  -8.413   1.680
  147    HA   SER  20           HA       SER  20  -1.928  -8.785   2.362
  148    HB2  SER  20           HB2      SER  20   0.401  -8.171   4.141
  149    HB3  SER  20           HB1      SER  20  -1.038  -9.107   4.557
  150    HG   SER  20           HG       SER  20  -0.418 -10.656   3.052
  151    H    ASN  21           HN       ASN  21  -0.450  -6.161   1.618
  152    HA   ASN  21           HA       ASN  21  -1.525  -4.285   3.598
  153    HB2  ASN  21           HB2      ASN  21   0.336  -3.961   1.270
  154    HB3  ASN  21           HB1      ASN  21  -0.362  -2.551   2.083
  155   HD21  ASN  21          HD21      ASN  21   1.937  -5.112   2.201
  156   HD22  ASN  21          HD22      ASN  21   2.736  -4.609   3.643
  157    H    ASN  22           HN       ASN  22  -2.341  -5.818   0.784
  158    HA   ASN  22           HA       ASN  22  -4.505  -3.968   0.254
  159    HB2  ASN  22           HB2      ASN  22  -2.408  -5.024  -1.431
  160    HB3  ASN  22           HB1      ASN  22  -3.965  -5.325  -2.150
  161   HD21  ASN  22          HD21      ASN  22  -3.241  -2.669   0.008
  162   HD22  ASN  22          HD22      ASN  22  -3.391  -1.412  -1.110
  163    H    PHE  23           HN       PHE  23  -3.216  -7.085  -0.163
  164    HA   PHE  23           HA       PHE  23  -5.406  -8.705  -0.476
  165    HB2  PHE  23           HB2      PHE  23  -2.739  -8.802   0.422
  166    HB3  PHE  23           HB1      PHE  23  -3.496 -10.261   0.894
  167    HD1  PHE  23           HD1      PHE  23  -3.566 -11.979  -0.838
  168    HD2  PHE  23           HD2      PHE  23  -2.955  -7.934  -1.929
  169    HE1  PHE  23           HE1      PHE  23  -3.146 -12.672  -3.161
  170    HE2  PHE  23           HE2      PHE  23  -2.532  -8.560  -4.198
  171    HZ   PHE  23           HZ       PHE  23  -2.625 -10.972  -4.871
  172    H    GLY  24           HN       GLY  24  -6.968  -8.198   0.678
  173    HA2  GLY  24           HA2      GLY  24  -8.464  -8.047   2.369
  174    HA3  GLY  24           HA1      GLY  24  -7.659  -9.348   3.170
  175    H    ALA  25           HN       ALA  25  -6.543  -6.141   2.341
  176    HA   ALA  25           HA       ALA  25  -6.112  -5.605   5.169
  177    HB1  ALA  25           HB1      ALA  25  -5.125  -4.213   2.666
  178    HB2  ALA  25           HB2      ALA  25  -4.211  -5.322   3.657
  179    HB3  ALA  25           HB3      ALA  25  -4.702  -3.756   4.320
  180    H    ILE  26           HN       ILE  26  -7.039  -4.204   2.210
  181    HA   ILE  26           HA       ILE  26  -8.797  -2.433   3.463
  182    HB   ILE  26           HB       ILE  26  -7.536  -1.435   1.777
  183   HG12  ILE  26          HG12      ILE  26 -10.018  -2.225   0.400
  184   HG13  ILE  26          HG11      ILE  26 -10.022  -0.978   1.643
  185   HG21  ILE  26          HG21      ILE  26  -7.440  -2.408  -0.578
  186   HG22  ILE  26          HG22      ILE  26  -8.122  -3.878   0.178
  187   HG23  ILE  26          HG23      ILE  26  -6.565  -3.277   0.688
  188   HD11  ILE  26          HD11      ILE  26  -8.642  -0.893  -1.052
  189   HD12  ILE  26          HD12      ILE  26  -8.461   0.345   0.190
  190   HD13  ILE  26          HD13      ILE  26 -10.038   0.064  -0.554
  191    H    LEU  27           HN       LEU  27  -8.812  -5.347   1.503
  192    HA   LEU  27           HA       LEU  27 -11.524  -5.448   0.804
  193    HB2  LEU  27           HB2      LEU  27 -10.581  -7.142  -0.377
  194    HB3  LEU  27           HB1      LEU  27  -9.196  -7.117   0.680
  195    HG   LEU  27           HG       LEU  27 -10.323  -8.788   2.159
  196   HD11  LEU  27          HD11      LEU  27 -12.420  -8.928   0.022
  197   HD12  LEU  27          HD12      LEU  27 -12.592  -8.336   1.694
  198   HD13  LEU  27          HD13      LEU  27 -12.186 -10.027   1.400
  199   HD21  LEU  27          HD21      LEU  27 -10.054 -10.693   0.659
  200   HD22  LEU  27          HD22      LEU  27  -8.746  -9.526   0.490
  201   HD23  LEU  27          HD23      LEU  27 -10.025  -9.598  -0.722
  202    H    SER  28           HN       SER  28  -9.741  -6.643   3.476
  203    HA   SER  28           HA       SER  28 -12.111  -7.707   4.704
  204    HB2  SER  28           HB2      SER  28  -9.256  -7.696   5.506
  205    HB3  SER  28           HB1      SER  28 -10.527  -8.477   6.463
  206    HG   SER  28           HG       SER  28 -10.943  -9.771   4.590
  207    H    SER  29           HN       SER  29 -10.376  -4.846   4.768
  208    HA   SER  29           HA       SER  29 -10.458  -2.901   5.954
  209    HB2  SER  29           HB2      SER  29 -13.031  -4.071   7.070
  210    HB3  SER  29           HB1      SER  29 -12.588  -2.360   7.049
  211    HG   SER  29           HG       SER  29 -13.903  -3.607   5.239
  212    H    THR  30           HN       THR  30  -8.920  -4.938   6.916
  213    HA   THR  30           HA       THR  30  -9.248  -5.648   9.625
  214    HB   THR  30           HB       THR  30  -7.834  -6.856   7.911
  215    HG1  THR  30           HG1      THR  30  -6.047  -7.181   9.451
  216   HG21  THR  30          HG21      THR  30  -6.701  -4.879   6.979
  217   HG22  THR  30          HG22      THR  30  -5.518  -6.069   7.538
  218   HG23  THR  30          HG23      THR  30  -5.870  -4.630   8.502
  219    H    ASN  31           HN       ASN  31  -8.033  -2.813   8.126
  220    HA   ASN  31           HA       ASN  31  -6.755  -1.891  10.588
  221    HB2  ASN  31           HB2      ASN  31  -5.716  -0.177   9.181
  222    HB3  ASN  31           HB1      ASN  31  -5.352  -1.803   8.606
  223   HD21  ASN  31          HD21      ASN  31  -7.089   1.078   8.042
  224   HD22  ASN  31          HD22      ASN  31  -7.512   0.735   6.413
  225    H    VAL  32           HN       VAL  32  -9.703  -1.951   9.611
  226    HA   VAL  32           HA       VAL  32 -10.302   0.860  10.223
  227    HB   VAL  32           HB       VAL  32 -12.149  -1.307   9.116
  228   HG11  VAL  32          HG11      VAL  32 -13.692   0.505   8.558
  229   HG12  VAL  32          HG12      VAL  32 -12.606   1.670   9.307
  230   HG13  VAL  32          HG13      VAL  32 -13.391   0.440  10.296
  231   HG21  VAL  32          HG21      VAL  32 -10.416  -0.773   7.517
  232   HG22  VAL  32          HG22      VAL  32 -10.767   0.948   7.675
  233   HG23  VAL  32          HG23      VAL  32 -11.966  -0.134   6.966
  234    H    GLY  33           HN       GLY  33  -9.975  -2.112  11.669
  235    HA2  GLY  33           HA2      GLY  33 -10.272  -2.545  13.941
  236    HA3  GLY  33           HA1      GLY  33 -11.415  -1.215  14.025
  237    H    SER  34           HN       SER  34 -12.261  -2.949  11.399
  238    HA   SER  34           HA       SER  34 -13.899  -4.766  12.940
  239    HB2  SER  34           HB2      SER  34 -14.973  -2.862  10.864
  240    HB3  SER  34           HB1      SER  34 -15.900  -4.184  11.580
  241    HG   SER  34           HG       SER  34 -14.882  -2.975  13.591
  242    H    ASN  35           HN       ASN  35 -12.871  -6.492  12.327
  243    HA   ASN  35           HA       ASN  35 -13.321  -7.412   9.609
  244    HB2  ASN  35           HB2      ASN  35 -11.104  -6.432   9.482
  245    HB3  ASN  35           HB1      ASN  35 -10.578  -7.363  10.882
  246   HD21  ASN  35          HD21      ASN  35  -8.904  -8.279   9.735
  247   HD22  ASN  35          HD22      ASN  35  -9.137  -9.505   8.555
  248    H    THR  36           HN       THR  36 -12.356  -8.071  12.899
  249    HA   THR  36           HA       THR  36 -12.527 -10.892  12.660
  250    HB   THR  36           HB       THR  36 -12.595  -9.239  15.201
  251    HG1  THR  36           HG1      THR  36 -10.308  -9.369  15.088
  252   HG21  THR  36          HG21      THR  36 -11.411 -11.175  16.137
  253   HG22  THR  36          HG22      THR  36 -11.478 -11.970  14.557
  254   HG23  THR  36          HG23      THR  36 -12.968 -11.648  15.451
  255    H    TYC  37           HN       ATY  37 -14.743 -10.372  11.591
  256    HA   TYC  37           HA       ATY  37 -16.845 -10.921  13.565
  257    HB1  TYC  37           HB1      ATY  37 -18.461  -9.808  11.941
  258    HB2  TYC  37           HB2      ATY  37 -17.051  -9.185  11.094
  259    HD1  TYC  37           HD1      ATY  37 -19.258  -8.748  13.896
  260    HD2  TYC  37           HD2      ATY  37 -15.495  -7.623  12.278
  261    HE1  TYC  37           HE1      ATY  37 -19.173  -6.847  15.437
  262    HE2  TYC  37           HE2      ATY  37 -15.392  -5.733  13.803
  263    HH   TYC  37           HH       ATY  37 -16.885  -4.319  15.166
  264   HT21  TYC  37          HT21      ATY  37 -16.923 -10.890  10.047
  265   HT22  TYC  37          HT22      ATY  37 -17.257 -12.572   9.862
  Start of MODEL   12
    1    H1   LYS   1           HT1      LYS   1   9.273   3.423   8.909
    2    H2   LYS   1           HT2      LYS   1  10.716   4.318   9.090
    3    H3   LYS   1           HT3      LYS   1  10.488   3.327   7.758
    4    HA   LYS   1           HA       LYS   1   8.825   4.643   6.870
    5    HB2  LYS   1           HB2      LYS   1   7.807   5.333   9.044
    6    HB3  LYS   1           HB1      LYS   1   9.157   6.425   9.305
    7    HG2  LYS   1           HG2      LYS   1   8.504   7.742   7.371
    8    HG3  LYS   1           HG1      LYS   1   7.192   6.616   7.019
    9    HD2  LYS   1           HD2      LYS   1   6.166   7.163   9.192
   10    HD3  LYS   1           HD1      LYS   1   7.465   8.309   9.509
   11    HE2  LYS   1           HE2      LYS   1   5.491   8.467   7.223
   12    HE3  LYS   1           HE1      LYS   1   5.417   9.415   8.705
   13    HZ1  LYS   1           HZ1      LYS   1   6.394  10.702   6.922
   14    HZ2  LYS   1           HZ2      LYS   1   7.544   9.534   6.639
   15    HZ3  LYS   1           HZ3      LYS   1   7.582  10.403   8.081
   16    H    CYS   2           HN       CYS   2   9.657   5.737   5.226
   17    HA   CYS   2           HA       CYS   2  11.728   7.668   5.590
   18    HB2  CYS   2           HB2      CYS   2  13.220   6.481   3.915
   19    HB3  CYS   2           HB1      CYS   2  13.160   5.778   5.535
   20    H    ASN   3           HN       ASN   3  12.373   8.529   3.310
   21    HA   ASN   3           HA       ASN   3  10.073   8.435   1.525
   22    HB2  ASN   3           HB2      ASN   3   9.750  10.892   1.569
   23    HB3  ASN   3           HB1      ASN   3   9.315  10.095   3.078
   24   HD21  ASN   3          HD21      ASN   3  11.446  12.328   1.532
   25   HD22  ASN   3          HD22      ASN   3  12.218  12.897   2.966
   26    H    THR   4           HN       THR   4  13.063   7.984   1.448
   27    HA   THR   4           HA       THR   4  13.629   9.820  -0.755
   28    HB   THR   4           HB       THR   4  15.459   9.658   0.892
   29    HG1  THR   4           HG1      THR   4  16.539   9.965  -0.835
   30   HG21  THR   4          HG21      THR   4  14.970   7.401   1.712
   31   HG22  THR   4          HG22      THR   4  16.669   7.581   1.270
   32   HG23  THR   4          HG23      THR   4  15.553   6.729   0.191
   33    H    ALA   5           HN       ALA   5  14.551   8.893  -2.686
   34    HA   ALA   5           HA       ALA   5  12.810   7.003  -3.833
   35    HB1  ALA   5           HB1      ALA   5  13.841   8.814  -5.113
   36    HB2  ALA   5           HB2      ALA   5  14.187   7.245  -5.839
   37    HB3  ALA   5           HB3      ALA   5  15.424   8.069  -4.891
   38    H    THR   6           HN       THR   6  15.731   6.696  -2.161
   39    HA   THR   6           HA       THR   6  16.403   4.104  -3.241
   40    HB   THR   6           HB       THR   6  17.536   5.717  -0.957
   41    HG1  THR   6           HG1      THR   6  17.807   5.764  -3.681
   42   HG21  THR   6          HG21      THR   6  19.520   4.273  -1.187
   43   HG22  THR   6          HG22      THR   6  18.658   3.303  -2.399
   44   HG23  THR   6          HG23      THR   6  18.066   3.382  -0.732
   45    H    CYS   7           HN       CYS   7  14.200   5.203  -0.925
   46    HA   CYS   7           HA       CYS   7  14.495   2.735   0.688
   47    HB2  CYS   7           HB2      CYS   7  15.302   4.928   1.628
   48    HB3  CYS   7           HB1      CYS   7  13.668   5.360   1.688
   49    H    ALA   8           HN       ALA   8  12.331   5.407  -0.272
   50    HA   ALA   8           HA       ALA   8  10.004   4.401   0.841
   51    HB1  ALA   8           HB1      ALA   8  10.371   6.090  -1.638
   52    HB2  ALA   8           HB2      ALA   8  10.202   6.688   0.012
   53    HB3  ALA   8           HB3      ALA   8   8.850   5.869  -0.772
   54    H    THR   9           HN       THR   9  11.789   3.723  -1.898
   55    HA   THR   9           HA       THR   9   9.827   2.314  -3.447
   56    HB   THR   9           HB       THR   9  11.851   1.433  -4.626
   57    HG1  THR   9           HG1      THR   9  13.721   2.911  -4.011
   58   HG21  THR   9          HG21      THR   9  11.528   4.418  -4.307
   59   HG22  THR   9          HG22      THR   9  10.594   3.395  -5.406
   60   HG23  THR   9          HG23      THR   9  12.326   3.629  -5.664
   61    H    GLN  10           HN       GLN  10  12.103   1.483  -1.047
   62    HA   GLN  10           HA       GLN  10  11.997  -1.362  -1.408
   63    HB2  GLN  10           HB2      GLN  10  12.900   0.106   1.073
   64    HB3  GLN  10           HB1      GLN  10  13.360  -1.523   0.573
   65    HG2  GLN  10           HG2      GLN  10  14.152   1.095  -0.662
   66    HG3  GLN  10           HG1      GLN  10  15.183  -0.038   0.206
   67   HE21  GLN  10          HE21      GLN  10  15.284   1.101  -2.429
   68   HE22  GLN  10          HE22      GLN  10  15.398  -0.224  -3.553
   69    H    ARG  11           HN       ARG  11  10.582   1.008   0.722
   70    HA   ARG  11           HA       ARG  11   9.110  -0.945   2.124
   71    HB2  ARG  11           HB2      ARG  11   7.895   0.883   3.218
   72    HB3  ARG  11           HB1      ARG  11   9.653   1.126   3.221
   73    HG2  ARG  11           HG2      ARG  11   8.698   3.247   2.872
   74    HG3  ARG  11           HG1      ARG  11   9.334   2.675   1.332
   75    HD2  ARG  11           HD2      ARG  11   7.182   3.669   0.902
   76    HD3  ARG  11           HD1      ARG  11   7.140   1.901   0.734
   77    HE   ARG  11           HE       ARG  11   6.384   2.353   3.284
   78   HH11  ARG  11          HH11      ARG  11   5.180   3.531   0.183
   79   HH12  ARG  11          HH12      ARG  11   3.543   3.487   0.621
   80   HH21  ARG  11          HH21      ARG  11   4.084   2.366   3.932
   81   HH22  ARG  11          HH22      ARG  11   2.908   2.802   2.795
   82    H    LEU  12           HN       LEU  12   8.514   0.912  -0.730
   83    HA   LEU  12           HA       LEU  12   5.835   0.299  -1.190
   84    HB2  LEU  12           HB2      LEU  12   8.234   0.830  -2.790
   85    HB3  LEU  12           HB1      LEU  12   6.878   0.369  -3.684
   86    HG   LEU  12           HG       LEU  12   7.199   2.852  -1.984
   87   HD11  LEU  12          HD11      LEU  12   6.737   4.007  -4.092
   88   HD12  LEU  12          HD12      LEU  12   6.635   2.454  -4.915
   89   HD13  LEU  12          HD13      LEU  12   8.161   2.981  -4.217
   90   HD21  LEU  12          HD21      LEU  12   4.939   2.056  -1.594
   91   HD22  LEU  12          HD22      LEU  12   4.689   1.858  -3.327
   92   HD23  LEU  12          HD23      LEU  12   4.905   3.469  -2.648
   93    H    ALA  13           HN       ALA  13   8.843  -1.376  -1.854
   94    HA   ALA  13           HA       ALA  13   7.722  -3.477  -3.235
   95    HB1  ALA  13           HB1      ALA  13  10.103  -2.968  -3.339
   96    HB2  ALA  13           HB2      ALA  13   9.860  -4.644  -2.851
   97    HB3  ALA  13           HB3      ALA  13  10.280  -3.426  -1.647
   98    H    ASN  14           HN       ASN  14   8.172  -2.823   0.149
   99    HA   ASN  14           HA       ASN  14   7.446  -5.488   1.026
  100    HB2  ASN  14           HB2      ASN  14   7.843  -2.955   2.597
  101    HB3  ASN  14           HB1      ASN  14   7.290  -4.466   3.320
  102   HD21  ASN  14          HD21      ASN  14   9.721  -3.945   0.872
  103   HD22  ASN  14          HD22      ASN  14  11.048  -4.583   1.770
  104    H    PHE  15           HN       PHE  15   5.644  -2.954  -0.184
  105    HA   PHE  15           HA       PHE  15   3.501  -3.259   1.701
  106    HB2  PHE  15           HB2      PHE  15   3.341  -1.058   1.196
  107    HB3  PHE  15           HB1      PHE  15   4.463  -1.228  -0.134
  108    HD1  PHE  15           HD1      PHE  15   0.944  -1.043   0.847
  109    HD2  PHE  15           HD2      PHE  15   3.655  -1.544  -2.391
  110    HE1  PHE  15           HE1      PHE  15  -0.868  -0.551  -0.748
  111    HE2  PHE  15           HE2      PHE  15   1.882  -1.068  -3.984
  112    HZ   PHE  15           HZ       PHE  15  -0.407  -0.557  -3.172
  113    H    LEU  16           HN       LEU  16   4.675  -4.514  -1.207
  114    HA   LEU  16           HA       LEU  16   2.093  -5.707  -1.672
  115    HB2  LEU  16           HB2      LEU  16   2.007  -4.833  -3.631
  116    HB3  LEU  16           HB1      LEU  16   3.141  -3.743  -3.031
  117    HG   LEU  16           HG       LEU  16   4.062  -6.099  -4.678
  118   HD11  LEU  16          HD11      LEU  16   4.278  -4.480  -6.503
  119   HD12  LEU  16          HD12      LEU  16   3.497  -3.254  -5.502
  120   HD13  LEU  16          HD13      LEU  16   2.600  -4.684  -6.007
  121   HD21  LEU  16          HD21      LEU  16   6.089  -4.739  -4.921
  122   HD22  LEU  16          HD22      LEU  16   5.754  -5.091  -3.219
  123   HD23  LEU  16          HD23      LEU  16   5.362  -3.505  -3.887
  124    H    VAL  17           HN       VAL  17   4.734  -6.467  -0.412
  125    HA   VAL  17           HA       VAL  17   6.035  -8.289  -2.166
  126    HB   VAL  17           HB       VAL  17   7.207  -6.993  -0.446
  127   HG11  VAL  17          HG11      VAL  17   6.081  -8.837   1.627
  128   HG12  VAL  17          HG12      VAL  17   5.608  -7.188   1.371
  129   HG13  VAL  17          HG13      VAL  17   7.266  -7.552   1.892
  130   HG21  VAL  17          HG21      VAL  17   7.601  -9.960  -0.399
  131   HG22  VAL  17          HG22      VAL  17   8.681  -8.814   0.410
  132   HG23  VAL  17          HG23      VAL  17   8.467  -8.730  -1.338
  133    H    HIS  18           HN       HIS  18   4.398  -8.963   0.871
  134    HA   HIS  18           HA       HIS  18   3.479 -11.522  -0.262
  135    HB2  HIS  18           HB2      HIS  18   4.101 -10.933   2.673
  136    HB3  HIS  18           HB1      HIS  18   3.348 -12.379   2.046
  137    HD1  HIS  18           HD1      HIS  18   4.974 -14.187   2.422
  138    HD2  HIS  18           HD2      HIS  18   6.675 -10.752   0.950
  139    HE1  HIS  18           HE1      HIS  18   7.403 -14.760   2.128
  140    HE2  HIS  18           HE2      HIS  18   8.458 -12.553   1.579
  141    H    SER  19           HN       SER  19   2.699  -8.593   0.149
  142    HA   SER  19           HA       SER  19   0.247  -8.906   1.613
  143    HB2  SER  19           HB2      SER  19   1.490  -6.536   0.323
  144    HB3  SER  19           HB1      SER  19  -0.019  -6.516   1.205
  145    HG   SER  19           HG       SER  19   1.196  -7.449   2.987
  146    H    SER  20           HN       SER  20   1.033  -9.833  -1.074
  147    HA   SER  20           HA       SER  20  -0.050  -8.457  -3.196
  148    HB2  SER  20           HB2      SER  20   0.449 -11.417  -2.980
  149    HB3  SER  20           HB1      SER  20   0.317 -10.472  -4.466
  150    HG   SER  20           HG       SER  20   2.062  -9.197  -3.669
  151    H    ASN  21           HN       ASN  21  -1.771 -10.012  -0.810
  152    HA   ASN  21           HA       ASN  21  -4.116 -10.249  -2.524
  153    HB2  ASN  21           HB2      ASN  21  -2.978 -11.937  -0.444
  154    HB3  ASN  21           HB1      ASN  21  -4.754 -12.007  -0.644
  155   HD21  ASN  21          HD21      ASN  21  -1.668 -12.888  -1.791
  156   HD22  ASN  21          HD22      ASN  21  -2.145 -13.869  -3.117
  157    H    ASN  22           HN       ASN  22  -2.826  -8.203  -0.344
  158    HA   ASN  22           HA       ASN  22  -5.295  -7.804   1.124
  159    HB2  ASN  22           HB2      ASN  22  -2.658  -8.443   2.051
  160    HB3  ASN  22           HB1      ASN  22  -3.315  -6.972   2.743
  161   HD21  ASN  22          HD21      ASN  22  -5.301  -9.584   1.616
  162   HD22  ASN  22          HD22      ASN  22  -5.826 -10.154   3.137
  163    H    PHE  23           HN       PHE  23  -2.312  -6.573   0.013
  164    HA   PHE  23           HA       PHE  23  -2.454  -4.023   0.873
  165    HB2  PHE  23           HB2      PHE  23  -0.600  -3.586  -0.514
  166    HB3  PHE  23           HB1      PHE  23  -0.620  -5.296  -0.180
  167    HD1  PHE  23           HD1      PHE  23  -0.277  -2.996  -2.769
  168    HD2  PHE  23           HD2      PHE  23  -1.753  -6.699  -1.660
  169    HE1  PHE  23           HE1      PHE  23  -0.082  -3.721  -5.120
  170    HE2  PHE  23           HE2      PHE  23  -1.596  -7.540  -3.821
  171    HZ   PHE  23           HZ       PHE  23  -0.748  -6.034  -5.721
  172    H    GLY  24           HN       GLY  24  -3.958  -2.852   0.787
  173    HA2  GLY  24           HA2      GLY  24  -5.656  -1.498   0.187
  174    HA3  GLY  24           HA1      GLY  24  -5.054  -1.329  -1.428
  175    H    ALA  25           HN       ALA  25  -5.945  -4.272   0.143
  176    HA   ALA  25           HA       ALA  25  -8.391  -4.430  -1.424
  177    HB1  ALA  25           HB1      ALA  25  -6.741  -6.523  -0.008
  178    HB2  ALA  25           HB2      ALA  25  -6.828  -6.289  -1.750
  179    HB3  ALA  25           HB3      ALA  25  -8.249  -6.871  -0.862
  180    H    ILE  26           HN       ILE  26  -6.847  -4.983   1.611
  181    HA   ILE  26           HA       ILE  26  -9.290  -4.817   3.001
  182    HB   ILE  26           HB       ILE  26  -7.820  -6.433   3.916
  183   HG12  ILE  26          HG12      ILE  26  -7.421  -3.995   5.494
  184   HG13  ILE  26          HG11      ILE  26  -8.923  -4.910   5.588
  185   HG21  ILE  26          HG21      ILE  26  -5.477  -5.877   4.628
  186   HG22  ILE  26          HG22      ILE  26  -5.704  -4.313   3.805
  187   HG23  ILE  26          HG23      ILE  26  -5.751  -5.803   2.885
  188   HD11  ILE  26          HD11      ILE  26  -7.539  -5.445   7.531
  189   HD12  ILE  26          HD12      ILE  26  -6.161  -5.797   6.486
  190   HD13  ILE  26          HD13      ILE  26  -7.576  -6.849   6.464
  191    H    LEU  27           HN       LEU  27  -6.324  -2.919   2.507
  192    HA   LEU  27           HA       LEU  27  -6.871  -0.808   4.232
  193    HB2  LEU  27           HB2      LEU  27  -4.766  -0.350   3.490
  194    HB3  LEU  27           HB1      LEU  27  -5.040  -1.456   2.168
  195    HG   LEU  27           HG       LEU  27  -5.856   0.411   0.759
  196   HD11  LEU  27          HD11      LEU  27  -6.649   1.914   2.430
  197   HD12  LEU  27          HD12      LEU  27  -5.477   2.659   1.343
  198   HD13  LEU  27          HD13      LEU  27  -4.987   2.210   2.995
  199   HD21  LEU  27          HD21      LEU  27  -3.115   0.797   1.939
  200   HD22  LEU  27          HD22      LEU  27  -3.673   1.409   0.382
  201   HD23  LEU  27          HD23      LEU  27  -3.549  -0.328   0.654
  202    H    SER  28           HN       SER  28  -7.632  -1.282   0.893
  203    HA   SER  28           HA       SER  28  -9.076   1.177   0.807
  204    HB2  SER  28           HB2      SER  28  -8.770  -1.012  -1.180
  205    HB3  SER  28           HB1      SER  28  -9.584   0.531  -1.515
  206    HG   SER  28           HG       SER  28  -7.546   1.490  -0.789
  207    H    SER  29           HN       SER  29  -9.752  -1.898   1.704
  208    HA   SER  29           HA       SER  29 -11.527  -3.026   2.493
  209    HB2  SER  29           HB2      SER  29 -11.840  -1.002   3.777
  210    HB3  SER  29           HB1      SER  29 -12.838  -0.280   2.517
  211    HG   SER  29           HG       SER  29 -13.662  -1.683   4.534
  212    H    THR  30           HN       THR  30 -11.185  -2.564  -0.383
  213    HA   THR  30           HA       THR  30 -13.856  -2.779  -1.440
  214    HB   THR  30           HB       THR  30 -12.064  -1.516  -2.658
  215    HG1  THR  30           HG1      THR  30 -13.056  -3.758  -4.113
  216   HG21  THR  30          HG21      THR  30 -10.887  -4.264  -3.129
  217   HG22  THR  30          HG22      THR  30 -10.158  -2.968  -2.182
  218   HG23  THR  30          HG23      THR  30 -10.357  -2.780  -3.925
  219    H    ASN  31           HN       ASN  31 -11.723  -4.815   0.079
  220    HA   ASN  31           HA       ASN  31 -12.866  -7.133  -1.272
  221    HB2  ASN  31           HB2      ASN  31 -10.393  -6.971  -1.416
  222    HB3  ASN  31           HB1      ASN  31 -10.299  -6.900   0.335
  223   HD21  ASN  31          HD21      ASN  31 -12.425  -9.004  -1.499
  224   HD22  ASN  31          HD22      ASN  31 -11.668 -10.464  -1.013
  225    H    VAL  32           HN       VAL  32 -13.548  -5.240   1.045
  226    HA   VAL  32           HA       VAL  32 -13.975  -7.283   3.098
  227    HB   VAL  32           HB       VAL  32 -14.199  -4.262   3.346
  228   HG11  VAL  32          HG11      VAL  32 -14.190  -4.666   5.743
  229   HG12  VAL  32          HG12      VAL  32 -14.154  -6.406   5.462
  230   HG13  VAL  32          HG13      VAL  32 -15.563  -5.462   4.970
  231   HG21  VAL  32          HG21      VAL  32 -11.990  -6.079   4.278
  232   HG22  VAL  32          HG22      VAL  32 -12.072  -4.330   4.511
  233   HG23  VAL  32          HG23      VAL  32 -11.905  -5.007   2.887
  234    H    GLY  33           HN       GLY  33 -15.499  -5.500   0.639
  235    HA2  GLY  33           HA2      GLY  33 -17.684  -5.560  -0.062
  236    HA3  GLY  33           HA1      GLY  33 -18.106  -6.453   1.399
  237    H    SER  34           HN       SER  34 -16.263  -3.653   1.768
  238    HA   SER  34           HA       SER  34 -18.644  -2.280   2.829
  239    HB2  SER  34           HB2      SER  34 -15.770  -1.961   3.722
  240    HB3  SER  34           HB1      SER  34 -17.180  -1.175   4.437
  241    HG   SER  34           HG       SER  34 -17.968  -3.423   4.661
  242    H    ASN  35           HN       ASN  35 -15.578  -1.736   1.129
  243    HA   ASN  35           HA       ASN  35 -16.735   0.750   0.072
  244    HB2  ASN  35           HB2      ASN  35 -13.867   0.127   0.802
  245    HB3  ASN  35           HB1      ASN  35 -14.299   1.449  -0.264
  246   HD21  ASN  35          HD21      ASN  35 -15.209   3.288   0.594
  247   HD22  ASN  35          HD22      ASN  35 -15.287   3.610   2.279
  248    H    THR  36           HN       THR  36 -16.955  -1.963  -0.805
  249    HA   THR  36           HA       THR  36 -15.240  -2.301  -3.052
  250    HB   THR  36           HB       THR  36 -17.824  -3.743  -2.389
  251    HG1  THR  36           HG1      THR  36 -15.745  -5.171  -1.690
  252   HG21  THR  36          HG21      THR  36 -16.910  -4.155  -4.643
  253   HG22  THR  36          HG22      THR  36 -16.763  -5.588  -3.614
  254   HG23  THR  36          HG23      THR  36 -15.355  -4.566  -3.915
  255    H    TYC  37           HN       ATY  37 -15.557  -0.356  -4.168
  256    HA   TYC  37           HA       ATY  37 -16.335   1.057  -5.629
  257    HB1  TYC  37           HB1      ATY  37 -17.731   0.264  -7.403
  258    HB2  TYC  37           HB2      ATY  37 -18.147  -1.203  -6.505
  259    HD1  TYC  37           HD1      ATY  37 -15.323   0.650  -8.048
  260    HD2  TYC  37           HD2      ATY  37 -16.743  -3.097  -6.635
  261    HE1  TYC  37           HE1      ATY  37 -13.330  -0.452  -8.978
  262    HE2  TYC  37           HE2      ATY  37 -14.760  -4.204  -7.556
  263    HH   TYC  37           HH       ATY  37 -13.086  -3.761  -9.377
  264   HT21  TYC  37          HT21      ATY  37 -17.142   2.472  -4.214
  265   HT22  TYC  37          HT22      ATY  37 -18.830   2.672  -3.916
  Start of MODEL   13
    1    H1   LYS   1           HT1      LYS   1  11.272   3.563   8.631
    2    H2   LYS   1           HT2      LYS   1   9.763   3.413   9.326
    3    H3   LYS   1           HT3      LYS   1  10.730   4.779   9.650
    4    HA   LYS   1           HA       LYS   1   9.687   3.986   7.020
    5    HB2  LYS   1           HB2      LYS   1   8.758   6.143   8.903
    6    HB3  LYS   1           HB1      LYS   1   8.366   6.117   7.190
    7    HG2  LYS   1           HG2      LYS   1   7.263   3.946   7.489
    8    HG3  LYS   1           HG1      LYS   1   7.628   3.999   9.208
    9    HD2  LYS   1           HD2      LYS   1   5.349   4.704   8.796
   10    HD3  LYS   1           HD1      LYS   1   6.302   6.048   9.418
   11    HE2  LYS   1           HE2      LYS   1   6.561   6.930   7.143
   12    HE3  LYS   1           HE1      LYS   1   5.647   5.563   6.505
   13    HZ1  LYS   1           HZ1      LYS   1   4.632   7.667   8.335
   14    HZ2  LYS   1           HZ2      LYS   1   3.734   6.349   7.757
   15    HZ3  LYS   1           HZ3      LYS   1   4.298   7.520   6.688
   16    H    CYS   2           HN       CYS   2   9.988   5.516   5.377
   17    HA   CYS   2           HA       CYS   2  11.994   7.533   5.672
   18    HB2  CYS   2           HB2      CYS   2  13.354   6.369   3.859
   19    HB3  CYS   2           HB1      CYS   2  13.475   5.680   5.488
   20    H    ASN   3           HN       ASN   3  12.384   8.471   3.325
   21    HA   ASN   3           HA       ASN   3   9.984   8.090   1.698
   22    HB2  ASN   3           HB2      ASN   3   9.325  10.405   1.699
   23    HB3  ASN   3           HB1      ASN   3   9.382   9.826   3.358
   24   HD21  ASN   3          HD21      ASN   3  10.995  10.606   4.711
   25   HD22  ASN   3          HD22      ASN   3  11.896  12.032   4.340
   26    H    THR   4           HN       THR   4  13.021   7.912   1.472
   27    HA   THR   4           HA       THR   4  13.381   9.771  -0.755
   28    HB   THR   4           HB       THR   4  15.260   9.743   0.832
   29    HG1  THR   4           HG1      THR   4  16.365  10.017  -0.909
   30   HG21  THR   4          HG21      THR   4  16.608   7.727   1.194
   31   HG22  THR   4          HG22      THR   4  15.466   6.798   0.223
   32   HG23  THR   4          HG23      THR   4  14.950   7.497   1.759
   33    H    ALA   5           HN       ALA   5  14.399   8.883  -2.691
   34    HA   ALA   5           HA       ALA   5  12.782   6.854  -3.831
   35    HB1  ALA   5           HB1      ALA   5  13.716   8.705  -5.134
   36    HB2  ALA   5           HB2      ALA   5  14.152   7.143  -5.831
   37    HB3  ALA   5           HB3      ALA   5  15.337   8.055  -4.894
   38    H    THR   6           HN       THR   6  15.738   6.786  -2.160
   39    HA   THR   6           HA       THR   6  16.626   4.249  -3.141
   40    HB   THR   6           HB       THR   6  17.440   5.864  -0.721
   41    HG1  THR   6           HG1      THR   6  18.389   5.860  -3.402
   42   HG21  THR   6          HG21      THR   6  18.193   3.568  -0.638
   43   HG22  THR   6          HG22      THR   6  19.576   4.636  -0.927
   44   HG23  THR   6          HG23      THR   6  18.879   3.687  -2.255
   45    H    CYS   7           HN       CYS   7  14.195   5.209  -0.947
   46    HA   CYS   7           HA       CYS   7  14.547   2.735   0.636
   47    HB2  CYS   7           HB2      CYS   7  15.324   4.911   1.593
   48    HB3  CYS   7           HB1      CYS   7  13.675   5.310   1.722
   49    H    ALA   8           HN       ALA   8  12.307   5.378  -0.221
   50    HA   ALA   8           HA       ALA   8  10.069   4.160   0.924
   51    HB1  ALA   8           HB1      ALA   8  10.226   6.160  -1.325
   52    HB2  ALA   8           HB2      ALA   8  10.171   6.517   0.403
   53    HB3  ALA   8           HB3      ALA   8   8.777   5.770  -0.383
   54    H    THR   9           HN       THR   9  11.811   3.708  -1.933
   55    HA   THR   9           HA       THR   9   9.844   2.378  -3.513
   56    HB   THR   9           HB       THR   9  11.910   1.475  -4.663
   57    HG1  THR   9           HG1      THR   9  13.667   3.213  -3.880
   58   HG21  THR   9          HG21      THR   9  12.392   3.678  -5.693
   59   HG22  THR   9          HG22      THR   9  11.562   4.465  -4.354
   60   HG23  THR   9          HG23      THR   9  10.657   3.433  -5.465
   61    H    GLN  10           HN       GLN  10  12.063   1.476  -1.116
   62    HA   GLN  10           HA       GLN  10  11.887  -1.391  -1.373
   63    HB2  GLN  10           HB2      GLN  10  12.712   0.184   1.077
   64    HB3  GLN  10           HB1      GLN  10  13.133  -1.485   0.706
   65    HG2  GLN  10           HG2      GLN  10  14.071   0.983  -0.728
   66    HG3  GLN  10           HG1      GLN  10  15.015  -0.003   0.379
   67   HE21  GLN  10          HE21      GLN  10  15.356   0.743  -2.387
   68   HE22  GLN  10          HE22      GLN  10  15.599  -0.721  -3.262
   69    H    ARG  11           HN       ARG  11  10.522   1.137   0.533
   70    HA   ARG  11           HA       ARG  11   8.827  -0.454   2.183
   71    HB2  ARG  11           HB2      ARG  11   8.212   2.358   1.272
   72    HB3  ARG  11           HB1      ARG  11   7.612   1.555   2.710
   73    HG2  ARG  11           HG2      ARG  11  10.400   2.538   2.178
   74    HG3  ARG  11           HG1      ARG  11   9.267   3.161   3.368
   75    HD2  ARG  11           HD2      ARG  11  10.694   0.530   3.322
   76    HD3  ARG  11           HD1      ARG  11  10.905   1.854   4.469
   77    HE   ARG  11           HE       ARG  11   8.433   1.296   5.013
   78   HH11  ARG  11          HH11      ARG  11  11.013  -1.012   4.289
   79   HH12  ARG  11          HH12      ARG  11  10.316  -2.309   5.140
   80   HH21  ARG  11          HH21      ARG  11   7.449  -0.503   6.217
   81   HH22  ARG  11          HH22      ARG  11   8.241  -2.007   6.273
   82    H    LEU  12           HN       LEU  12   8.462   0.992  -0.977
   83    HA   LEU  12           HA       LEU  12   5.813   0.309  -1.510
   84    HB2  LEU  12           HB2      LEU  12   8.268   0.739  -3.043
   85    HB3  LEU  12           HB1      LEU  12   6.936   0.268  -3.962
   86    HG   LEU  12           HG       LEU  12   7.258   2.816  -2.353
   87   HD11  LEU  12          HD11      LEU  12   6.910   3.922  -4.485
   88   HD12  LEU  12          HD12      LEU  12   6.709   2.363  -5.274
   89   HD13  LEU  12          HD13      LEU  12   8.267   2.806  -4.589
   90   HD21  LEU  12          HD21      LEU  12   4.969   2.062  -1.985
   91   HD22  LEU  12          HD22      LEU  12   4.753   1.831  -3.718
   92   HD23  LEU  12          HD23      LEU  12   4.986   3.452  -3.068
   93    H    ALA  13           HN       ALA  13   8.861  -1.396  -1.909
   94    HA   ALA  13           HA       ALA  13   7.776  -3.596  -3.201
   95    HB1  ALA  13           HB1      ALA  13  10.173  -3.127  -3.274
   96    HB2  ALA  13           HB2      ALA  13   9.890  -4.763  -2.678
   97    HB3  ALA  13           HB3      ALA  13  10.305  -3.472  -1.549
   98    H    ASN  14           HN       ASN  14   8.203  -2.765   0.136
   99    HA   ASN  14           HA       ASN  14   7.396  -5.338   1.231
  100    HB2  ASN  14           HB2      ASN  14   7.700  -2.648   2.582
  101    HB3  ASN  14           HB1      ASN  14   7.216  -4.134   3.391
  102   HD21  ASN  14          HD21      ASN  14   9.636  -4.117   0.921
  103   HD22  ASN  14          HD22      ASN  14  10.988  -4.428   1.943
  104    H    PHE  15           HN       PHE  15   5.682  -2.951  -0.316
  105    HA   PHE  15           HA       PHE  15   3.478  -2.978   1.510
  106    HB2  PHE  15           HB2      PHE  15   3.460  -0.843   0.742
  107    HB3  PHE  15           HB1      PHE  15   4.531  -1.257  -0.584
  108    HD1  PHE  15           HD1      PHE  15   1.009  -0.964   0.468
  109    HD2  PHE  15           HD2      PHE  15   3.667  -1.665  -2.770
  110    HE1  PHE  15           HE1      PHE  15  -0.851  -0.670  -1.119
  111    HE2  PHE  15           HE2      PHE  15   1.833  -1.378  -4.359
  112    HZ   PHE  15           HZ       PHE  15  -0.445  -0.873  -3.535
  113    H    LEU  16           HN       LEU  16   4.748  -4.537  -1.225
  114    HA   LEU  16           HA       LEU  16   2.229  -5.813  -1.660
  115    HB2  LEU  16           HB2      LEU  16   2.124  -5.136  -3.680
  116    HB3  LEU  16           HB1      LEU  16   3.069  -3.849  -3.117
  117    HG   LEU  16           HG       LEU  16   4.242  -6.145  -4.704
  118   HD11  LEU  16          HD11      LEU  16   4.443  -4.531  -6.514
  119   HD12  LEU  16          HD12      LEU  16   3.624  -3.320  -5.532
  120   HD13  LEU  16          HD13      LEU  16   2.758  -4.765  -6.051
  121   HD21  LEU  16          HD21      LEU  16   5.447  -3.515  -3.871
  122   HD22  LEU  16          HD22      LEU  16   6.232  -4.752  -4.861
  123   HD23  LEU  16          HD23      LEU  16   5.833  -5.084  -3.171
  124    H    VAL  17           HN       VAL  17   4.544  -6.643  -0.158
  125    HA   VAL  17           HA       VAL  17   6.153  -8.345  -1.854
  126    HB   VAL  17           HB       VAL  17   7.270  -6.983  -0.152
  127   HG11  VAL  17          HG11      VAL  17   7.098  -7.493   2.237
  128   HG12  VAL  17          HG12      VAL  17   5.806  -8.642   1.869
  129   HG13  VAL  17          HG13      VAL  17   5.564  -6.932   1.558
  130   HG21  VAL  17          HG21      VAL  17   7.504  -9.928   0.395
  131   HG22  VAL  17          HG22      VAL  17   8.674  -8.691   0.873
  132   HG23  VAL  17          HG23      VAL  17   8.380  -9.013  -0.842
  133    H    HIS  18           HN       HIS  18   3.866  -8.681   0.760
  134    HA   HIS  18           HA       HIS  18   3.297 -11.355  -0.121
  135    HB2  HIS  18           HB2      HIS  18   3.482 -12.280   1.961
  136    HB3  HIS  18           HB1      HIS  18   5.060 -11.561   1.673
  137    HD1  HIS  18           HD1      HIS  18   3.694 -12.398   4.506
  138    HD2  HIS  18           HD2      HIS  18   4.050  -8.577   2.959
  139    HE1  HIS  18           HE1      HIS  18   3.580 -10.871   6.488
  140    HE2  HIS  18           HE2      HIS  18   4.019  -8.591   5.558
  141    H    SER  19           HN       SER  19   2.150  -8.725  -0.165
  142    HA   SER  19           HA       SER  19   0.233  -8.638   1.985
  143    HB2  SER  19           HB2      SER  19   0.657  -6.682  -0.204
  144    HB3  SER  19           HB1      SER  19  -0.004  -6.416   1.408
  145    HG   SER  19           HG       SER  19   1.971  -5.934   1.969
  146    H    SER  20           HN       SER  20  -1.474  -9.764   1.599
  147    HA   SER  20           HA       SER  20  -2.818  -9.559  -0.963
  148    HB2  SER  20           HB2      SER  20  -3.825 -11.753  -0.031
  149    HB3  SER  20           HB1      SER  20  -2.205 -11.819  -0.770
  150    HG   SER  20           HG       SER  20  -1.737 -12.693   1.098
  151    H    ASN  21           HN       ASN  21  -2.869  -8.967   2.347
  152    HA   ASN  21           HA       ASN  21  -5.762  -8.377   2.389
  153    HB2  ASN  21           HB2      ASN  21  -3.976  -9.651   4.395
  154    HB3  ASN  21           HB1      ASN  21  -5.565  -9.017   4.845
  155   HD21  ASN  21          HD21      ASN  21  -3.792 -11.558   3.290
  156   HD22  ASN  21          HD22      ASN  21  -5.115 -12.617   3.038
  157    H    ASN  22           HN       ASN  22  -2.832  -6.949   2.300
  158    HA   ASN  22           HA       ASN  22  -3.392  -5.173   4.556
  159    HB2  ASN  22           HB2      ASN  22  -1.237  -6.920   3.990
  160    HB3  ASN  22           HB1      ASN  22  -0.713  -5.270   4.238
  161   HD21  ASN  22          HD21      ASN  22  -3.613  -6.656   5.646
  162   HD22  ASN  22          HD22      ASN  22  -3.067  -6.718   7.260
  163    H    PHE  23           HN       PHE  23  -2.760  -5.463   1.313
  164    HA   PHE  23           HA       PHE  23  -0.861  -3.424   1.147
  165    HB2  PHE  23           HB2      PHE  23  -0.843  -3.939  -1.254
  166    HB3  PHE  23           HB1      PHE  23  -0.806  -5.347  -0.202
  167    HD1  PHE  23           HD1      PHE  23  -2.696  -3.671  -2.742
  168    HD2  PHE  23           HD2      PHE  23  -2.495  -6.706   0.112
  169    HE1  PHE  23           HE1      PHE  23  -4.547  -4.825  -3.922
  170    HE2  PHE  23           HE2      PHE  23  -4.323  -7.931  -1.001
  171    HZ   PHE  23           HZ       PHE  23  -5.375  -6.970  -3.051
  172    H    GLY  24           HN       GLY  24  -1.406  -1.634   1.682
  173    HA2  GLY  24           HA2      GLY  24  -2.503   0.298   2.056
  174    HA3  GLY  24           HA1      GLY  24  -3.100   0.319   0.447
  175    H    ALA  25           HN       ALA  25  -3.623  -2.078   2.951
  176    HA   ALA  25           HA       ALA  25  -6.445  -1.386   3.029
  177    HB1  ALA  25           HB1      ALA  25  -5.947  -3.668   2.401
  178    HB2  ALA  25           HB2      ALA  25  -6.704  -3.649   4.008
  179    HB3  ALA  25           HB3      ALA  25  -4.954  -3.865   3.842
  180    H    ILE  26           HN       ILE  26  -3.632  -2.218   4.837
  181    HA   ILE  26           HA       ILE  26  -4.768  -1.048   7.145
  182    HB   ILE  26           HB       ILE  26  -3.609  -3.077   7.654
  183   HG12  ILE  26          HG12      ILE  26  -1.670  -0.931   8.119
  184   HG13  ILE  26          HG11      ILE  26  -3.088  -1.072   9.146
  185   HG21  ILE  26          HG21      ILE  26  -1.394  -1.911   6.029
  186   HG22  ILE  26          HG22      ILE  26  -2.363  -3.329   5.612
  187   HG23  ILE  26          HG23      ILE  26  -1.215  -3.401   6.964
  188   HD11  ILE  26          HD11      ILE  26  -1.168  -2.041  10.301
  189   HD12  ILE  26          HD12      ILE  26  -0.769  -3.019   8.890
  190   HD13  ILE  26          HD13      ILE  26  -2.232  -3.361   9.814
  191    H    LEU  27           HN       LEU  27  -2.270  -0.608   4.728
  192    HA   LEU  27           HA       LEU  27  -0.987   1.627   5.766
  193    HB2  LEU  27           HB2      LEU  27   0.236   0.937   4.014
  194    HB3  LEU  27           HB1      LEU  27  -1.136   0.151   3.288
  195    HG   LEU  27           HG       LEU  27  -1.774   2.374   2.279
  196   HD11  LEU  27          HD11      LEU  27  -0.609   3.839   3.768
  197   HD12  LEU  27          HD12      LEU  27  -0.194   4.067   2.065
  198   HD13  LEU  27          HD13      LEU  27   0.954   3.243   3.145
  199   HD21  LEU  27          HD21      LEU  27  -0.112   2.323   0.540
  200   HD22  LEU  27          HD22      LEU  27  -0.671   0.709   0.981
  201   HD23  LEU  27          HD23      LEU  27   0.910   1.282   1.535
  202    H    SER  28           HN       SER  28  -3.716   1.200   3.641
  203    HA   SER  28           HA       SER  28  -4.332   3.897   4.266
  204    HB2  SER  28           HB2      SER  28  -5.204   2.449   1.781
  205    HB3  SER  28           HB1      SER  28  -5.580   4.107   2.310
  206    HG   SER  28           HG       SER  28  -3.383   4.576   2.254
  207    H    SER  29           HN       SER  29  -5.136   2.729   6.122
  208    HA   SER  29           HA       SER  29  -7.505   1.160   6.043
  209    HB2  SER  29           HB2      SER  29  -6.399   2.763   8.359
  210    HB3  SER  29           HB1      SER  29  -7.684   1.565   8.484
  211    HG   SER  29           HG       SER  29  -4.942   1.197   7.920
  212    H    THR  30           HN       THR  30  -7.094   4.260   5.284
  213    HA   THR  30           HA       THR  30  -9.284   5.632   6.310
  214    HB   THR  30           HB       THR  30  -8.746   7.143   4.396
  215    HG1  THR  30           HG1      THR  30  -7.473   6.390   2.826
  216   HG21  THR  30          HG21      THR  30  -6.467   5.939   5.905
  217   HG22  THR  30          HG22      THR  30  -7.503   7.238   6.504
  218   HG23  THR  30          HG23      THR  30  -6.397   7.531   5.137
  219    H    ASN  31           HN       ASN  31  -8.841   3.388   3.721
  220    HA   ASN  31           HA       ASN  31 -11.315   3.891   2.342
  221    HB2  ASN  31           HB2      ASN  31  -9.510   1.461   2.275
  222    HB3  ASN  31           HB1      ASN  31 -10.912   1.664   1.238
  223   HD21  ASN  31          HD21      ASN  31  -7.649   2.590   1.854
  224   HD22  ASN  31          HD22      ASN  31  -7.422   3.512   0.413
  225    H    VAL  32           HN       VAL  32 -10.365   2.212   5.040
  226    HA   VAL  32           HA       VAL  32 -12.697   0.465   5.233
  227    HB   VAL  32           HB       VAL  32 -10.638   0.939   7.384
  228   HG11  VAL  32          HG11      VAL  32 -12.219  -1.508   6.672
  229   HG12  VAL  32          HG12      VAL  32 -12.530  -0.408   8.012
  230   HG13  VAL  32          HG13      VAL  32 -11.058  -1.385   7.995
  231   HG21  VAL  32          HG21      VAL  32  -9.216  -0.831   6.443
  232   HG22  VAL  32          HG22      VAL  32  -9.354   0.569   5.382
  233   HG23  VAL  32          HG23      VAL  32 -10.263  -0.901   5.019
  234    H    GLY  33           HN       GLY  33 -11.855   3.627   5.862
  235    HA2  GLY  33           HA2      GLY  33 -13.047   5.320   6.871
  236    HA3  GLY  33           HA1      GLY  33 -14.145   4.113   7.540
  237    H    SER  34           HN       SER  34 -10.833   3.467   7.963
  238    HA   SER  34           HA       SER  34  -9.514   3.221   9.751
  239    HB2  SER  34           HB2      SER  34 -10.899   5.734  10.706
  240    HB3  SER  34           HB1      SER  34  -9.363   5.071  11.293
  241    HG   SER  34           HG       SER  34  -9.945   6.502   9.010
  242    H    ASN  35           HN       ASN  35 -12.121   2.128   9.663
  243    HA   ASN  35           HA       ASN  35 -13.583   1.961  12.088
  244    HB2  ASN  35           HB2      ASN  35 -14.265   1.158   9.760
  245    HB3  ASN  35           HB1      ASN  35 -13.248  -0.240  10.039
  246   HD21  ASN  35          HD21      ASN  35 -16.022  -0.224   9.467
  247   HD22  ASN  35          HD22      ASN  35 -16.825  -0.932  10.825
  248    H    THR  36           HN       THR  36 -10.804   0.297  10.884
  249    HA   THR  36           HA       THR  36 -10.663  -1.742  12.851
  250    HB   THR  36           HB       THR  36  -8.399  -1.890  11.507
  251    HG1  THR  36           HG1      THR  36  -8.325  -0.229  10.194
  252   HG21  THR  36          HG21      THR  36  -9.612  -3.148   9.766
  253   HG22  THR  36          HG22      THR  36 -11.122  -2.389  10.282
  254   HG23  THR  36          HG23      THR  36 -10.271  -3.485  11.368
  255    H    TYC  37           HN       ATY  37 -10.662   0.866  13.997
  256    HA   TYC  37           HA       ATY  37  -9.688   2.277  15.385
  257    HB1  TYC  37           HB1      ATY  37  -8.019   1.412  16.881
  258    HB2  TYC  37           HB2      ATY  37  -7.808  -0.037  15.903
  259    HD1  TYC  37           HD1      ATY  37  -9.468  -1.813  15.959
  260    HD2  TYC  37           HD2      ATY  37  -9.995   1.718  18.261
  261    HE1  TYC  37           HE1      ATY  37 -11.209  -2.938  17.271
  262    HE2  TYC  37           HE2      ATY  37 -11.739   0.604  19.582
  263    HH   TYC  37           HH       ATY  37 -13.275  -1.236  19.385
  264   HT21  TYC  37          HT21      ATY  37  -9.110   3.497  13.557
  265   HT22  TYC  37          HT22      ATY  37  -7.439   3.789  13.201
  Start of MODEL   14
    1    H1   LYS   1           HT1      LYS   1  10.231   8.233   9.244
    2    H2   LYS   1           HT2      LYS   1  11.248   7.038   9.823
    3    H3   LYS   1           HT3      LYS   1   9.584   6.903  10.078
    4    HA   LYS   1           HA       LYS   1  10.330   5.432   8.334
    5    HB2  LYS   1           HB2      LYS   1   8.822   6.165   6.536
    6    HB3  LYS   1           HB1      LYS   1   8.070   6.476   8.093
    7    HG2  LYS   1           HG2      LYS   1   8.534   8.819   7.925
    8    HG3  LYS   1           HG1      LYS   1   9.541   8.574   6.500
    9    HD2  LYS   1           HD2      LYS   1   7.396   9.457   5.819
   10    HD3  LYS   1           HD1      LYS   1   7.528   7.788   5.280
   11    HE2  LYS   1           HE2      LYS   1   6.151   7.052   7.145
   12    HE3  LYS   1           HE1      LYS   1   6.080   8.705   7.756
   13    HZ1  LYS   1           HZ1      LYS   1   4.910   9.365   5.770
   14    HZ2  LYS   1           HZ2      LYS   1   4.084   8.089   6.504
   15    HZ3  LYS   1           HZ3      LYS   1   5.024   7.817   5.135
   16    H    CYS   2           HN       CYS   2  10.703   5.824   5.741
   17    HA   CYS   2           HA       CYS   2  12.723   7.885   5.450
   18    HB2  CYS   2           HB2      CYS   2  13.825   6.337   3.790
   19    HB3  CYS   2           HB1      CYS   2  13.986   5.841   5.483
   20    H    ASN   3           HN       ASN   3  12.851   8.714   3.265
   21    HA   ASN   3           HA       ASN   3  10.340   8.342   1.813
   22    HB2  ASN   3           HB2      ASN   3  10.024  10.064   3.628
   23    HB3  ASN   3           HB1      ASN   3  11.245  11.044   2.833
   24   HD21  ASN   3          HD21      ASN   3  10.671  12.220   1.081
   25   HD22  ASN   3          HD22      ASN   3   9.062  12.351   0.470
   26    H    THR   4           HN       THR   4  13.306   8.004   1.425
   27    HA   THR   4           HA       THR   4  13.637   9.772  -0.867
   28    HB   THR   4           HB       THR   4  15.607   9.635   0.621
   29    HG1  THR   4           HG1      THR   4  16.630   9.867  -1.192
   30   HG21  THR   4          HG21      THR   4  15.663   6.696  -0.074
   31   HG22  THR   4          HG22      THR   4  15.232   7.353   1.497
   32   HG23  THR   4          HG23      THR   4  16.875   7.553   0.877
   33    H    ALA   5           HN       ALA   5  14.448   8.771  -2.812
   34    HA   ALA   5           HA       ALA   5  12.630   6.819  -3.775
   35    HB1  ALA   5           HB1      ALA   5  13.516   8.605  -5.199
   36    HB2  ALA   5           HB2      ALA   5  13.835   7.015  -5.895
   37    HB3  ALA   5           HB3      ALA   5  15.126   7.896  -5.077
   38    H    THR   6           HN       THR   6  15.665   6.625  -2.332
   39    HA   THR   6           HA       THR   6  16.362   4.024  -3.326
   40    HB   THR   6           HB       THR   6  17.437   5.688  -1.055
   41    HG1  THR   6           HG1      THR   6  17.678   5.799  -3.786
   42   HG21  THR   6          HG21      THR   6  18.075   3.365  -0.875
   43   HG22  THR   6          HG22      THR   6  19.485   4.336  -1.326
   44   HG23  THR   6          HG23      THR   6  18.651   3.347  -2.542
   45    H    CYS   7           HN       CYS   7  14.163   5.142  -0.958
   46    HA   CYS   7           HA       CYS   7  14.500   2.664   0.633
   47    HB2  CYS   7           HB2      CYS   7  15.419   4.862   1.528
   48    HB3  CYS   7           HB1      CYS   7  13.793   5.268   1.766
   49    H    ALA   8           HN       ALA   8  12.344   5.397  -0.139
   50    HA   ALA   8           HA       ALA   8  10.141   4.322   1.192
   51    HB1  ALA   8           HB1      ALA   8  10.255   6.297  -1.077
   52    HB2  ALA   8           HB2      ALA   8  10.354   6.675   0.639
   53    HB3  ALA   8           HB3      ALA   8   8.858   6.017  -0.031
   54    H    THR   9           HN       THR   9  11.652   3.772  -1.751
   55    HA   THR   9           HA       THR   9   9.570   2.548  -3.270
   56    HB   THR   9           HB       THR   9  11.600   1.532  -4.444
   57    HG1  THR   9           HG1      THR   9  13.409   3.194  -3.790
   58   HG21  THR   9          HG21      THR   9  10.340   3.482  -5.275
   59   HG22  THR   9          HG22      THR   9  12.071   3.690  -5.552
   60   HG23  THR   9          HG23      THR   9  11.286   4.531  -4.216
   61    H    GLN  10           HN       GLN  10  11.767   1.575  -0.930
   62    HA   GLN  10           HA       GLN  10  11.506  -1.269  -1.221
   63    HB2  GLN  10           HB2      GLN  10  12.537   0.221   1.196
   64    HB3  GLN  10           HB1      GLN  10  12.874  -1.452   0.755
   65    HG2  GLN  10           HG2      GLN  10  13.797   1.034  -0.657
   66    HG3  GLN  10           HG1      GLN  10  14.785  -0.089   0.272
   67   HE21  GLN  10          HE21      GLN  10  14.830   0.849  -2.495
   68   HE22  GLN  10          HE22      GLN  10  14.888  -0.575  -3.473
   69    H    ARG  11           HN       ARG  11  10.106   1.274   0.610
   70    HA   ARG  11           HA       ARG  11   8.440  -0.355   2.322
   71    HB2  ARG  11           HB2      ARG  11   7.781   2.419   1.314
   72    HB3  ARG  11           HB1      ARG  11   7.160   1.631   2.755
   73    HG2  ARG  11           HG2      ARG  11   9.973   2.617   2.310
   74    HG3  ARG  11           HG1      ARG  11   8.774   3.306   3.408
   75    HD2  ARG  11           HD2      ARG  11  10.051   0.596   3.561
   76    HD3  ARG  11           HD1      ARG  11  10.390   1.975   4.605
   77    HE   ARG  11           HE       ARG  11   7.815   1.696   5.053
   78   HH11  ARG  11          HH11      ARG  11  10.270  -0.845   4.867
   79   HH12  ARG  11          HH12      ARG  11   9.465  -1.896   5.927
   80   HH21  ARG  11          HH21      ARG  11   6.717   0.290   6.458
   81   HH22  ARG  11          HH22      ARG  11   7.328  -1.245   6.873
   82    H    LEU  12           HN       LEU  12   8.078   1.114  -0.802
   83    HA   LEU  12           HA       LEU  12   5.533   0.207  -1.439
   84    HB2  LEU  12           HB2      LEU  12   8.010   0.799  -2.920
   85    HB3  LEU  12           HB1      LEU  12   6.628   0.401  -3.828
   86    HG   LEU  12           HG       LEU  12   7.100   2.816  -2.084
   87   HD11  LEU  12          HD11      LEU  12   6.369   2.547  -4.985
   88   HD12  LEU  12          HD12      LEU  12   7.971   2.924  -4.361
   89   HD13  LEU  12          HD13      LEU  12   6.641   4.060  -4.125
   90   HD21  LEU  12          HD21      LEU  12   4.831   2.131  -1.593
   91   HD22  LEU  12          HD22      LEU  12   4.481   1.952  -3.307
   92   HD23  LEU  12          HD23      LEU  12   4.795   3.553  -2.634
   93    H    ALA  13           HN       ALA  13   8.722  -1.236  -1.687
   94    HA   ALA  13           HA       ALA  13   7.953  -3.525  -3.065
   95    HB1  ALA  13           HB1      ALA  13  10.132  -4.446  -2.427
   96    HB2  ALA  13           HB2      ALA  13  10.310  -3.193  -1.209
   97    HB3  ALA  13           HB3      ALA  13  10.287  -2.759  -2.920
   98    H    ASN  14           HN       ASN  14   7.856  -2.651   0.289
   99    HA   ASN  14           HA       ASN  14   7.251  -5.326   1.217
  100    HB2  ASN  14           HB2      ASN  14   7.189  -2.673   2.657
  101    HB3  ASN  14           HB1      ASN  14   6.640  -4.190   3.376
  102   HD21  ASN  14          HD21      ASN  14   9.357  -3.957   1.248
  103   HD22  ASN  14          HD22      ASN  14  10.548  -4.295   2.454
  104    H    PHE  15           HN       PHE  15   5.507  -2.977  -0.386
  105    HA   PHE  15           HA       PHE  15   3.068  -3.371   1.048
  106    HB2  PHE  15           HB2      PHE  15   3.013  -1.197   0.363
  107    HB3  PHE  15           HB1      PHE  15   4.251  -1.487  -0.849
  108    HD1  PHE  15           HD1      PHE  15   3.653  -2.021  -3.111
  109    HD2  PHE  15           HD2      PHE  15   0.640  -1.353  -0.189
  110    HE1  PHE  15           HE1      PHE  15   2.020  -1.847  -4.881
  111    HE2  PHE  15           HE2      PHE  15  -1.047  -1.161  -1.975
  112    HZ   PHE  15           HZ       PHE  15  -0.370  -1.408  -4.333
  113    H    LEU  16           HN       LEU  16   4.904  -4.729  -1.475
  114    HA   LEU  16           HA       LEU  16   2.581  -6.230  -2.258
  115    HB2  LEU  16           HB2      LEU  16   2.747  -5.537  -4.271
  116    HB3  LEU  16           HB1      LEU  16   3.586  -4.249  -3.599
  117    HG   LEU  16           HG       LEU  16   5.180  -6.533  -4.751
  118   HD11  LEU  16          HD11      LEU  16   3.783  -5.612  -6.524
  119   HD12  LEU  16          HD12      LEU  16   5.468  -5.136  -6.743
  120   HD13  LEU  16          HD13      LEU  16   4.301  -3.982  -6.095
  121   HD21  LEU  16          HD21      LEU  16   6.932  -4.843  -4.829
  122   HD22  LEU  16          HD22      LEU  16   6.290  -5.035  -3.188
  123   HD23  LEU  16          HD23      LEU  16   5.796  -3.655  -4.175
  124    H    VAL  17           HN       VAL  17   4.759  -6.794  -0.404
  125    HA   VAL  17           HA       VAL  17   6.563  -8.589  -1.803
  126    HB   VAL  17           HB       VAL  17   7.505  -7.095  -0.097
  127   HG11  VAL  17          HG11      VAL  17   7.103  -7.415   2.283
  128   HG12  VAL  17          HG12      VAL  17   5.890  -8.642   1.898
  129   HG13  VAL  17          HG13      VAL  17   5.618  -6.974   1.431
  130   HG21  VAL  17          HG21      VAL  17   8.682  -9.149  -0.523
  131   HG22  VAL  17          HG22      VAL  17   7.686  -9.983   0.687
  132   HG23  VAL  17          HG23      VAL  17   8.795  -8.694   1.183
  133    H    HIS  18           HN       HIS  18   4.044  -8.781   0.596
  134    HA   HIS  18           HA       HIS  18   3.655 -11.577   0.012
  135    HB2  HIS  18           HB2      HIS  18   3.568 -12.148   2.265
  136    HB3  HIS  18           HB1      HIS  18   5.172 -11.454   2.032
  137    HD1  HIS  18           HD1      HIS  18   3.467 -11.781   4.836
  138    HD2  HIS  18           HD2      HIS  18   3.993  -8.305   2.635
  139    HE1  HIS  18           HE1      HIS  18   3.110  -9.916   6.451
  140    HE2  HIS  18           HE2      HIS  18   3.224  -7.823   5.045
  141    H    SER  19           HN       SER  19   2.461  -8.917  -0.478
  142    HA   SER  19           HA       SER  19   0.323  -8.874   1.454
  143    HB2  SER  19           HB2      SER  19   1.035  -6.685  -0.404
  144    HB3  SER  19           HB1      SER  19   0.133  -6.631   1.101
  145    HG   SER  19           HG       SER  19   2.049  -6.018   1.829
  146    H    SER  20           HN       SER  20  -1.157 -10.013   0.665
  147    HA   SER  20           HA       SER  20  -2.387  -9.274  -1.894
  148    HB2  SER  20           HB2      SER  20  -2.265 -12.041  -0.670
  149    HB3  SER  20           HB1      SER  20  -3.128 -11.617  -2.153
  150    HG   SER  20           HG       SER  20  -1.240 -11.115  -3.117
  151    H    ASN  21           HN       ASN  21  -2.656  -9.507   1.448
  152    HA   ASN  21           HA       ASN  21  -5.543  -9.097   1.375
  153    HB2  ASN  21           HB2      ASN  21  -3.869 -10.752   3.218
  154    HB3  ASN  21           HB1      ASN  21  -5.523 -10.289   3.628
  155   HD21  ASN  21          HD21      ASN  21  -4.356 -12.906   3.258
  156   HD22  ASN  21          HD22      ASN  21  -5.232 -13.674   1.993
  157    H    ASN  22           HN       ASN  22  -3.001  -7.314   1.574
  158    HA   ASN  22           HA       ASN  22  -3.491  -6.110   4.153
  159    HB2  ASN  22           HB2      ASN  22  -1.093  -7.495   3.258
  160    HB3  ASN  22           HB1      ASN  22  -0.835  -5.911   3.961
  161   HD21  ASN  22          HD21      ASN  22  -3.549  -7.844   4.926
  162   HD22  ASN  22          HD22      ASN  22  -2.989  -8.330   6.438
  163    H    PHE  23           HN       PHE  23  -1.792  -6.077   1.206
  164    HA   PHE  23           HA       PHE  23  -0.926  -3.532   1.104
  165    HB2  PHE  23           HB2      PHE  23  -0.533  -3.849  -1.200
  166    HB3  PHE  23           HB1      PHE  23  -0.423  -5.377  -0.347
  167    HD1  PHE  23           HD1      PHE  23  -1.631  -3.850  -3.191
  168    HD2  PHE  23           HD2      PHE  23  -2.499  -6.718  -0.278
  169    HE1  PHE  23           HE1      PHE  23  -3.130  -4.958  -4.807
  170    HE2  PHE  23           HE2      PHE  23  -3.988  -7.891  -1.813
  171    HZ   PHE  23           HZ       PHE  23  -4.339  -7.005  -4.125
  172    H    GLY  24           HN       GLY  24  -2.005  -2.006   1.653
  173    HA2  GLY  24           HA2      GLY  24  -3.480  -0.340   1.785
  174    HA3  GLY  24           HA1      GLY  24  -3.986  -0.574   0.130
  175    H    ALA  25           HN       ALA  25  -4.248  -3.118   2.434
  176    HA   ALA  25           HA       ALA  25  -7.129  -2.941   2.448
  177    HB1  ALA  25           HB1      ALA  25  -6.923  -5.149   3.578
  178    HB2  ALA  25           HB2      ALA  25  -5.166  -4.914   3.567
  179    HB3  ALA  25           HB3      ALA  25  -6.030  -5.074   2.042
  180    H    ILE  26           HN       ILE  26  -4.278  -2.714   4.255
  181    HA   ILE  26           HA       ILE  26  -5.731  -1.721   6.450
  182    HB   ILE  26           HB       ILE  26  -4.292  -3.337   7.244
  183   HG12  ILE  26          HG12      ILE  26  -2.708  -0.837   7.427
  184   HG13  ILE  26          HG11      ILE  26  -4.049  -1.219   8.508
  185   HG21  ILE  26          HG21      ILE  26  -3.016  -3.816   5.247
  186   HG22  ILE  26          HG22      ILE  26  -1.881  -3.589   6.575
  187   HG23  ILE  26          HG23      ILE  26  -2.157  -2.296   5.403
  188   HD11  ILE  26          HD11      ILE  26  -2.740  -3.164   9.352
  189   HD12  ILE  26          HD12      ILE  26  -1.933  -1.625   9.648
  190   HD13  ILE  26          HD13      ILE  26  -1.394  -2.663   8.328
  191    H    LEU  27           HN       LEU  27  -2.919  -0.999   4.399
  192    HA   LEU  27           HA       LEU  27  -2.237   1.561   5.130
  193    HB2  LEU  27           HB2      LEU  27  -0.698   0.809   3.671
  194    HB3  LEU  27           HB1      LEU  27  -1.870  -0.264   2.952
  195    HG   LEU  27           HG       LEU  27  -2.609   1.576   1.459
  196   HD11  LEU  27          HD11      LEU  27  -1.229   3.479   1.117
  197   HD12  LEU  27          HD12      LEU  27  -0.264   3.083   2.557
  198   HD13  LEU  27          HD13      LEU  27  -1.990   3.487   2.707
  199   HD21  LEU  27          HD21      LEU  27  -0.677   1.475  -0.001
  200   HD22  LEU  27          HD22      LEU  27  -1.062  -0.093   0.704
  201   HD23  LEU  27          HD23      LEU  27   0.295   0.845   1.328
  202    H    SER  28           HN       SER  28  -4.542   0.590   2.721
  203    HA   SER  28           HA       SER  28  -5.299   3.384   2.486
  204    HB2  SER  28           HB2      SER  28  -6.014   1.070   0.697
  205    HB3  SER  28           HB1      SER  28  -6.480   2.751   0.432
  206    HG   SER  28           HG       SER  28  -4.239   3.257   0.363
  207    H    SER  29           HN       SER  29  -6.137   0.547   3.786
  208    HA   SER  29           HA       SER  29  -7.807  -0.285   5.085
  209    HB2  SER  29           HB2      SER  29  -8.793   2.556   5.057
  210    HB3  SER  29           HB1      SER  29  -9.279   1.321   6.213
  211    HG   SER  29           HG       SER  29  -6.528   1.612   6.064
  212    H    THR  30           HN       THR  30  -8.084  -0.278   2.173
  213    HA   THR  30           HA       THR  30 -10.584   0.460   1.267
  214    HB   THR  30           HB       THR  30  -8.766  -0.153  -0.269
  215    HG1  THR  30           HG1      THR  30 -10.732  -0.248  -1.167
  216   HG21  THR  30          HG21      THR  30  -9.245  -2.992   0.648
  217   HG22  THR  30          HG22      THR  30  -7.764  -2.035   0.843
  218   HG23  THR  30          HG23      THR  30  -8.283  -2.539  -0.757
  219    H    ASN  31           HN       ASN  31  -9.702  -2.313   3.129
  220    HA   ASN  31           HA       ASN  31 -12.313  -3.565   2.625
  221    HB2  ASN  31           HB2      ASN  31  -9.776  -4.786   3.721
  222    HB3  ASN  31           HB1      ASN  31 -11.309  -5.642   3.590
  223   HD21  ASN  31          HD21      ASN  31  -8.778  -6.252   2.304
  224   HD22  ASN  31          HD22      ASN  31  -9.072  -6.208   0.618
  225    H    VAL  32           HN       VAL  32 -11.456  -1.371   4.569
  226    HA   VAL  32           HA       VAL  32 -12.452  -2.593   7.043
  227    HB   VAL  32           HB       VAL  32 -11.374   0.230   6.629
  228   HG11  VAL  32          HG11      VAL  32 -11.635  -1.404   9.150
  229   HG12  VAL  32          HG12      VAL  32 -12.684  -0.069   8.675
  230   HG13  VAL  32          HG13      VAL  32 -10.980   0.228   9.030
  231   HG21  VAL  32          HG21      VAL  32  -9.877  -2.222   7.519
  232   HG22  VAL  32          HG22      VAL  32  -9.242  -0.571   7.513
  233   HG23  VAL  32          HG23      VAL  32  -9.689  -1.357   5.994
  234    H    GLY  33           HN       GLY  33 -13.881  -1.825   4.471
  235    HA2  GLY  33           HA2      GLY  33 -16.191  -1.375   4.290
  236    HA3  GLY  33           HA1      GLY  33 -16.089  -0.396   5.752
  237    H    SER  34           HN       SER  34 -13.492   0.226   3.777
  238    HA   SER  34           HA       SER  34 -14.511   2.813   3.148
  239    HB2  SER  34           HB2      SER  34 -12.139   2.414   3.805
  240    HB3  SER  34           HB1      SER  34 -11.912   1.473   2.339
  241    HG   SER  34           HG       SER  34 -12.835   4.124   2.210
  242    H    ASN  35           HN       ASN  35 -13.642  -0.131   1.386
  243    HA   ASN  35           HA       ASN  35 -15.229   0.854  -0.889
  244    HB2  ASN  35           HB2      ASN  35 -12.829  -0.910  -0.799
  245    HB3  ASN  35           HB1      ASN  35 -13.815  -0.740  -2.261
  246   HD21  ASN  35          HD21      ASN  35 -13.716   1.247  -3.346
  247   HD22  ASN  35          HD22      ASN  35 -12.446   2.378  -3.073
  248    H    THR  36           HN       THR  36 -14.621  -1.700   1.362
  249    HA   THR  36           HA       THR  36 -16.173  -3.607  -0.019
  250    HB   THR  36           HB       THR  36 -16.045  -4.733   2.315
  251    HG1  THR  36           HG1      THR  36 -15.169  -3.607   3.755
  252   HG21  THR  36          HG21      THR  36 -14.718  -5.429   0.375
  253   HG22  THR  36          HG22      THR  36 -13.746  -5.481   1.846
  254   HG23  THR  36          HG23      THR  36 -13.552  -4.149   0.708
  255    H    TYC  37           HN       ATY  37 -18.178  -2.926  -0.384
  256    HA   TYC  37           HA       ATY  37 -19.813  -2.111   1.904
  257    HB1  TYC  37           HB1      ATY  37 -21.387  -1.175   0.296
  258    HB2  TYC  37           HB2      ATY  37 -20.469  -1.846  -1.043
  259    HD1  TYC  37           HD1      ATY  37 -19.580   0.232   1.955
  260    HD2  TYC  37           HD2      ATY  37 -19.421  -0.226  -2.275
  261    HE1  TYC  37           HE1      ATY  37 -18.266   2.300   1.779
  262    HE2  TYC  37           HE2      ATY  37 -18.103   1.838  -2.454
  263    HH   TYC  37           HH       ATY  37 -16.555   3.180   0.074
  264   HT21  TYC  37          HT21      ATY  37 -20.375  -3.815  -1.135
  265   HT22  TYC  37          HT22      ATY  37 -21.290  -5.113  -0.453
  Start of MODEL   15
    1    H1   LYS   1           HT1      LYS   1  12.914   5.061   9.086
    2    H2   LYS   1           HT2      LYS   1  11.888   5.423  10.387
    3    H3   LYS   1           HT3      LYS   1  12.941   6.591   9.739
    4    HA   LYS   1           HA       LYS   1  10.746   5.381   8.216
    5    HB2  LYS   1           HB2      LYS   1  10.045   6.957  10.102
    6    HB3  LYS   1           HB1      LYS   1  11.015   8.197   9.329
    7    HG2  LYS   1           HG2      LYS   1   9.582   8.145   7.366
    8    HG3  LYS   1           HG1      LYS   1   8.648   6.822   8.062
    9    HD2  LYS   1           HD2      LYS   1   7.383   8.799   8.443
   10    HD3  LYS   1           HD1      LYS   1   8.103   8.366   9.985
   11    HE2  LYS   1           HE2      LYS   1   8.290  10.742   9.703
   12    HE3  LYS   1           HE1      LYS   1   9.896  10.047   9.550
   13    HZ1  LYS   1           HZ1      LYS   1   8.167  10.813   7.246
   14    HZ2  LYS   1           HZ2      LYS   1   9.776  10.288   7.164
   15    HZ3  LYS   1           HZ3      LYS   1   9.406  11.752   7.869
   16    H    CYS   2           HN       CYS   2  10.898   5.938   6.019
   17    HA   CYS   2           HA       CYS   2  12.909   7.899   5.349
   18    HB2  CYS   2           HB2      CYS   2  13.819   6.356   3.587
   19    HB3  CYS   2           HB1      CYS   2  14.231   5.950   5.252
   20    H    ASN   3           HN       ASN   3  12.816   8.693   3.187
   21    HA   ASN   3           HA       ASN   3  10.220   8.302   1.870
   22    HB2  ASN   3           HB2      ASN   3   9.968  10.085   3.623
   23    HB3  ASN   3           HB1      ASN   3  11.204  11.018   2.799
   24   HD21  ASN   3          HD21      ASN   3   8.586   9.171   1.235
   25   HD22  ASN   3          HD22      ASN   3   7.821  10.555   0.579
   26    H    THR   4           HN       THR   4  13.175   7.955   1.362
   27    HA   THR   4           HA       THR   4  13.564   9.739  -0.923
   28    HB   THR   4           HB       THR   4  15.488   9.602   0.600
   29    HG1  THR   4           HG1      THR   4  16.377   9.809  -1.302
   30   HG21  THR   4          HG21      THR   4  14.989   7.390   1.548
   31   HG22  THR   4          HG22      THR   4  16.671   7.527   1.018
   32   HG23  THR   4          HG23      THR   4  15.496   6.647   0.033
   33    H    ALA   5           HN       ALA   5  14.439   8.739  -2.862
   34    HA   ALA   5           HA       ALA   5  12.654   6.824  -3.922
   35    HB1  ALA   5           HB1      ALA   5  13.647   8.615  -5.263
   36    HB2  ALA   5           HB2      ALA   5  13.952   7.027  -5.973
   37    HB3  ALA   5           HB3      ALA   5  15.231   7.861  -5.090
   38    H    THR   6           HN       THR   6  15.610   6.509  -2.317
   39    HA   THR   6           HA       THR   6  16.167   3.876  -3.385
   40    HB   THR   6           HB       THR   6  17.458   5.492  -1.186
   41    HG1  THR   6           HG1      THR   6  17.582   5.521  -3.897
   42   HG21  THR   6          HG21      THR   6  17.893   3.127  -0.913
   43   HG22  THR   6          HG22      THR   6  19.366   3.955  -1.440
   44   HG23  THR   6          HG23      THR   6  18.421   2.990  -2.588
   45    H    CYS   7           HN       CYS   7  14.129   5.116  -0.961
   46    HA   CYS   7           HA       CYS   7  14.417   2.628   0.624
   47    HB2  CYS   7           HB2      CYS   7  15.392   4.836   1.481
   48    HB3  CYS   7           HB1      CYS   7  13.768   5.219   1.790
   49    H    ALA   8           HN       ALA   8  12.303   5.379  -0.200
   50    HA   ALA   8           HA       ALA   8  10.050   4.371   1.136
   51    HB1  ALA   8           HB1      ALA   8   8.793   5.964  -0.281
   52    HB2  ALA   8           HB2      ALA   8  10.268   6.237  -1.226
   53    HB3  ALA   8           HB3      ALA   8  10.211   6.695   0.474
   54    H    THR   9           HN       THR   9  11.627   3.751  -1.802
   55    HA   THR   9           HA       THR   9   9.565   2.434  -3.229
   56    HB   THR   9           HB       THR   9  11.588   1.468  -4.418
   57    HG1  THR   9           HG1      THR   9  13.421   3.092  -3.838
   58   HG21  THR   9          HG21      THR   9  10.277   3.388  -5.237
   59   HG22  THR   9          HG22      THR   9  12.001   3.621  -5.551
   60   HG23  THR   9          HG23      THR   9  11.230   4.456  -4.204
   61    H    GLN  10           HN       GLN  10  11.844   1.543  -0.888
   62    HA   GLN  10           HA       GLN  10  11.597  -1.323  -1.083
   63    HB2  GLN  10           HB2      GLN  10  12.574   0.325   1.259
   64    HB3  GLN  10           HB1      GLN  10  12.818  -1.401   1.041
   65    HG2  GLN  10           HG2      GLN  10  13.919   0.782  -0.687
   66    HG3  GLN  10           HG1      GLN  10  14.809  -0.169   0.499
   67   HE21  GLN  10          HE21      GLN  10  14.981   0.210  -2.351
   68   HE22  GLN  10          HE22      GLN  10  15.075  -1.375  -3.056
   69    H    ARG  11           HN       ARG  11  10.321   1.218   0.808
   70    HA   ARG  11           HA       ARG  11   8.624  -0.346   2.523
   71    HB2  ARG  11           HB2      ARG  11   7.916   2.447   1.588
   72    HB3  ARG  11           HB1      ARG  11   7.498   1.690   3.115
   73    HG2  ARG  11           HG2      ARG  11  10.219   2.679   2.265
   74    HG3  ARG  11           HG1      ARG  11   9.161   3.405   3.472
   75    HD2  ARG  11           HD2      ARG  11  10.453   0.688   3.639
   76    HD3  ARG  11           HD1      ARG  11  11.026   2.150   4.439
   77    HE   ARG  11           HE       ARG  11   8.378   1.741   5.173
   78   HH11  ARG  11          HH11      ARG  11  11.509   0.168   5.649
   79   HH12  ARG  11          HH12      ARG  11  11.118  -0.457   7.183
   80   HH21  ARG  11          HH21      ARG  11   7.836   0.865   7.229
   81   HH22  ARG  11          HH22      ARG  11   8.970  -0.080   8.095
   82    H    LEU  12           HN       LEU  12   8.177   1.230  -0.594
   83    HA   LEU  12           HA       LEU  12   5.593   0.420  -1.165
   84    HB2  LEU  12           HB2      LEU  12   8.006   1.007  -2.746
   85    HB3  LEU  12           HB1      LEU  12   6.587   0.609  -3.586
   86    HG   LEU  12           HG       LEU  12   7.067   3.039  -1.843
   87   HD11  LEU  12          HD11      LEU  12   7.929   3.208  -4.103
   88   HD12  LEU  12          HD12      LEU  12   6.539   4.272  -3.892
   89   HD13  LEU  12          HD13      LEU  12   6.356   2.747  -4.749
   90   HD21  LEU  12          HD21      LEU  12   4.799   2.284  -1.368
   91   HD22  LEU  12          HD22      LEU  12   4.459   2.170  -3.093
   92   HD23  LEU  12          HD23      LEU  12   4.757   3.741  -2.359
   93    H    ALA  13           HN       ALA  13   8.716  -1.169  -1.661
   94    HA   ALA  13           HA       ALA  13   7.704  -3.313  -3.105
   95    HB1  ALA  13           HB1      ALA  13  10.097  -2.776  -3.026
   96    HB2  ALA  13           HB2      ALA  13   9.812  -4.462  -2.598
   97    HB3  ALA  13           HB3      ALA  13  10.156  -3.278  -1.337
   98    H    ASN  14           HN       ASN  14   7.784  -2.622   0.261
   99    HA   ASN  14           HA       ASN  14   7.119  -5.301   1.082
  100    HB2  ASN  14           HB2      ASN  14   7.140  -2.721   2.630
  101    HB3  ASN  14           HB1      ASN  14   6.512  -4.228   3.308
  102   HD21  ASN  14          HD21      ASN  14   9.249  -3.931   1.173
  103   HD22  ASN  14          HD22      ASN  14  10.438  -4.466   2.300
  104    H    PHE  15           HN       PHE  15   5.483  -2.700  -0.109
  105    HA   PHE  15           HA       PHE  15   2.885  -3.465   0.785
  106    HB2  PHE  15           HB2      PHE  15   2.651  -1.263   0.183
  107    HB3  PHE  15           HB1      PHE  15   4.119  -1.349  -0.781
  108    HD1  PHE  15           HD1      PHE  15   0.517  -1.113  -0.873
  109    HD2  PHE  15           HD2      PHE  15   3.942  -2.238  -3.073
  110    HE1  PHE  15           HE1      PHE  15  -0.778  -0.991  -2.967
  111    HE2  PHE  15           HE2      PHE  15   2.768  -2.200  -5.094
  112    HZ   PHE  15           HZ       PHE  15   0.316  -1.523  -5.122
  113    H    LEU  16           HN       LEU  16   5.057  -4.494  -1.695
  114    HA   LEU  16           HA       LEU  16   2.951  -6.057  -3.033
  115    HB2  LEU  16           HB2      LEU  16   5.916  -5.883  -3.658
  116    HB3  LEU  16           HB1      LEU  16   4.767  -6.912  -4.524
  117    HG   LEU  16           HG       LEU  16   5.301  -5.250  -5.915
  118   HD11  LEU  16          HD11      LEU  16   2.823  -4.309  -4.618
  119   HD12  LEU  16          HD12      LEU  16   2.987  -5.523  -5.899
  120   HD13  LEU  16          HD13      LEU  16   3.411  -3.834  -6.213
  121   HD21  LEU  16          HD21      LEU  16   5.264  -2.788  -5.202
  122   HD22  LEU  16          HD22      LEU  16   6.594  -3.834  -4.743
  123   HD23  LEU  16          HD23      LEU  16   5.370  -3.455  -3.549
  124    H    VAL  17           HN       VAL  17   5.968  -6.488  -1.342
  125    HA   VAL  17           HA       VAL  17   6.782  -8.901  -1.625
  126    HB   VAL  17           HB       VAL  17   7.607  -7.111  -0.076
  127   HG11  VAL  17          HG11      VAL  17   7.275  -7.292   2.327
  128   HG12  VAL  17          HG12      VAL  17   6.023  -8.502   2.042
  129   HG13  VAL  17          HG13      VAL  17   5.792  -6.871   1.460
  130   HG21  VAL  17          HG21      VAL  17   7.968 -10.013   0.573
  131   HG22  VAL  17          HG22      VAL  17   8.833  -8.739   1.411
  132   HG23  VAL  17          HG23      VAL  17   9.017  -8.919  -0.338
  133    H    HIS  18           HN       HIS  18   4.368  -8.483   0.860
  134    HA   HIS  18           HA       HIS  18   3.430 -11.276   0.500
  135    HB2  HIS  18           HB2      HIS  18   4.074  -9.989   3.173
  136    HB3  HIS  18           HB1      HIS  18   3.176 -11.482   2.995
  137    HD1  HIS  18           HD1      HIS  18   4.673 -13.260   3.889
  138    HD2  HIS  18           HD2      HIS  18   6.516 -10.500   1.505
  139    HE1  HIS  18           HE1      HIS  18   7.036 -14.063   3.750
  140    HE2  HIS  18           HE2      HIS  18   8.232 -12.157   2.615
  141    H    SER  19           HN       SER  19   2.764  -8.437  -0.004
  142    HA   SER  19           HA       SER  19   0.382  -8.187   1.655
  143    HB2  SER  19           HB2      SER  19   1.864  -6.084   0.118
  144    HB3  SER  19           HB1      SER  19   0.510  -5.805   1.199
  145    HG   SER  19           HG       SER  19   2.981  -5.729   1.901
  146    H    SER  20           HN       SER  20   1.438  -8.837  -1.399
  147    HA   SER  20           HA       SER  20  -0.689  -7.667  -2.916
  148    HB2  SER  20           HB2      SER  20   1.090  -9.973  -3.718
  149    HB3  SER  20           HB1      SER  20   0.094  -9.007  -4.800
  150    HG   SER  20           HG       SER  20   2.288  -8.141  -3.241
  151    H    ASN  21           HN       ASN  21  -0.850 -10.138  -0.827
  152    HA   ASN  21           HA       ASN  21  -3.211 -11.335  -2.136
  153    HB2  ASN  21           HB2      ASN  21  -1.142 -12.395  -0.325
  154    HB3  ASN  21           HB1      ASN  21  -2.730 -13.193  -0.388
  155   HD21  ASN  21          HD21      ASN  21   0.292 -12.665  -1.888
  156   HD22  ASN  21          HD22      ASN  21   0.124 -13.759  -3.203
  157    H    ASN  22           HN       ASN  22  -2.498  -9.033   0.076
  158    HA   ASN  22           HA       ASN  22  -4.505  -9.909   2.003
  159    HB2  ASN  22           HB2      ASN  22  -1.683  -9.527   2.362
  160    HB3  ASN  22           HB1      ASN  22  -2.736  -8.637   3.464
  161   HD21  ASN  22          HD21      ASN  22  -3.728 -11.606   2.007
  162   HD22  ASN  22          HD22      ASN  22  -3.630 -12.601   3.366
  163    H    PHE  23           HN       PHE  23  -2.502  -7.435   0.768
  164    HA   PHE  23           HA       PHE  23  -3.175  -5.353   2.328
  165    HB2  PHE  23           HB2      PHE  23  -2.082  -3.970   0.669
  166    HB3  PHE  23           HB1      PHE  23  -1.323  -5.540   0.847
  167    HD1  PHE  23           HD1      PHE  23  -0.910  -3.586  -1.366
  168    HD2  PHE  23           HD2      PHE  23  -3.418  -6.916  -0.885
  169    HE1  PHE  23           HE1      PHE  23  -0.793  -3.949  -3.758
  170    HE2  PHE  23           HE2      PHE  23  -3.366  -7.343  -3.304
  171    HZ   PHE  23           HZ       PHE  23  -2.043  -5.835  -4.792
  172    H    GLY  24           HN       GLY  24  -5.018  -5.008   2.844
  173    HA2  GLY  24           HA2      GLY  24  -7.174  -4.319   2.896
  174    HA3  GLY  24           HA1      GLY  24  -6.994  -3.490   1.387
  175    H    ALA  25           HN       ALA  25  -6.619  -6.844   2.167
  176    HA   ALA  25           HA       ALA  25  -9.048  -7.505   0.698
  177    HB1  ALA  25           HB1      ALA  25  -8.036  -9.792   0.577
  178    HB2  ALA  25           HB2      ALA  25  -6.642  -9.198   1.467
  179    HB3  ALA  25           HB3      ALA  25  -6.968  -8.581  -0.145
  180    H    ILE  26           HN       ILE  26  -6.957  -8.386   3.264
  181    HA   ILE  26           HA       ILE  26  -9.053  -9.343   4.879
  182    HB   ILE  26           HB       ILE  26  -7.028 -10.607   4.946
  183   HG12  ILE  26          HG12      ILE  26  -6.948  -8.846   7.267
  184   HG13  ILE  26          HG11      ILE  26  -8.167 -10.105   7.169
  185   HG21  ILE  26          HG21      ILE  26  -5.442  -9.050   4.064
  186   HG22  ILE  26          HG22      ILE  26  -4.839  -9.509   5.664
  187   HG23  ILE  26          HG23      ILE  26  -5.695  -7.976   5.423
  188   HD11  ILE  26          HD11      ILE  26  -6.260 -11.774   7.097
  189   HD12  ILE  26          HD12      ILE  26  -6.357 -10.870   8.610
  190   HD13  ILE  26          HD13      ILE  26  -5.156 -10.429   7.393
  191    H    LEU  27           HN       LEU  27  -6.981  -6.549   4.574
  192    HA   LEU  27           HA       LEU  27  -7.584  -5.335   7.028
  193    HB2  LEU  27           HB2      LEU  27  -5.854  -4.110   6.282
  194    HB3  LEU  27           HB1      LEU  27  -6.085  -4.763   4.684
  195    HG   LEU  27           HG       LEU  27  -7.615  -2.854   4.151
  196   HD11  LEU  27          HD11      LEU  27  -6.743  -1.714   6.786
  197   HD12  LEU  27          HD12      LEU  27  -8.371  -2.262   6.303
  198   HD13  LEU  27          HD13      LEU  27  -7.626  -0.901   5.475
  199   HD21  LEU  27          HD21      LEU  27  -5.869  -1.207   3.915
  200   HD22  LEU  27          HD22      LEU  27  -5.279  -2.821   3.513
  201   HD23  LEU  27          HD23      LEU  27  -4.861  -2.086   5.063
  202    H    SER  28           HN       SER  28  -8.907  -5.060   3.848
  203    HA   SER  28           HA       SER  28 -10.738  -2.998   4.592
  204    HB2  SER  28           HB2      SER  28 -11.553  -3.123   2.350
  205    HB3  SER  28           HB1      SER  28  -9.799  -3.243   2.347
  206    HG   SER  28           HG       SER  28 -10.286  -4.916   1.100
  207    H    SER  29           HN       SER  29 -10.823  -6.435   4.430
  208    HA   SER  29           HA       SER  29 -12.263  -8.012   4.978
  209    HB2  SER  29           HB2      SER  29 -14.152  -5.800   5.879
  210    HB3  SER  29           HB1      SER  29 -14.348  -7.522   6.225
  211    HG   SER  29           HG       SER  29 -13.346  -6.162   7.874
  212    H    THR  30           HN       THR  30 -12.207  -6.337   2.454
  213    HA   THR  30           HA       THR  30 -12.769  -6.542   0.386
  214    HB   THR  30           HB       THR  30 -13.832  -8.487  -0.465
  215    HG1  THR  30           HG1      THR  30 -14.443  -8.973   2.263
  216   HG21  THR  30          HG21      THR  30 -11.883  -9.058   1.717
  217   HG22  THR  30          HG22      THR  30 -11.506  -8.652   0.023
  218   HG23  THR  30          HG23      THR  30 -12.322 -10.179   0.428
  219    H    ASN  31           HN       ASN  31 -15.566  -6.457   2.465
  220    HA   ASN  31           HA       ASN  31 -17.272  -6.370   0.052
  221    HB2  ASN  31           HB2      ASN  31 -17.459  -8.091   2.060
  222    HB3  ASN  31           HB1      ASN  31 -18.407  -6.786   2.769
  223   HD21  ASN  31          HD21      ASN  31 -18.150  -9.043   0.176
  224   HD22  ASN  31          HD22      ASN  31 -19.799  -8.932  -0.350
  225    H    VAL  32           HN       VAL  32 -15.743  -4.353   1.262
  226    HA   VAL  32           HA       VAL  32 -17.739  -2.477   2.272
  227    HB   VAL  32           HB       VAL  32 -15.851  -1.239   3.092
  228   HG11  VAL  32          HG11      VAL  32 -16.886  -2.889   4.528
  229   HG12  VAL  32          HG12      VAL  32 -15.154  -2.809   4.855
  230   HG13  VAL  32          HG13      VAL  32 -15.810  -4.131   3.892
  231   HG21  VAL  32          HG21      VAL  32 -13.573  -2.183   3.071
  232   HG22  VAL  32          HG22      VAL  32 -14.160  -1.830   1.443
  233   HG23  VAL  32          HG23      VAL  32 -14.148  -3.490   2.035
  234    H    GLY  33           HN       GLY  33 -16.614  -3.341  -0.541
  235    HA2  GLY  33           HA2      GLY  33 -16.844  -2.109  -2.558
  236    HA3  GLY  33           HA1      GLY  33 -16.625  -0.626  -1.628
  237    H    SER  34           HN       SER  34 -14.493  -3.182  -0.964
  238    HA   SER  34           HA       SER  34 -12.493  -2.173  -2.786
  239    HB2  SER  34           HB2      SER  34 -12.053  -2.360   0.204
  240    HB3  SER  34           HB1      SER  34 -10.837  -1.911  -0.993
  241    HG   SER  34           HG       SER  34 -12.776  -0.326  -1.492
  242    H    ASN  35           HN       ASN  35 -12.440  -4.056  -3.870
  243    HA   ASN  35           HA       ASN  35 -11.140  -6.266  -2.612
  244    HB2  ASN  35           HB2      ASN  35 -13.485  -6.867  -2.199
  245    HB3  ASN  35           HB1      ASN  35 -13.860  -6.590  -3.899
  246   HD21  ASN  35          HD21      ASN  35 -14.552  -8.695  -4.204
  247   HD22  ASN  35          HD22      ASN  35 -13.464 -10.025  -4.273
  248    H    THR  36           HN       THR  36  -9.526  -6.307  -3.955
  249    HA   THR  36           HA       THR  36  -9.964  -5.681  -6.753
  250    HB   THR  36           HB       THR  36  -7.270  -6.202  -5.487
  251    HG1  THR  36           HG1      THR  36  -7.376  -4.369  -4.447
  252   HG21  THR  36          HG21      THR  36  -6.594  -4.489  -7.085
  253   HG22  THR  36          HG22      THR  36  -8.292  -4.272  -7.538
  254   HG23  THR  36          HG23      THR  36  -7.475  -5.788  -7.913
  255    H    TYC  37           HN       ATY  37 -10.451  -8.310  -5.160
  256    HA   TYC  37           HA       ATY  37  -8.941 -10.141  -6.885
  257    HB1  TYC  37           HB1      ATY  37  -9.340 -11.846  -5.139
  258    HB2  TYC  37           HB2      ATY  37 -10.212 -10.652  -4.187
  259    HD1  TYC  37           HD1      ATY  37  -6.931 -11.862  -5.188
  260    HD2  TYC  37           HD2      ATY  37  -9.012  -8.765  -3.148
  261    HE1  TYC  37           HE1      ATY  37  -4.830 -11.134  -4.142
  262    HE2  TYC  37           HE2      ATY  37  -6.918  -8.036  -2.109
  263    HH   TYC  37           HH       ATY  37  -3.897  -9.171  -3.152
  264   HT21  TYC  37          HT21      ATY  37 -10.301 -10.192  -8.585
  265   HT22  TYC  37          HT22      ATY  37 -11.923 -10.797  -8.537
  Start of MODEL   16
    1    H1   LYS   1           HT1      LYS   1  11.225   4.955   9.280
    2    H2   LYS   1           HT2      LYS   1   9.717   5.248  10.005
    3    H3   LYS   1           HT3      LYS   1  10.808   6.514   9.711
    4    HA   LYS   1           HA       LYS   1   9.676   4.896   7.576
    5    HB2  LYS   1           HB2      LYS   1   8.228   6.827   7.082
    6    HB3  LYS   1           HB1      LYS   1   7.870   6.160   8.663
    7    HG2  LYS   1           HG2      LYS   1   9.160   7.975   9.704
    8    HG3  LYS   1           HG1      LYS   1   9.476   8.650   8.103
    9    HD2  LYS   1           HD2      LYS   1   7.060   8.916   7.755
   10    HD3  LYS   1           HD1      LYS   1   6.764   8.260   9.366
   11    HE2  LYS   1           HE2      LYS   1   8.060  10.118  10.326
   12    HE3  LYS   1           HE1      LYS   1   8.273  10.789   8.710
   13    HZ1  LYS   1           HZ1      LYS   1   5.682  10.429  10.131
   14    HZ2  LYS   1           HZ2      LYS   1   5.831  10.945   8.554
   15    HZ3  LYS   1           HZ3      LYS   1   6.443  11.896   9.789
   16    H    CYS   2           HN       CYS   2  10.087   5.933   5.503
   17    HA   CYS   2           HA       CYS   2  12.109   7.970   5.453
   18    HB2  CYS   2           HB2      CYS   2  13.480   6.562   3.852
   19    HB3  CYS   2           HB1      CYS   2  13.552   6.069   5.543
   20    H    ASN   3           HN       ASN   3  12.423   8.758   3.206
   21    HA   ASN   3           HA       ASN   3  10.006   8.360   1.587
   22    HB2  ASN   3           HB2      ASN   3   9.575  10.760   1.467
   23    HB3  ASN   3           HB1      ASN   3   9.507  10.193   3.131
   24   HD21  ASN   3          HD21      ASN   3  11.212  12.155   0.850
   25   HD22  ASN   3          HD22      ASN   3  12.226  12.972   1.973
   26    H    THR   4           HN       THR   4  13.047   8.000   1.394
   27    HA   THR   4           HA       THR   4  13.464   9.654  -0.962
   28    HB   THR   4           HB       THR   4  15.356   9.703   0.609
   29    HG1  THR   4           HG1      THR   4  16.564   9.748  -1.101
   30   HG21  THR   4          HG21      THR   4  14.993   7.505   1.673
   31   HG22  THR   4          HG22      THR   4  16.657   7.696   1.111
   32   HG23  THR   4          HG23      THR   4  15.516   6.724   0.180
   33    H    ALA   5           HN       ALA   5  14.377   8.682  -2.827
   34    HA   ALA   5           HA       ALA   5  12.738   6.613  -3.814
   35    HB1  ALA   5           HB1      ALA   5  15.260   7.752  -4.999
   36    HB2  ALA   5           HB2      ALA   5  13.641   8.417  -5.218
   37    HB3  ALA   5           HB3      ALA   5  14.039   6.824  -5.869
   38    H    THR   6           HN       THR   6  15.713   6.616  -2.210
   39    HA   THR   6           HA       THR   6  16.616   4.063  -3.099
   40    HB   THR   6           HB       THR   6  17.371   5.703  -0.685
   41    HG1  THR   6           HG1      THR   6  17.783   6.082  -3.331
   42   HG21  THR   6          HG21      THR   6  18.849   3.506  -2.143
   43   HG22  THR   6          HG22      THR   6  18.070   3.383  -0.569
   44   HG23  THR   6          HG23      THR   6  19.472   4.441  -0.769
   45    H    CYS   7           HN       CYS   7  14.282   5.145  -0.768
   46    HA   CYS   7           HA       CYS   7  14.621   2.685   0.861
   47    HB2  CYS   7           HB2      CYS   7  15.296   5.014   1.702
   48    HB3  CYS   7           HB1      CYS   7  13.632   5.269   1.794
   49    H    ALA   8           HN       ALA   8  12.357   5.320  -0.000
   50    HA   ALA   8           HA       ALA   8  10.105   4.177   1.198
   51    HB1  ALA   8           HB1      ALA   8  10.320   6.132  -1.082
   52    HB2  ALA   8           HB2      ALA   8  10.264   6.519   0.644
   53    HB3  ALA   8           HB3      ALA   8   8.856   5.797  -0.144
   54    H    THR   9           HN       THR   9  11.708   3.766  -1.745
   55    HA   THR   9           HA       THR   9   9.617   2.551  -3.269
   56    HB   THR   9           HB       THR   9  11.551   1.701  -4.619
   57    HG1  THR   9           HG1      THR   9  13.468   3.198  -3.837
   58   HG21  THR   9          HG21      THR   9  12.096   3.964  -5.457
   59   HG22  THR   9          HG22      THR   9  11.379   4.654  -4.003
   60   HG23  THR   9          HG23      THR   9  10.365   3.781  -5.156
   61    H    GLN  10           HN       GLN  10  11.936   1.498  -1.042
   62    HA   GLN  10           HA       GLN  10  11.677  -1.318  -1.523
   63    HB2  GLN  10           HB2      GLN  10  12.782  -0.001   0.958
   64    HB3  GLN  10           HB1      GLN  10  13.119  -1.639   0.386
   65    HG2  GLN  10           HG2      GLN  10  14.033   0.985  -0.753
   66    HG3  GLN  10           HG1      GLN  10  15.018  -0.287  -0.044
   67   HE21  GLN  10          HE21      GLN  10  15.040   1.052  -2.601
   68   HE22  GLN  10          HE22      GLN  10  15.027  -0.161  -3.823
   69    H    ARG  11           HN       ARG  11  10.434   1.075   0.657
   70    HA   ARG  11           HA       ARG  11   8.839  -0.653   2.307
   71    HB2  ARG  11           HB2      ARG  11   8.069   2.166   1.540
   72    HB3  ARG  11           HB1      ARG  11   7.662   1.307   3.011
   73    HG2  ARG  11           HG2      ARG  11  10.397   2.312   2.256
   74    HG3  ARG  11           HG1      ARG  11   9.302   3.072   3.406
   75    HD2  ARG  11           HD2      ARG  11  10.548   0.354   3.627
   76    HD3  ARG  11           HD1      ARG  11  11.031   1.819   4.490
   77    HE   ARG  11           HE       ARG  11   8.392   1.492   5.093
   78   HH11  ARG  11          HH11      ARG  11  11.318  -0.454   5.567
   79   HH12  ARG  11          HH12      ARG  11  10.726  -1.270   6.939
   80   HH21  ARG  11          HH21      ARG  11   7.585   0.368   6.973
   81   HH22  ARG  11          HH22      ARG  11   8.553  -0.801   7.750
   82    H    LEU  12           HN       LEU  12   8.287   1.075  -0.680
   83    HA   LEU  12           HA       LEU  12   5.663   0.337  -1.186
   84    HB2  LEU  12           HB2      LEU  12   8.046   0.951  -2.794
   85    HB3  LEU  12           HB1      LEU  12   6.618   0.600  -3.644
   86    HG   LEU  12           HG       LEU  12   7.190   2.944  -1.825
   87   HD11  LEU  12          HD11      LEU  12   7.956   3.138  -4.134
   88   HD12  LEU  12          HD12      LEU  12   6.642   4.257  -3.799
   89   HD13  LEU  12          HD13      LEU  12   6.327   2.780  -4.701
   90   HD21  LEU  12          HD21      LEU  12   4.889   3.716  -2.206
   91   HD22  LEU  12          HD22      LEU  12   4.933   2.228  -1.277
   92   HD23  LEU  12          HD23      LEU  12   4.507   2.183  -2.990
   93    H    ALA  13           HN       ALA  13   8.740  -1.208  -1.913
   94    HA   ALA  13           HA       ALA  13   7.638  -3.330  -3.338
   95    HB1  ALA  13           HB1      ALA  13   9.815  -4.410  -3.090
   96    HB2  ALA  13           HB2      ALA  13  10.256  -3.235  -1.851
   97    HB3  ALA  13           HB3      ALA  13   9.986  -2.706  -3.510
   98    H    ASN  14           HN       ASN  14   8.131  -2.732   0.008
   99    HA   ASN  14           HA       ASN  14   7.574  -5.412   0.956
  100    HB2  ASN  14           HB2      ASN  14   7.836  -2.778   2.390
  101    HB3  ASN  14           HB1      ASN  14   7.390  -4.276   3.191
  102   HD21  ASN  14          HD21      ASN  14   9.689  -4.273   0.612
  103   HD22  ASN  14          HD22      ASN  14  11.081  -4.551   1.583
  104    H    PHE  15           HN       PHE  15   5.634  -3.013  -0.339
  105    HA   PHE  15           HA       PHE  15   3.525  -3.275   1.599
  106    HB2  PHE  15           HB2      PHE  15   3.285  -1.101   1.006
  107    HB3  PHE  15           HB1      PHE  15   4.486  -1.311  -0.257
  108    HD1  PHE  15           HD1      PHE  15   0.939  -1.060   0.519
  109    HD2  PHE  15           HD2      PHE  15   3.766  -1.783  -2.566
  110    HE1  PHE  15           HE1      PHE  15  -0.802  -0.682  -1.173
  111    HE2  PHE  15           HE2      PHE  15   2.036  -1.409  -4.256
  112    HZ   PHE  15           HZ       PHE  15  -0.251  -0.856  -3.560
  113    H    LEU  16           HN       LEU  16   4.700  -4.515  -1.324
  114    HA   LEU  16           HA       LEU  16   2.215  -5.902  -1.676
  115    HB2  LEU  16           HB2      LEU  16   2.115  -5.351  -3.738
  116    HB3  LEU  16           HB1      LEU  16   2.916  -3.955  -3.186
  117    HG   LEU  16           HG       LEU  16   4.458  -6.178  -4.548
  118   HD11  LEU  16          HD11      LEU  16   3.368  -3.631  -5.720
  119   HD12  LEU  16          HD12      LEU  16   2.832  -5.270  -6.104
  120   HD13  LEU  16          HD13      LEU  16   4.464  -4.750  -6.530
  121   HD21  LEU  16          HD21      LEU  16   6.136  -4.436  -4.838
  122   HD22  LEU  16          HD22      LEU  16   5.772  -4.702  -3.135
  123   HD23  LEU  16          HD23      LEU  16   5.108  -3.300  -3.970
  124    H    VAL  17           HN       VAL  17   4.897  -6.470  -0.356
  125    HA   VAL  17           HA       VAL  17   6.338  -8.144  -2.124
  126    HB   VAL  17           HB       VAL  17   7.419  -6.879  -0.328
  127   HG11  VAL  17          HG11      VAL  17   6.253  -8.867   1.609
  128   HG12  VAL  17          HG12      VAL  17   5.860  -7.174   1.488
  129   HG13  VAL  17          HG13      VAL  17   7.486  -7.659   1.998
  130   HG21  VAL  17          HG21      VAL  17   8.973  -8.723   0.439
  131   HG22  VAL  17          HG22      VAL  17   8.745  -8.496  -1.291
  132   HG23  VAL  17          HG23      VAL  17   7.928  -9.827  -0.481
  133    H    HIS  18           HN       HIS  18   4.581  -9.003   0.793
  134    HA   HIS  18           HA       HIS  18   3.919 -11.557  -0.510
  135    HB2  HIS  18           HB2      HIS  18   4.666 -11.106   2.386
  136    HB3  HIS  18           HB1      HIS  18   3.848 -12.559   1.837
  137    HD1  HIS  18           HD1      HIS  18   5.385 -14.419   1.336
  138    HD2  HIS  18           HD2      HIS  18   7.081 -10.711   0.894
  139    HE1  HIS  18           HE1      HIS  18   7.799 -14.903   0.788
  140    HE2  HIS  18           HE2      HIS  18   8.671 -12.633   0.116
  141    H    SER  19           HN       SER  19   2.850  -8.747   0.242
  142    HA   SER  19           HA       SER  19   0.580  -9.197   1.796
  143    HB2  SER  19           HB2      SER  19   1.191  -6.993  -0.159
  144    HB3  SER  19           HB1      SER  19   0.012  -6.946   1.152
  145    HG   SER  19           HG       SER  19   1.573  -6.224   2.270
  146    H    SER  20           HN       SER  20   1.458  -9.985  -1.344
  147    HA   SER  20           HA       SER  20  -0.654  -9.417  -3.058
  148    HB2  SER  20           HB2      SER  20   1.216 -11.756  -3.094
  149    HB3  SER  20           HB1      SER  20   0.433 -11.003  -4.495
  150    HG   SER  20           HG       SER  20   2.666 -10.349  -4.022
  151    H    ASN  21           HN       ASN  21  -0.578 -11.492  -0.547
  152    HA   ASN  21           HA       ASN  21  -2.402 -13.502  -1.623
  153    HB2  ASN  21           HB2      ASN  21  -0.743 -13.275   0.799
  154    HB3  ASN  21           HB1      ASN  21  -2.179 -14.316   0.900
  155   HD21  ASN  21          HD21      ASN  21   0.743 -14.803   0.937
  156   HD22  ASN  21          HD22      ASN  21   1.025 -16.004  -0.263
  157    H    ASN  22           HN       ASN  22  -2.528 -10.586  -0.016
  158    HA   ASN  22           HA       ASN  22  -5.366 -11.049   0.493
  159    HB2  ASN  22           HB2      ASN  22  -3.296  -9.686   2.033
  160    HB3  ASN  22           HB1      ASN  22  -4.733  -8.707   1.867
  161   HD21  ASN  22          HD21      ASN  22  -4.670 -12.235   1.941
  162   HD22  ASN  22          HD22      ASN  22  -5.433 -12.412   3.467
  163    H    PHE  23           HN       PHE  23  -2.911  -8.973  -0.556
  164    HA   PHE  23           HA       PHE  23  -4.313  -6.961  -1.742
  165    HB2  PHE  23           HB2      PHE  23  -1.758  -8.095  -1.669
  166    HB3  PHE  23           HB1      PHE  23  -1.875  -7.201  -3.125
  167    HD1  PHE  23           HD1      PHE  23  -1.724  -4.747  -2.892
  168    HD2  PHE  23           HD2      PHE  23  -2.354  -7.184   0.520
  169    HE1  PHE  23           HE1      PHE  23  -1.413  -2.795  -1.438
  170    HE2  PHE  23           HE2      PHE  23  -2.042  -5.306   1.977
  171    HZ   PHE  23           HZ       PHE  23  -1.566  -3.048   1.015
  172    H    GLY  24           HN       GLY  24  -5.838  -7.559  -2.731
  173    HA2  GLY  24           HA2      GLY  24  -7.085  -7.772  -4.571
  174    HA3  GLY  24           HA1      GLY  24  -5.722  -8.199  -5.557
  175    H    ALA  25           HN       ALA  25  -6.536  -9.751  -2.595
  176    HA   ALA  25           HA       ALA  25  -7.735 -11.979  -4.022
  177    HB1  ALA  25           HB1      ALA  25  -6.546 -11.723  -1.257
  178    HB2  ALA  25           HB2      ALA  25  -5.798 -12.543  -2.621
  179    HB3  ALA  25           HB3      ALA  25  -7.272 -13.203  -1.895
  180    H    ILE  26           HN       ILE  26  -7.804 -10.240  -1.049
  181    HA   ILE  26           HA       ILE  26 -10.604 -10.423  -0.926
  182    HB   ILE  26           HB       ILE  26  -9.481 -10.762   1.142
  183   HG12  ILE  26          HG12      ILE  26 -10.362  -7.981   1.127
  184   HG13  ILE  26          HG11      ILE  26 -11.534  -9.292   1.189
  185   HG21  ILE  26          HG21      ILE  26  -7.975  -9.005   2.132
  186   HG22  ILE  26          HG22      ILE  26  -8.059  -8.191   0.547
  187   HG23  ILE  26          HG23      ILE  26  -7.351  -9.783   0.672
  188   HD11  ILE  26          HD11      ILE  26 -10.460  -9.993   3.375
  189   HD12  ILE  26          HD12      ILE  26 -11.238  -8.414   3.443
  190   HD13  ILE  26          HD13      ILE  26  -9.486  -8.525   3.294
  191    H    LEU  27           HN       LEU  27  -8.069  -8.129  -1.683
  192    HA   LEU  27           HA       LEU  27  -9.607  -5.784  -1.468
  193    HB2  LEU  27           HB2      LEU  27  -7.492  -4.974  -1.576
  194    HB3  LEU  27           HB1      LEU  27  -6.984  -6.551  -2.108
  195    HG   LEU  27           HG       LEU  27  -7.162  -5.856  -4.467
  196   HD11  LEU  27          HD11      LEU  27  -7.922  -3.154  -3.420
  197   HD12  LEU  27          HD12      LEU  27  -8.896  -4.300  -4.387
  198   HD13  LEU  27          HD13      LEU  27  -7.438  -3.594  -5.073
  199   HD21  LEU  27          HD21      LEU  27  -5.051  -5.587  -3.328
  200   HD22  LEU  27          HD22      LEU  27  -5.534  -3.985  -2.770
  201   HD23  LEU  27          HD23      LEU  27  -5.301  -4.286  -4.492
  202    H    SER  28           HN       SER  28  -8.772  -7.865  -4.034
  203    HA   SER  28           HA       SER  28 -10.326  -6.351  -5.886
  204    HB2  SER  28           HB2      SER  28  -8.952  -8.990  -6.179
  205    HB3  SER  28           HB1      SER  28  -9.758  -8.163  -7.526
  206    HG   SER  28           HG       SER  28  -8.297  -6.447  -7.228
  207    H    SER  29           HN       SER  29 -10.780  -8.713  -3.693
  208    HA   SER  29           HA       SER  29 -12.522  -9.778  -2.790
  209    HB2  SER  29           HB2      SER  29 -14.144  -8.160  -4.727
  210    HB3  SER  29           HB1      SER  29 -14.788  -8.988  -3.306
  211    HG   SER  29           HG       SER  29 -12.799  -7.581  -2.387
  212    H    THR  30           HN       THR  30 -11.176 -10.773  -5.223
  213    HA   THR  30           HA       THR  30 -13.171 -12.435  -6.458
  214    HB   THR  30           HB       THR  30 -11.234 -11.624  -7.761
  215    HG1  THR  30           HG1      THR  30 -11.203 -13.393  -8.906
  216   HG21  THR  30          HG21      THR  30  -9.568 -13.398  -5.958
  217   HG22  THR  30          HG22      THR  30  -9.511 -11.640  -6.021
  218   HG23  THR  30          HG23      THR  30  -8.978 -12.588  -7.409
  219    H    ASN  31           HN       ASN  31 -11.183 -12.449  -3.705
  220    HA   ASN  31           HA       ASN  31 -11.854 -15.229  -3.212
  221    HB2  ASN  31           HB2      ASN  31  -9.453 -15.110  -3.783
  222    HB3  ASN  31           HB1      ASN  31  -9.224 -13.868  -2.560
  223   HD21  ASN  31          HD21      ASN  31  -9.116 -14.462  -0.441
  224   HD22  ASN  31          HD22      ASN  31  -8.946 -16.096   0.085
  225    H    VAL  32           HN       VAL  32 -13.606 -14.372  -2.305
  226    HA   VAL  32           HA       VAL  32 -13.300 -13.743   0.529
  227    HB   VAL  32           HB       VAL  32 -15.246 -12.240  -1.285
  228   HG11  VAL  32          HG11      VAL  32 -16.206 -12.661   0.892
  229   HG12  VAL  32          HG12      VAL  32 -15.820 -10.948   0.739
  230   HG13  VAL  32          HG13      VAL  32 -14.773 -12.010   1.681
  231   HG21  VAL  32          HG21      VAL  32 -12.874 -11.134   0.224
  232   HG22  VAL  32          HG22      VAL  32 -14.016 -10.197  -0.745
  233   HG23  VAL  32          HG23      VAL  32 -12.959 -11.382  -1.518
  234    H    GLY  33           HN       GLY  33 -15.457 -14.381  -2.185
  235    HA2  GLY  33           HA2      GLY  33 -16.459 -16.605  -2.292
  236    HA3  GLY  33           HA1      GLY  33 -16.771 -16.454  -0.568
  237    H    SER  34           HN       SER  34 -17.239 -13.555  -2.239
  238    HA   SER  34           HA       SER  34 -20.104 -14.175  -2.379
  239    HB2  SER  34           HB2      SER  34 -19.604 -12.943  -0.283
  240    HB3  SER  34           HB1      SER  34 -18.993 -11.597  -1.236
  241    HG   SER  34           HG       SER  34 -21.316 -11.896  -2.239
  242    H    ASN  35           HN       ASN  35 -17.705 -11.708  -3.401
  243    HA   ASN  35           HA       ASN  35 -19.328 -10.600  -5.440
  244    HB2  ASN  35           HB2      ASN  35 -17.347  -9.462  -4.428
  245    HB3  ASN  35           HB1      ASN  35 -16.296 -10.627  -5.210
  246   HD21  ASN  35          HD21      ASN  35 -16.439  -7.713  -5.353
  247   HD22  ASN  35          HD22      ASN  35 -16.600  -7.308  -7.014
  248    H    THR  36           HN       THR  36 -17.132 -13.258  -5.367
  249    HA   THR  36           HA       THR  36 -17.621 -13.758  -8.189
  250    HB   THR  36           HB       THR  36 -15.724 -15.414  -7.906
  251    HG1  THR  36           HG1      THR  36 -14.610 -15.404  -6.107
  252   HG21  THR  36          HG21      THR  36 -15.428 -13.227  -8.974
  253   HG22  THR  36          HG22      THR  36 -14.001 -13.668  -8.040
  254   HG23  THR  36          HG23      THR  36 -15.153 -12.491  -7.397
  255    H    TYC  37           HN       ATY  37 -19.222 -14.361  -5.618
  256    HA   TYC  37           HA       ATY  37 -20.578 -15.896  -4.751
  257    HB1  TYC  37           HB1      ATY  37 -21.883 -17.121  -6.365
  258    HB2  TYC  37           HB2      ATY  37 -20.687 -16.816  -7.629
  259    HD1  TYC  37           HD1      ATY  37 -20.497 -14.589  -8.631
  260    HD2  TYC  37           HD2      ATY  37 -23.378 -15.389  -5.616
  261    HE1  TYC  37           HE1      ATY  37 -21.635 -12.480  -9.169
  262    HE2  TYC  37           HE2      ATY  37 -24.521 -13.289  -6.139
  263    HH   TYC  37           HH       ATY  37 -23.775 -11.453  -8.932
  264   HT21  TYC  37          HT21      ATY  37 -19.054 -16.962  -3.448
  265   HT22  TYC  37          HT22      ATY  37 -18.543 -18.571  -3.811
  Start of MODEL   17
    1    H1   LYS   1           HT1      LYS   1  10.530   5.290  10.134
    2    H2   LYS   1           HT2      LYS   1  11.472   6.685   9.863
    3    H3   LYS   1           HT3      LYS   1  11.973   5.205   9.264
    4    HA   LYS   1           HA       LYS   1  10.263   5.081   7.737
    5    HB2  LYS   1           HB2      LYS   1   9.393   7.781   8.816
    6    HB3  LYS   1           HB1      LYS   1   8.751   7.001   7.384
    7    HG2  LYS   1           HG2      LYS   1   7.898   5.162   8.759
    8    HG3  LYS   1           HG1      LYS   1   8.545   5.953  10.197
    9    HD2  LYS   1           HD2      LYS   1   6.175   6.403  10.015
   10    HD3  LYS   1           HD1      LYS   1   7.089   7.887   9.755
   11    HE2  LYS   1           HE2      LYS   1   6.808   7.642   7.341
   12    HE3  LYS   1           HE1      LYS   1   5.920   6.140   7.588
   13    HZ1  LYS   1           HZ1      LYS   1   4.209   7.380   8.742
   14    HZ2  LYS   1           HZ2      LYS   1   4.457   8.046   7.218
   15    HZ3  LYS   1           HZ3      LYS   1   5.091   8.802   8.580
   16    H    CYS   2           HN       CYS   2  10.603   5.939   5.669
   17    HA   CYS   2           HA       CYS   2  12.651   7.983   5.508
   18    HB2  CYS   2           HB2      CYS   2  13.681   6.536   3.677
   19    HB3  CYS   2           HB1      CYS   2  13.954   6.039   5.348
   20    H    ASN   3           HN       ASN   3  12.890   8.795   3.234
   21    HA   ASN   3           HA       ASN   3  10.271   8.798   1.867
   22    HB2  ASN   3           HB2      ASN   3  10.190  11.217   1.855
   23    HB3  ASN   3           HB1      ASN   3  10.356  10.660   3.515
   24   HD21  ASN   3          HD21      ASN   3  11.815  12.401   0.934
   25   HD22  ASN   3          HD22      ASN   3  13.169  13.015   1.798
   26    H    THR   4           HN       THR   4  13.286   8.055   1.387
   27    HA   THR   4           HA       THR   4  13.681   9.702  -0.992
   28    HB   THR   4           HB       THR   4  15.634   9.644   0.493
   29    HG1  THR   4           HG1      THR   4  16.936   9.539  -1.108
   30   HG21  THR   4          HG21      THR   4  16.877   7.568   0.901
   31   HG22  THR   4          HG22      THR   4  15.625   6.659   0.055
   32   HG23  THR   4          HG23      THR   4  15.247   7.471   1.571
   33    H    ALA   5           HN       ALA   5  14.432   8.668  -2.893
   34    HA   ALA   5           HA       ALA   5  12.688   6.667  -3.834
   35    HB1  ALA   5           HB1      ALA   5  13.607   8.395  -5.297
   36    HB2  ALA   5           HB2      ALA   5  13.983   6.788  -5.921
   37    HB3  ALA   5           HB3      ALA   5  15.221   7.723  -5.085
   38    H    THR   6           HN       THR   6  15.711   6.519  -2.321
   39    HA   THR   6           HA       THR   6  16.427   3.899  -3.222
   40    HB   THR   6           HB       THR   6  17.426   5.547  -0.888
   41    HG1  THR   6           HG1      THR   6  18.404   5.242  -3.535
   42   HG21  THR   6          HG21      THR   6  18.672   3.182  -2.308
   43   HG22  THR   6          HG22      THR   6  18.006   3.196  -0.672
   44   HG23  THR   6          HG23      THR   6  19.448   4.147  -1.043
   45    H    CYS   7           HN       CYS   7  14.174   5.100  -0.914
   46    HA   CYS   7           HA       CYS   7  14.440   2.638   0.724
   47    HB2  CYS   7           HB2      CYS   7  15.343   4.865   1.557
   48    HB3  CYS   7           HB1      CYS   7  13.708   5.271   1.747
   49    H    ALA   8           HN       ALA   8  12.293   5.381  -0.124
   50    HA   ALA   8           HA       ALA   8  10.055   4.336   1.201
   51    HB1  ALA   8           HB1      ALA   8  10.308   6.291  -1.061
   52    HB2  ALA   8           HB2      ALA   8  10.251   6.662   0.672
   53    HB3  ALA   8           HB3      ALA   8   8.824   6.001  -0.139
   54    H    THR   9           HN       THR   9  11.579   3.807  -1.759
   55    HA   THR   9           HA       THR   9   9.467   2.581  -3.239
   56    HB   THR   9           HB       THR   9  11.454   1.599  -4.499
   57    HG1  THR   9           HG1      THR   9  13.329   3.150  -3.823
   58   HG21  THR   9          HG21      THR   9  10.244   3.632  -5.221
   59   HG22  THR   9          HG22      THR   9  11.977   3.776  -5.531
   60   HG23  THR   9          HG23      THR   9  11.260   4.599  -4.146
   61    H    GLN  10           HN       GLN  10  11.719   1.586  -0.930
   62    HA   GLN  10           HA       GLN  10  11.430  -1.251  -1.302
   63    HB2  GLN  10           HB2      GLN  10  12.578   0.118   1.132
   64    HB3  GLN  10           HB1      GLN  10  12.850  -1.546   0.617
   65    HG2  GLN  10           HG2      GLN  10  13.843   0.977  -0.668
   66    HG3  GLN  10           HG1      GLN  10  14.791  -0.281   0.112
   67   HE21  GLN  10          HE21      GLN  10  14.769   0.906  -2.545
   68   HE22  GLN  10          HE22      GLN  10  14.738  -0.405  -3.671
   69    H    ARG  11           HN       ARG  11  10.087   1.232   0.630
   70    HA   ARG  11           HA       ARG  11   8.528  -0.490   2.343
   71    HB2  ARG  11           HB2      ARG  11   7.766   2.309   1.513
   72    HB3  ARG  11           HB1      ARG  11   7.259   1.440   2.949
   73    HG2  ARG  11           HG2      ARG  11   9.992   2.565   2.370
   74    HG3  ARG  11           HG1      ARG  11   8.857   3.130   3.590
   75    HD2  ARG  11           HD2      ARG  11  10.399   0.550   3.507
   76    HD3  ARG  11           HD1      ARG  11  10.558   1.875   4.661
   77    HE   ARG  11           HE       ARG  11   7.989   1.091   4.967
   78   HH11  ARG  11          HH11      ARG  11  11.096  -0.612   5.276
   79   HH12  ARG  11          HH12      ARG  11  10.478  -1.854   6.256
   80   HH21  ARG  11          HH21      ARG  11   7.147  -0.661   6.326
   81   HH22  ARG  11          HH22      ARG  11   8.206  -1.865   6.880
   82    H    LEU  12           HN       LEU  12   8.048   1.101  -0.729
   83    HA   LEU  12           HA       LEU  12   5.485   0.215  -1.304
   84    HB2  LEU  12           HB2      LEU  12   7.917   0.835  -2.856
   85    HB3  LEU  12           HB1      LEU  12   6.514   0.439  -3.727
   86    HG   LEU  12           HG       LEU  12   7.050   2.866  -2.013
   87   HD11  LEU  12          HD11      LEU  12   6.490   4.090  -4.041
   88   HD12  LEU  12          HD12      LEU  12   6.176   2.573  -4.877
   89   HD13  LEU  12          HD13      LEU  12   7.807   2.953  -4.331
   90   HD21  LEU  12          HD21      LEU  12   4.370   2.031  -3.129
   91   HD22  LEU  12          HD22      LEU  12   4.736   3.607  -2.437
   92   HD23  LEU  12          HD23      LEU  12   4.791   2.172  -1.419
   93    H    ALA  13           HN       ALA  13   8.678  -1.215  -1.711
   94    HA   ALA  13           HA       ALA  13   7.894  -3.487  -3.096
   95    HB1  ALA  13           HB1      ALA  13  10.259  -3.244  -1.241
   96    HB2  ALA  13           HB2      ALA  13  10.233  -2.718  -2.918
   97    HB3  ALA  13           HB3      ALA  13  10.062  -4.432  -2.534
   98    H    ASN  14           HN       ASN  14   7.983  -2.728   0.299
   99    HA   ASN  14           HA       ASN  14   7.375  -5.423   1.152
  100    HB2  ASN  14           HB2      ASN  14   7.422  -2.833   2.674
  101    HB3  ASN  14           HB1      ASN  14   6.893  -4.363   3.387
  102   HD21  ASN  14          HD21      ASN  14   9.536  -3.917   1.160
  103   HD22  ASN  14          HD22      ASN  14  10.796  -4.375   2.244
  104    H    PHE  15           HN       PHE  15   5.558  -3.069  -0.316
  105    HA   PHE  15           HA       PHE  15   3.198  -3.465   1.262
  106    HB2  PHE  15           HB2      PHE  15   3.135  -1.270   0.656
  107    HB3  PHE  15           HB1      PHE  15   4.280  -1.533  -0.652
  108    HD1  PHE  15           HD1      PHE  15   0.731  -1.462   0.313
  109    HD2  PHE  15           HD2      PHE  15   3.511  -1.911  -2.870
  110    HE1  PHE  15           HE1      PHE  15  -1.090  -1.194  -1.317
  111    HE2  PHE  15           HE2      PHE  15   1.743  -1.662  -4.494
  112    HZ   PHE  15           HZ       PHE  15  -0.597  -1.286  -3.731
  113    H    LEU  16           HN       LEU  16   4.876  -4.667  -1.444
  114    HA   LEU  16           HA       LEU  16   2.550  -6.184  -2.170
  115    HB2  LEU  16           HB2      LEU  16   2.559  -5.382  -4.151
  116    HB3  LEU  16           HB1      LEU  16   3.410  -4.093  -3.474
  117    HG   LEU  16           HG       LEU  16   4.952  -6.284  -4.871
  118   HD11  LEU  16          HD11      LEU  16   3.413  -5.260  -6.466
  119   HD12  LEU  16          HD12      LEU  16   5.080  -4.778  -6.788
  120   HD13  LEU  16          HD13      LEU  16   3.978  -3.659  -5.984
  121   HD21  LEU  16          HD21      LEU  16   6.195  -4.868  -3.315
  122   HD22  LEU  16          HD22      LEU  16   5.588  -3.439  -4.160
  123   HD23  LEU  16          HD23      LEU  16   6.674  -4.559  -4.991
  124    H    VAL  17           HN       VAL  17   4.895  -6.713  -0.504
  125    HA   VAL  17           HA       VAL  17   6.610  -8.377  -2.079
  126    HB   VAL  17           HB       VAL  17   7.554  -7.022  -0.289
  127   HG11  VAL  17          HG11      VAL  17   6.215  -8.782   1.731
  128   HG12  VAL  17          HG12      VAL  17   5.722  -7.161   1.318
  129   HG13  VAL  17          HG13      VAL  17   7.312  -7.437   2.041
  130   HG21  VAL  17          HG21      VAL  17   8.935  -8.736   0.829
  131   HG22  VAL  17          HG22      VAL  17   8.875  -8.818  -0.931
  132   HG23  VAL  17          HG23      VAL  17   7.942  -9.970   0.035
  133    H    HIS  18           HN       HIS  18   4.729  -9.220   0.770
  134    HA   HIS  18           HA       HIS  18   4.107 -11.793  -0.562
  135    HB2  HIS  18           HB2      HIS  18   4.257 -11.269   2.433
  136    HB3  HIS  18           HB1      HIS  18   3.738 -12.773   1.698
  137    HD1  HIS  18           HD1      HIS  18   5.536 -14.491   1.531
  138    HD2  HIS  18           HD2      HIS  18   6.944 -10.625   1.624
  139    HE1  HIS  18           HE1      HIS  18   8.020 -14.731   1.637
  140    HE2  HIS  18           HE2      HIS  18   8.886 -12.382   1.456
  141    H    SER  19           HN       SER  19   3.043  -8.854   0.531
  142    HA   SER  19           HA       SER  19   0.521  -9.169   1.532
  143    HB2  SER  19           HB2      SER  19   1.560  -7.020  -0.272
  144    HB3  SER  19           HB1      SER  19   0.300  -6.875   0.949
  145    HG   SER  19           HG       SER  19   1.849  -6.289   2.166
  146    H    SER  20           HN       SER  20   1.726  -9.774  -1.468
  147    HA   SER  20           HA       SER  20  -0.129  -8.972  -3.373
  148    HB2  SER  20           HB2      SER  20   1.537 -11.459  -3.508
  149    HB3  SER  20           HB1      SER  20   1.065 -10.378  -4.826
  150    HG   SER  20           HG       SER  20   2.906  -9.449  -4.417
  151    H    ASN  21           HN       ASN  21  -0.508 -11.325  -1.042
  152    HA   ASN  21           HA       ASN  21  -2.525 -12.792  -2.585
  153    HB2  ASN  21           HB2      ASN  21  -0.736 -13.461  -0.346
  154    HB3  ASN  21           HB1      ASN  21  -2.118 -14.535  -0.719
  155   HD21  ASN  21          HD21      ASN  21   1.096 -13.593  -1.393
  156   HD22  ASN  21          HD22      ASN  21   1.359 -14.610  -2.757
  157    H    ASN  22           HN       ASN  22  -2.365 -10.290  -0.330
  158    HA   ASN  22           HA       ASN  22  -4.785 -11.157   1.015
  159    HB2  ASN  22           HB2      ASN  22  -2.178 -10.770   2.096
  160    HB3  ASN  22           HB1      ASN  22  -3.414  -9.719   2.799
  161   HD21  ASN  22          HD21      ASN  22  -4.073 -12.789   1.381
  162   HD22  ASN  22          HD22      ASN  22  -4.475 -13.620   2.801
  163    H    PHE  23           HN       PHE  23  -2.602  -8.648   0.245
  164    HA   PHE  23           HA       PHE  23  -3.803  -6.537   1.436
  165    HB2  PHE  23           HB2      PHE  23  -2.245  -5.195   0.257
  166    HB3  PHE  23           HB1      PHE  23  -1.592  -6.803   0.416
  167    HD1  PHE  23           HD1      PHE  23  -2.691  -8.260  -1.589
  168    HD2  PHE  23           HD2      PHE  23  -1.321  -4.312  -1.684
  169    HE1  PHE  23           HE1      PHE  23  -2.157  -8.558  -3.950
  170    HE2  PHE  23           HE2      PHE  23  -0.766  -4.509  -4.064
  171    HZ   PHE  23           HZ       PHE  23  -1.194  -6.640  -5.246
  172    H    GLY  24           HN       GLY  24  -5.721  -6.252   1.359
  173    HA2  GLY  24           HA2      GLY  24  -7.885  -5.795   0.758
  174    HA3  GLY  24           HA1      GLY  24  -7.282  -5.003  -0.677
  175    H    ALA  25           HN       ALA  25  -6.546  -8.286  -0.161
  176    HA   ALA  25           HA       ALA  25  -8.140  -9.097  -2.409
  177    HB1  ALA  25           HB1      ALA  25  -5.850  -9.877  -2.203
  178    HB2  ALA  25           HB2      ALA  25  -6.956 -11.253  -1.970
  179    HB3  ALA  25           HB3      ALA  25  -6.197 -10.470  -0.583
  180    H    ILE  26           HN       ILE  26  -7.650  -9.382   0.945
  181    HA   ILE  26           HA       ILE  26 -10.011 -10.876   1.142
  182    HB   ILE  26           HB       ILE  26  -8.317 -12.096   2.159
  183   HG12  ILE  26          HG12      ILE  26  -9.530 -10.510   4.318
  184   HG13  ILE  26          HG11      ILE  26 -10.366 -11.863   3.551
  185   HG21  ILE  26          HG21      ILE  26  -6.575 -10.437   2.225
  186   HG22  ILE  26          HG22      ILE  26  -6.722 -11.171   3.822
  187   HG23  ILE  26          HG23      ILE  26  -7.410  -9.574   3.509
  188   HD11  ILE  26          HD11      ILE  26  -8.571 -13.368   4.409
  189   HD12  ILE  26          HD12      ILE  26  -9.466 -12.567   5.704
  190   HD13  ILE  26          HD13      ILE  26  -7.866 -11.986   5.247
  191    H    LEU  27           HN       LEU  27  -8.346  -7.965   2.538
  192    HA   LEU  27           HA       LEU  27 -10.388  -7.549   4.409
  193    HB2  LEU  27           HB2      LEU  27  -9.163  -5.620   4.997
  194    HB3  LEU  27           HB1      LEU  27  -8.168  -7.043   4.909
  195    HG   LEU  27           HG       LEU  27  -7.483  -6.060   2.591
  196   HD11  LEU  27          HD11      LEU  27  -8.377  -3.558   4.024
  197   HD12  LEU  27          HD12      LEU  27  -9.109  -4.232   2.570
  198   HD13  LEU  27          HD13      LEU  27  -7.461  -3.614   2.516
  199   HD21  LEU  27          HD21      LEU  27  -5.965  -6.380   4.436
  200   HD22  LEU  27          HD22      LEU  27  -6.546  -4.882   5.180
  201   HD23  LEU  27          HD23      LEU  27  -5.670  -4.826   3.647
  202    H    SER  28           HN       SER  28  -9.793  -6.460   1.183
  203    HA   SER  28           HA       SER  28 -11.294  -4.330   1.774
  204    HB2  SER  28           HB2      SER  28 -10.342  -5.280  -0.904
  205    HB3  SER  28           HB1      SER  28 -11.325  -3.825  -0.753
  206    HG   SER  28           HG       SER  28  -9.777  -3.017   0.682
  207    H    SER  29           HN       SER  29 -11.876  -7.442   0.865
  208    HA   SER  29           HA       SER  29 -13.549  -8.827   0.567
  209    HB2  SER  29           HB2      SER  29 -15.308  -6.503   1.261
  210    HB3  SER  29           HB1      SER  29 -15.849  -8.187   1.215
  211    HG   SER  29           HG       SER  29 -14.481  -6.850   3.126
  212    H    THR  30           HN       THR  30 -13.774  -5.991  -1.316
  213    HA   THR  30           HA       THR  30 -15.518  -6.846  -3.307
  214    HB   THR  30           HB       THR  30 -14.815  -4.563  -3.389
  215    HG1  THR  30           HG1      THR  30 -15.025  -5.665  -5.503
  216   HG21  THR  30          HG21      THR  30 -12.656  -4.819  -2.283
  217   HG22  THR  30          HG22      THR  30 -12.486  -3.847  -3.752
  218   HG23  THR  30          HG23      THR  30 -11.978  -5.541  -3.737
  219    H    ASN  31           HN       ASN  31 -12.126  -7.535  -2.841
  220    HA   ASN  31           HA       ASN  31 -11.845  -9.015  -5.283
  221    HB2  ASN  31           HB2      ASN  31 -10.042  -8.582  -2.928
  222    HB3  ASN  31           HB1      ASN  31  -9.589  -9.621  -4.275
  223   HD21  ASN  31          HD21      ASN  31  -9.035  -8.693  -6.199
  224   HD22  ASN  31          HD22      ASN  31  -8.786  -7.000  -6.403
  225    H    VAL  32           HN       VAL  32 -13.397  -9.759  -2.515
  226    HA   VAL  32           HA       VAL  32 -12.687 -12.601  -2.625
  227    HB   VAL  32           HB       VAL  32 -14.680 -11.274  -0.742
  228   HG11  VAL  32          HG11      VAL  32 -14.233 -13.204   0.707
  229   HG12  VAL  32          HG12      VAL  32 -13.167 -13.869  -0.530
  230   HG13  VAL  32          HG13      VAL  32 -14.889 -13.676  -0.862
  231   HG21  VAL  32          HG21      VAL  32 -11.767 -11.786  -0.193
  232   HG22  VAL  32          HG22      VAL  32 -12.949 -11.139   0.953
  233   HG23  VAL  32          HG23      VAL  32 -12.494 -10.213  -0.487
  234    H    GLY  33           HN       GLY  33 -14.533 -10.456  -4.186
  235    HA2  GLY  33           HA2      GLY  33 -16.090 -10.907  -5.838
  236    HA3  GLY  33           HA1      GLY  33 -16.345 -12.498  -5.130
  237    H    SER  34           HN       SER  34 -16.454  -9.782  -2.980
  238    HA   SER  34           HA       SER  34 -19.286 -10.261  -2.597
  239    HB2  SER  34           HB2      SER  34 -17.637 -10.151  -0.682
  240    HB3  SER  34           HB1      SER  34 -17.366  -8.463  -1.077
  241    HG   SER  34           HG       SER  34 -19.284  -9.601   0.382
  242    H    ASN  35           HN       ASN  35 -17.226  -8.309  -4.309
  243    HA   ASN  35           HA       ASN  35 -19.353  -6.594  -5.216
  244    HB2  ASN  35           HB2      ASN  35 -18.174  -5.335  -3.387
  245    HB3  ASN  35           HB1      ASN  35 -16.693  -5.504  -4.300
  246   HD21  ASN  35          HD21      ASN  35 -19.775  -3.884  -4.254
  247   HD22  ASN  35          HD22      ASN  35 -19.401  -2.733  -5.470
  248    H    THR  36           HN       THR  36 -19.256  -7.273  -7.276
  249    HA   THR  36           HA       THR  36 -16.604  -7.830  -8.380
  250    HB   THR  36           HB       THR  36 -19.228  -8.706  -9.617
  251    HG1  THR  36           HG1      THR  36 -18.822  -9.222  -7.239
  252   HG21  THR  36          HG21      THR  36 -16.463  -9.943  -9.503
  253   HG22  THR  36          HG22      THR  36 -17.102  -9.035 -10.872
  254   HG23  THR  36          HG23      THR  36 -17.838 -10.572 -10.409
  255    H    TYC  37           HN       ATY  37 -18.099  -5.212  -8.087
  256    HA   TYC  37           HA       ATY  37 -18.669  -4.415 -10.799
  257    HB1  TYC  37           HB1      ATY  37 -19.047  -2.160  -9.773
  258    HB2  TYC  37           HB2      ATY  37 -18.642  -2.853  -8.210
  259    HD1  TYC  37           HD1      ATY  37 -20.340  -3.756  -6.880
  260    HD2  TYC  37           HD2      ATY  37 -20.980  -3.307 -11.053
  261    HE1  TYC  37           HE1      ATY  37 -22.691  -4.437  -6.595
  262    HE2  TYC  37           HE2      ATY  37 -23.319  -3.983 -10.770
  263    HH   TYC  37           HH       ATY  37 -24.627  -5.272  -9.245
  264   HT21  TYC  37          HT21      ATY  37 -16.742  -4.657 -11.829
  265   HT22  TYC  37          HT22      ATY  37 -15.383  -3.618 -11.561
  Start of MODEL   18
    1    H1   LYS   1           HT1      LYS   1   9.172   4.918   9.857
    2    H2   LYS   1           HT2      LYS   1  10.009   6.396   9.692
    3    H3   LYS   1           HT3      LYS   1  10.783   4.949   9.375
    4    HA   LYS   1           HA       LYS   1   9.525   4.521   7.500
    5    HB2  LYS   1           HB2      LYS   1   8.077   7.115   8.152
    6    HB3  LYS   1           HB1      LYS   1   7.903   6.225   6.652
    7    HG2  LYS   1           HG2      LYS   1   7.010   4.310   7.897
    8    HG3  LYS   1           HG1      LYS   1   7.151   5.232   9.394
    9    HD2  LYS   1           HD2      LYS   1   5.559   6.882   8.534
   10    HD3  LYS   1           HD1      LYS   1   5.446   5.990   7.015
   11    HE2  LYS   1           HE2      LYS   1   4.561   4.050   8.222
   12    HE3  LYS   1           HE1      LYS   1   4.681   4.933   9.740
   13    HZ1  LYS   1           HZ1      LYS   1   2.441   4.908   8.852
   14    HZ2  LYS   1           HZ2      LYS   1   2.934   5.664   7.442
   15    HZ3  LYS   1           HZ3      LYS   1   3.021   6.487   8.927
   16    H    CYS   2           HN       CYS   2   9.942   5.635   5.393
   17    HA   CYS   2           HA       CYS   2  11.903   7.756   5.613
   18    HB2  CYS   2           HB2      CYS   2  13.304   6.506   3.920
   19    HB3  CYS   2           HB1      CYS   2  13.310   5.838   5.554
   20    H    ASN   3           HN       ASN   3  12.412   8.611   3.313
   21    HA   ASN   3           HA       ASN   3   9.992   8.436   1.665
   22    HB2  ASN   3           HB2      ASN   3   9.673  10.146   3.491
   23    HB3  ASN   3           HB1      ASN   3  10.989  11.057   2.774
   24   HD21  ASN   3          HD21      ASN   3   8.507   9.310   0.969
   25   HD22  ASN   3          HD22      ASN   3   7.776  10.706   0.310
   26    H    THR   4           HN       THR   4  13.043   8.025   1.491
   27    HA   THR   4           HA       THR   4  13.564   9.825  -0.745
   28    HB   THR   4           HB       THR   4  15.385   9.740   0.906
   29    HG1  THR   4           HG1      THR   4  16.929   9.579  -0.550
   30   HG21  THR   4          HG21      THR   4  14.895   7.520   1.814
   31   HG22  THR   4          HG22      THR   4  16.603   7.667   1.360
   32   HG23  THR   4          HG23      THR   4  15.467   6.799   0.312
   33    H    ALA   5           HN       ALA   5  14.564   8.825  -2.667
   34    HA   ALA   5           HA       ALA   5  12.874   6.768  -3.690
   35    HB1  ALA   5           HB1      ALA   5  13.774   8.576  -5.111
   36    HB2  ALA   5           HB2      ALA   5  14.146   6.972  -5.752
   37    HB3  ALA   5           HB3      ALA   5  15.387   7.894  -4.901
   38    H    THR   6           HN       THR   6  15.835   6.798  -2.089
   39    HA   THR   6           HA       THR   6  16.765   4.247  -2.970
   40    HB   THR   6           HB       THR   6  17.527   5.935  -0.574
   41    HG1  THR   6           HG1      THR   6  19.077   6.808  -1.889
   42   HG21  THR   6          HG21      THR   6  18.288   3.639  -0.389
   43   HG22  THR   6          HG22      THR   6  19.664   4.714  -0.666
   44   HG23  THR   6          HG23      THR   6  19.032   3.717  -1.988
   45    H    CYS   7           HN       CYS   7  14.277   5.211  -0.838
   46    HA   CYS   7           HA       CYS   7  14.577   2.732   0.767
   47    HB2  CYS   7           HB2      CYS   7  15.294   4.944   1.718
   48    HB3  CYS   7           HB1      CYS   7  13.646   5.324   1.757
   49    H    ALA   8           HN       ALA   8  12.379   5.384  -0.169
   50    HA   ALA   8           HA       ALA   8  10.069   4.314   0.937
   51    HB1  ALA   8           HB1      ALA   8  10.442   6.167  -1.407
   52    HB2  ALA   8           HB2      ALA   8  10.225   6.633   0.285
   53    HB3  ALA   8           HB3      ALA   8   8.908   5.854  -0.599
   54    H    THR   9           HN       THR   9  11.794   3.791  -1.882
   55    HA   THR   9           HA       THR   9   9.761   2.557  -3.484
   56    HB   THR   9           HB       THR   9  11.746   1.743  -4.778
   57    HG1  THR   9           HG1      THR   9  13.597   3.307  -3.909
   58   HG21  THR   9          HG21      THR   9  12.257   4.039  -5.601
   59   HG22  THR   9          HG22      THR   9  11.493   4.698  -4.157
   60   HG23  THR   9          HG23      THR   9  10.529   3.805  -5.330
   61    H    GLN  10           HN       GLN  10  12.010   1.564  -1.185
   62    HA   GLN  10           HA       GLN  10  11.894  -1.262  -1.660
   63    HB2  GLN  10           HB2      GLN  10  12.793   0.077   0.886
   64    HB3  GLN  10           HB1      GLN  10  13.277  -1.506   0.282
   65    HG2  GLN  10           HG2      GLN  10  14.042   1.201  -0.777
   66    HG3  GLN  10           HG1      GLN  10  15.089   0.020   0.003
   67   HE21  GLN  10          HE21      GLN  10  15.183   1.341  -2.566
   68   HE22  GLN  10          HE22      GLN  10  15.327   0.103  -3.763
   69    H    ARG  11           HN       ARG  11  10.465   1.056   0.554
   70    HA   ARG  11           HA       ARG  11   8.988  -0.937   1.899
   71    HB2  ARG  11           HB2      ARG  11   7.728   0.792   3.040
   72    HB3  ARG  11           HB1      ARG  11   9.427   1.233   2.984
   73    HG2  ARG  11           HG2      ARG  11   8.167   3.225   2.685
   74    HG3  ARG  11           HG1      ARG  11   8.864   2.788   1.123
   75    HD2  ARG  11           HD2      ARG  11   6.545   3.507   0.813
   76    HD3  ARG  11           HD1      ARG  11   6.803   1.782   0.469
   77    HE   ARG  11           HE       ARG  11   6.004   1.572   2.923
   78   HH11  ARG  11          HH11      ARG  11   4.610   3.716   0.461
   79   HH12  ARG  11          HH12      ARG  11   3.021   3.572   1.057
   80   HH21  ARG  11          HH21      ARG  11   3.847   1.381   3.715
   81   HH22  ARG  11          HH22      ARG  11   2.568   2.197   2.950
   82    H    LEU  12           HN       LEU  12   8.439   0.909  -0.967
   83    HA   LEU  12           HA       LEU  12   5.779   0.289  -1.482
   84    HB2  LEU  12           HB2      LEU  12   8.207   0.786  -3.051
   85    HB3  LEU  12           HB1      LEU  12   6.836   0.387  -3.952
   86    HG   LEU  12           HG       LEU  12   7.286   2.845  -2.255
   87   HD11  LEU  12          HD11      LEU  12   6.851   4.020  -4.344
   88   HD12  LEU  12          HD12      LEU  12   6.542   2.488  -5.151
   89   HD13  LEU  12          HD13      LEU  12   8.159   2.856  -4.566
   90   HD21  LEU  12          HD21      LEU  12   4.984   3.541  -2.848
   91   HD22  LEU  12          HD22      LEU  12   5.017   2.156  -1.771
   92   HD23  LEU  12          HD23      LEU  12   4.683   1.928  -3.489
   93    H    ALA  13           HN       ALA  13   8.794  -1.396  -2.124
   94    HA   ALA  13           HA       ALA  13   7.620  -3.521  -3.454
   95    HB1  ALA  13           HB1      ALA  13  10.003  -3.044  -3.639
   96    HB2  ALA  13           HB2      ALA  13   9.762  -4.702  -3.090
   97    HB3  ALA  13           HB3      ALA  13  10.229  -3.449  -1.939
   98    H    ASN  14           HN       ASN  14   8.100  -2.766  -0.114
   99    HA   ASN  14           HA       ASN  14   7.467  -5.417   0.886
  100    HB2  ASN  14           HB2      ASN  14   7.956  -2.844   2.372
  101    HB3  ASN  14           HB1      ASN  14   7.452  -4.327   3.163
  102   HD21  ASN  14          HD21      ASN  14   9.647  -3.923   0.534
  103   HD22  ASN  14          HD22      ASN  14  11.068  -4.559   1.298
  104    H    PHE  15           HN       PHE  15   5.477  -3.002  -0.331
  105    HA   PHE  15           HA       PHE  15   3.560  -3.299   1.811
  106    HB2  PHE  15           HB2      PHE  15   2.858  -1.224   1.172
  107    HB3  PHE  15           HB1      PHE  15   4.259  -1.210   0.110
  108    HD1  PHE  15           HD1      PHE  15   0.628  -1.569   0.310
  109    HD2  PHE  15           HD2      PHE  15   3.970  -1.571  -2.305
  110    HE1  PHE  15           HE1      PHE  15  -0.880  -1.327  -1.612
  111    HE2  PHE  15           HE2      PHE  15   2.474  -1.332  -4.231
  112    HZ   PHE  15           HZ       PHE  15   0.046  -1.208  -3.892
  113    H    LEU  16           HN       LEU  16   4.519  -4.609  -1.109
  114    HA   LEU  16           HA       LEU  16   2.018  -5.962  -1.247
  115    HB2  LEU  16           HB2      LEU  16   1.724  -5.415  -3.289
  116    HB3  LEU  16           HB1      LEU  16   2.627  -4.047  -2.829
  117    HG   LEU  16           HG       LEU  16   3.789  -6.323  -4.457
  118   HD11  LEU  16          HD11      LEU  16   3.793  -4.687  -6.280
  119   HD12  LEU  16          HD12      LEU  16   2.938  -3.551  -5.236
  120   HD13  LEU  16          HD13      LEU  16   2.165  -5.063  -5.712
  121   HD21  LEU  16          HD21      LEU  16   5.689  -4.818  -4.804
  122   HD22  LEU  16          HD22      LEU  16   5.484  -5.189  -3.093
  123   HD23  LEU  16          HD23      LEU  16   4.951  -3.632  -3.727
  124    H    VAL  17           HN       VAL  17   4.791  -6.536  -0.146
  125    HA   VAL  17           HA       VAL  17   6.113  -8.302  -1.918
  126    HB   VAL  17           HB       VAL  17   7.341  -7.039  -0.248
  127   HG11  VAL  17          HG11      VAL  17   7.364  -7.514   2.115
  128   HG12  VAL  17          HG12      VAL  17   6.169  -8.788   1.891
  129   HG13  VAL  17          HG13      VAL  17   5.717  -7.126   1.594
  130   HG21  VAL  17          HG21      VAL  17   8.812  -8.846   0.644
  131   HG22  VAL  17          HG22      VAL  17   8.492  -8.910  -1.081
  132   HG23  VAL  17          HG23      VAL  17   7.652 -10.021   0.001
  133    H    HIS  18           HN       HIS  18   4.551  -9.117   1.127
  134    HA   HIS  18           HA       HIS  18   3.650 -11.608  -0.175
  135    HB2  HIS  18           HB2      HIS  18   4.161 -11.174   2.801
  136    HB3  HIS  18           HB1      HIS  18   3.475 -12.622   2.090
  137    HD1  HIS  18           HD1      HIS  18   5.119 -14.441   1.796
  138    HD2  HIS  18           HD2      HIS  18   6.812 -10.681   1.615
  139    HE1  HIS  18           HE1      HIS  18   7.588 -14.856   1.637
  140    HE2  HIS  18           HE2      HIS  18   8.620 -12.567   1.741
  141    H    SER  19           HN       SER  19   2.889  -8.629   0.818
  142    HA   SER  19           HA       SER  19   0.404  -9.048   2.030
  143    HB2  SER  19           HB2      SER  19   1.540  -6.618   0.683
  144    HB3  SER  19           HB1      SER  19   0.148  -6.648   1.762
  145    HG   SER  19           HG       SER  19   1.987  -7.838   3.091
  146    H    SER  20           HN       SER  20   1.546  -9.258  -1.033
  147    HA   SER  20           HA       SER  20  -0.343  -8.208  -2.756
  148    HB2  SER  20           HB2      SER  20   0.661 -10.112  -4.205
  149    HB3  SER  20           HB1      SER  20   1.696  -8.784  -3.643
  150    HG   SER  20           HG       SER  20   2.479 -10.998  -3.307
  151    H    ASN  21           HN       ASN  21  -0.500 -10.962  -0.804
  152    HA   ASN  21           HA       ASN  21  -2.708 -12.176  -2.311
  153    HB2  ASN  21           HB2      ASN  21  -0.694 -13.147  -0.373
  154    HB3  ASN  21           HB1      ASN  21  -2.129 -14.142  -0.731
  155   HD21  ASN  21          HD21      ASN  21   0.987 -13.015  -1.772
  156   HD22  ASN  21          HD22      ASN  21   1.067 -13.928  -3.217
  157    H    ASN  22           HN       ASN  22  -2.346  -9.968   0.164
  158    HA   ASN  22           HA       ASN  22  -4.527 -11.102   1.702
  159    HB2  ASN  22           HB2      ASN  22  -1.830 -10.694   2.427
  160    HB3  ASN  22           HB1      ASN  22  -2.932  -9.703   3.388
  161   HD21  ASN  22          HD21      ASN  22  -3.778 -12.712   1.842
  162   HD22  ASN  22          HD22      ASN  22  -3.986 -13.620   3.250
  163    H    PHE  23           HN       PHE  23  -2.675  -8.369   0.840
  164    HA   PHE  23           HA       PHE  23  -3.923  -6.544   2.458
  165    HB2  PHE  23           HB2      PHE  23  -2.401  -5.004   1.546
  166    HB3  PHE  23           HB1      PHE  23  -1.757  -6.594   1.308
  167    HD1  PHE  23           HD1      PHE  23  -1.907  -3.624  -0.272
  168    HD2  PHE  23           HD2      PHE  23  -2.623  -7.684  -0.825
  169    HE1  PHE  23           HE1      PHE  23  -1.476  -3.310  -2.676
  170    HE2  PHE  23           HE2      PHE  23  -2.195  -7.498  -3.227
  171    HZ   PHE  23           HZ       PHE  23  -1.614  -5.241  -4.193
  172    H    GLY  24           HN       GLY  24  -5.877  -6.533   2.445
  173    HA2  GLY  24           HA2      GLY  24  -8.073  -6.266   1.927
  174    HA3  GLY  24           HA1      GLY  24  -7.668  -5.135   0.658
  175    H    ALA  25           HN       ALA  25  -6.687  -8.453   1.015
  176    HA   ALA  25           HA       ALA  25  -8.214  -9.179  -1.360
  177    HB1  ALA  25           HB1      ALA  25  -6.653 -11.088  -1.499
  178    HB2  ALA  25           HB2      ALA  25  -5.896 -10.549  -0.003
  179    HB3  ALA  25           HB3      ALA  25  -5.770  -9.551  -1.454
  180    H    ILE  26           HN       ILE  26  -7.251  -9.960   1.842
  181    HA   ILE  26           HA       ILE  26  -9.342 -11.839   2.105
  182    HB   ILE  26           HB       ILE  26  -7.286 -12.568   3.047
  183   HG12  ILE  26          HG12      ILE  26  -8.823 -11.440   5.258
  184   HG13  ILE  26          HG11      ILE  26  -9.380 -12.893   4.436
  185   HG21  ILE  26          HG21      ILE  26  -6.097 -10.484   3.221
  186   HG22  ILE  26          HG22      ILE  26  -6.084 -11.237   4.822
  187   HG23  ILE  26          HG23      ILE  26  -7.205  -9.913   4.456
  188   HD11  ILE  26          HD11      ILE  26  -6.873 -12.546   6.118
  189   HD12  ILE  26          HD12      ILE  26  -7.213 -13.987   5.161
  190   HD13  ILE  26          HD13      ILE  26  -8.272 -13.553   6.502
  191    H    LEU  27           HN       LEU  27  -8.309  -8.675   3.217
  192    HA   LEU  27           HA       LEU  27 -10.310  -8.226   5.129
  193    HB2  LEU  27           HB2      LEU  27  -8.891  -6.481   5.497
  194    HB3  LEU  27           HB1      LEU  27  -8.120  -6.885   3.981
  195    HG   LEU  27           HG       LEU  27  -9.618  -5.276   2.810
  196   HD11  LEU  27          HD11      LEU  27 -10.791  -3.605   4.042
  197   HD12  LEU  27          HD12      LEU  27 -10.501  -4.473   5.566
  198   HD13  LEU  27          HD13      LEU  27 -11.481  -5.207   4.274
  199   HD21  LEU  27          HD21      LEU  27  -8.480  -3.269   3.612
  200   HD22  LEU  27          HD22      LEU  27  -7.375  -4.636   3.469
  201   HD23  LEU  27          HD23      LEU  27  -7.965  -4.142   5.054
  202    H    SER  28           HN       SER  28 -10.010  -7.387   1.787
  203    HA   SER  28           HA       SER  28 -12.634  -6.344   1.804
  204    HB2  SER  28           HB2      SER  28 -10.765  -6.853  -0.477
  205    HB3  SER  28           HB1      SER  28 -12.280  -5.935  -0.607
  206    HG   SER  28           HG       SER  28 -10.688  -4.444  -0.231
  207    H    SER  29           HN       SER  29 -11.089  -9.273   1.203
  208    HA   SER  29           HA       SER  29 -11.739 -11.423   0.871
  209    HB2  SER  29           HB2      SER  29 -14.523 -10.501   1.227
  210    HB3  SER  29           HB1      SER  29 -13.852 -12.067   1.683
  211    HG   SER  29           HG       SER  29 -12.459 -10.610   3.183
  212    H    THR  30           HN       THR  30 -11.626  -9.622  -1.360
  213    HA   THR  30           HA       THR  30 -13.783  -9.644  -3.094
  214    HB   THR  30           HB       THR  30 -11.867  -9.084  -4.699
  215    HG1  THR  30           HG1      THR  30  -9.875  -8.764  -3.640
  216   HG21  THR  30          HG21      THR  30 -13.235  -7.398  -3.543
  217   HG22  THR  30          HG22      THR  30 -11.535  -6.895  -3.579
  218   HG23  THR  30          HG23      THR  30 -12.227  -7.603  -2.112
  219    H    ASN  31           HN       ASN  31 -11.058 -11.720  -2.682
  220    HA   ASN  31           HA       ASN  31 -11.958 -13.354  -4.929
  221    HB2  ASN  31           HB2      ASN  31  -9.748 -14.460  -4.937
  222    HB3  ASN  31           HB1      ASN  31  -9.613 -12.712  -5.114
  223   HD21  ASN  31          HD21      ASN  31  -8.768 -11.511  -3.463
  224   HD22  ASN  31          HD22      ASN  31  -7.969 -12.266  -2.138
  225    H    VAL  32           HN       VAL  32 -12.540 -13.184  -1.873
  226    HA   VAL  32           HA       VAL  32 -12.242 -16.012  -1.196
  227    HB   VAL  32           HB       VAL  32 -13.379 -13.782   0.522
  228   HG11  VAL  32          HG11      VAL  32 -13.979 -16.002   1.306
  229   HG12  VAL  32          HG12      VAL  32 -12.827 -15.254   2.413
  230   HG13  VAL  32          HG13      VAL  32 -12.285 -16.489   1.280
  231   HG21  VAL  32          HG21      VAL  32 -10.535 -14.788   0.438
  232   HG22  VAL  32          HG22      VAL  32 -11.178 -13.619   1.596
  233   HG23  VAL  32          HG23      VAL  32 -11.100 -13.214  -0.119
  234    H    GLY  33           HN       GLY  33 -14.452 -13.827  -2.511
  235    HA2  GLY  33           HA2      GLY  33 -16.556 -14.259  -3.367
  236    HA3  GLY  33           HA1      GLY  33 -16.501 -15.842  -2.595
  237    H    SER  34           HN       SER  34 -15.780 -13.073  -0.748
  238    HA   SER  34           HA       SER  34 -18.325 -13.398   0.677
  239    HB2  SER  34           HB2      SER  34 -15.918 -11.913   1.722
  240    HB3  SER  34           HB1      SER  34 -17.216 -12.673   2.629
  241    HG   SER  34           HG       SER  34 -16.336 -14.681   1.537
  242    H    ASN  35           HN       ASN  35 -15.883 -10.912   0.025
  243    HA   ASN  35           HA       ASN  35 -15.881  -8.905  -0.822
  244    HB2  ASN  35           HB2      ASN  35 -18.716  -9.487  -1.685
  245    HB3  ASN  35           HB1      ASN  35 -17.886  -7.978  -2.088
  246   HD21  ASN  35          HD21      ASN  35 -18.966 -10.002  -3.848
  247   HD22  ASN  35          HD22      ASN  35 -17.655 -10.575  -4.798
  248    H    THR  36           HN       THR  36 -15.467  -8.228   1.075
  249    HA   THR  36           HA       THR  36 -17.680  -7.405   2.749
  250    HB   THR  36           HB       THR  36 -14.828  -7.671   3.682
  251    HG1  THR  36           HG1      THR  36 -14.972  -9.780   3.411
  252   HG21  THR  36          HG21      THR  36 -15.950  -8.270   5.758
  253   HG22  THR  36          HG22      THR  36 -17.501  -8.206   4.916
  254   HG23  THR  36          HG23      THR  36 -16.572  -6.715   5.166
  255    H    TYC  37           HN       ATY  37 -15.624  -6.235   0.591
  256    HA   TYC  37           HA       ATY  37 -14.667  -4.285  -0.001
  257    HB1  TYC  37           HB1      ATY  37 -16.132  -2.349   0.245
  258    HB2  TYC  37           HB2      ATY  37 -17.179  -3.261   1.332
  259    HD1  TYC  37           HD1      ATY  37 -16.248  -2.628  -2.118
  260    HD2  TYC  37           HD2      ATY  37 -18.468  -5.207   0.428
  261    HE1  TYC  37           HE1      ATY  37 -17.462  -3.485  -4.059
  262    HE2  TYC  37           HE2      ATY  37 -19.693  -6.075  -1.518
  263    HH   TYC  37           HH       ATY  37 -20.275  -5.266  -3.754
  264   HT21  TYC  37          HT21      ATY  37 -12.781  -4.264   1.183
  265   HT22  TYC  37          HT22      ATY  37 -12.574  -3.246   2.556
  Start of MODEL   19
    1    H1   LYS   1           HT1      LYS   1  10.112   3.835   9.501
    2    H2   LYS   1           HT2      LYS   1  11.506   4.796   9.456
    3    H3   LYS   1           HT3      LYS   1  11.276   3.599   8.307
    4    HA   LYS   1           HA       LYS   1   9.441   4.760   7.353
    5    HB2  LYS   1           HB2      LYS   1   8.651   5.786   9.489
    6    HB3  LYS   1           HB1      LYS   1  10.045   6.851   9.467
    7    HG2  LYS   1           HG2      LYS   1   9.246   7.812   7.344
    8    HG3  LYS   1           HG1      LYS   1   7.817   6.789   7.446
    9    HD2  LYS   1           HD2      LYS   1   7.183   7.868   9.545
   10    HD3  LYS   1           HD1      LYS   1   8.626   8.881   9.467
   11    HE2  LYS   1           HE2      LYS   1   6.365   8.853   7.461
   12    HE3  LYS   1           HE1      LYS   1   6.639  10.086   8.687
   13    HZ1  LYS   1           HZ1      LYS   1   8.739  10.642   7.605
   14    HZ2  LYS   1           HZ2      LYS   1   7.461  10.763   6.508
   15    HZ3  LYS   1           HZ3      LYS   1   8.487   9.441   6.450
   16    H    CYS   2           HN       CYS   2  10.079   5.770   5.479
   17    HA   CYS   2           HA       CYS   2  12.231   7.620   5.522
   18    HB2  CYS   2           HB2      CYS   2  13.515   6.291   3.793
   19    HB3  CYS   2           HB1      CYS   2  13.608   5.716   5.467
   20    H    ASN   3           HN       ASN   3  12.539   8.616   3.371
   21    HA   ASN   3           HA       ASN   3  10.154   8.307   1.704
   22    HB2  ASN   3           HB2      ASN   3   9.697  10.006   3.521
   23    HB3  ASN   3           HB1      ASN   3  10.981  10.988   2.839
   24   HD21  ASN   3          HD21      ASN   3   8.663   9.122   0.936
   25   HD22  ASN   3          HD22      ASN   3   7.882  10.479   0.232
   26    H    THR   4           HN       THR   4  13.130   7.942   1.492
   27    HA   THR   4           HA       THR   4  13.633   9.770  -0.730
   28    HB   THR   4           HB       THR   4  15.484   9.578   0.891
   29    HG1  THR   4           HG1      THR   4  16.695   9.827  -0.712
   30   HG21  THR   4          HG21      THR   4  15.558   6.661   0.155
   31   HG22  THR   4          HG22      THR   4  15.026   7.312   1.699
   32   HG23  THR   4          HG23      THR   4  16.713   7.487   1.204
   33    H    ALA   5           HN       ALA   5  14.471   8.832  -2.691
   34    HA   ALA   5           HA       ALA   5  12.742   6.880  -3.768
   35    HB1  ALA   5           HB1      ALA   5  15.308   7.950  -4.927
   36    HB2  ALA   5           HB2      ALA   5  13.720   8.694  -5.096
   37    HB3  ALA   5           HB3      ALA   5  14.034   7.113  -5.814
   38    H    THR   6           HN       THR   6  15.698   6.652  -2.181
   39    HA   THR   6           HA       THR   6  16.406   4.064  -3.211
   40    HB   THR   6           HB       THR   6  17.471   5.735  -0.939
   41    HG1  THR   6           HG1      THR   6  17.999   5.549  -3.687
   42   HG21  THR   6          HG21      THR   6  19.488   4.337  -1.105
   43   HG22  THR   6          HG22      THR   6  18.672   3.322  -2.309
   44   HG23  THR   6          HG23      THR   6  18.057   3.412  -0.653
   45    H    CYS   7           HN       CYS   7  14.174   5.169  -0.899
   46    HA   CYS   7           HA       CYS   7  14.456   2.656   0.651
   47    HB2  CYS   7           HB2      CYS   7  15.300   4.880   1.626
   48    HB3  CYS   7           HB1      CYS   7  13.651   5.208   1.801
   49    H    ALA   8           HN       ALA   8  12.292   5.355  -0.212
   50    HA   ALA   8           HA       ALA   8  10.016   4.255   1.001
   51    HB1  ALA   8           HB1      ALA   8  10.181   6.590   0.424
   52    HB2  ALA   8           HB2      ALA   8   8.788   5.863  -0.385
   53    HB3  ALA   8           HB3      ALA   8  10.273   6.193  -1.292
   54    H    THR   9           HN       THR   9  11.711   3.720  -1.820
   55    HA   THR   9           HA       THR   9   9.715   2.429  -3.418
   56    HB   THR   9           HB       THR   9  11.779   1.527  -4.608
   57    HG1  THR   9           HG1      THR   9  13.534   3.217  -3.849
   58   HG21  THR   9          HG21      THR   9  10.501   3.502  -5.358
   59   HG22  THR   9          HG22      THR   9  12.233   3.737  -5.616
   60   HG23  THR   9          HG23      THR   9  11.433   4.513  -4.252
   61    H    GLN  10           HN       GLN  10  11.901   1.533  -1.031
   62    HA   GLN  10           HA       GLN  10  11.720  -1.332  -1.288
   63    HB2  GLN  10           HB2      GLN  10  12.574   0.222   1.170
   64    HB3  GLN  10           HB1      GLN  10  12.918  -1.463   0.810
   65    HG2  GLN  10           HG2      GLN  10  13.964   0.918  -0.686
   66    HG3  GLN  10           HG1      GLN  10  14.862  -0.066   0.464
   67   HE21  GLN  10          HE21      GLN  10  15.147   0.549  -2.359
   68   HE22  GLN  10          HE22      GLN  10  15.377  -0.957  -3.172
   69    H    ARG  11           HN       ARG  11  10.310   1.209   0.547
   70    HA   ARG  11           HA       ARG  11   8.589  -0.371   2.199
   71    HB2  ARG  11           HB2      ARG  11   7.973   2.403   1.140
   72    HB3  ARG  11           HB1      ARG  11   7.252   1.635   2.539
   73    HG2  ARG  11           HG2      ARG  11  10.099   2.568   2.267
   74    HG3  ARG  11           HG1      ARG  11   8.830   3.330   3.226
   75    HD2  ARG  11           HD2      ARG  11  10.066   0.640   3.596
   76    HD3  ARG  11           HD1      ARG  11  10.293   2.064   4.617
   77    HE   ARG  11           HE       ARG  11   7.604   1.660   4.691
   78   HH11  ARG  11          HH11      ARG  11  10.361  -0.397   5.571
   79   HH12  ARG  11          HH12      ARG  11   9.458  -1.385   6.624
   80   HH21  ARG  11          HH21      ARG  11   6.373   0.298   6.152
   81   HH22  ARG  11          HH22      ARG  11   7.152  -0.967   6.971
   82    H    LEU  12           HN       LEU  12   8.253   1.063  -0.976
   83    HA   LEU  12           HA       LEU  12   5.675   0.237  -1.598
   84    HB2  LEU  12           HB2      LEU  12   8.158   0.736  -3.076
   85    HB3  LEU  12           HB1      LEU  12   6.814   0.315  -4.004
   86    HG   LEU  12           HG       LEU  12   7.227   2.810  -2.344
   87   HD11  LEU  12          HD11      LEU  12   6.816   3.970  -4.443
   88   HD12  LEU  12          HD12      LEU  12   6.562   2.429  -5.253
   89   HD13  LEU  12          HD13      LEU  12   8.151   2.827  -4.610
   90   HD21  LEU  12          HD21      LEU  12   4.944   3.520  -2.961
   91   HD22  LEU  12          HD22      LEU  12   4.945   2.130  -1.888
   92   HD23  LEU  12          HD23      LEU  12   4.635   1.909  -3.612
   93    H    ALA  13           HN       ALA  13   8.824  -1.324  -1.953
   94    HA   ALA  13           HA       ALA  13   7.875  -3.596  -3.245
   95    HB1  ALA  13           HB1      ALA  13  10.238  -2.961  -3.286
   96    HB2  ALA  13           HB2      ALA  13  10.042  -4.619  -2.715
   97    HB3  ALA  13           HB3      ALA  13  10.371  -3.324  -1.565
   98    H    ASN  14           HN       ASN  14   8.121  -2.704   0.092
   99    HA   ASN  14           HA       ASN  14   7.493  -5.309   1.222
  100    HB2  ASN  14           HB2      ASN  14   7.592  -2.558   2.452
  101    HB3  ASN  14           HB1      ASN  14   7.117  -4.005   3.326
  102   HD21  ASN  14          HD21      ASN  14   9.646  -4.047   0.972
  103   HD22  ASN  14          HD22      ASN  14  10.957  -4.243   2.058
  104    H    PHE  15           HN       PHE  15   5.664  -3.034  -0.409
  105    HA   PHE  15           HA       PHE  15   3.439  -3.081   1.396
  106    HB2  PHE  15           HB2      PHE  15   3.440  -0.954   0.586
  107    HB3  PHE  15           HB1      PHE  15   4.502  -1.398  -0.733
  108    HD1  PHE  15           HD1      PHE  15   3.643  -1.855  -2.894
  109    HD2  PHE  15           HD2      PHE  15   0.994  -1.045   0.326
  110    HE1  PHE  15           HE1      PHE  15   1.825  -1.567  -4.491
  111    HE2  PHE  15           HE2      PHE  15  -0.857  -0.745  -1.272
  112    HZ   PHE  15           HZ       PHE  15  -0.449  -1.002  -3.686
  113    H    LEU  16           HN       LEU  16   4.759  -4.548  -1.371
  114    HA   LEU  16           HA       LEU  16   2.271  -5.941  -1.728
  115    HB2  LEU  16           HB2      LEU  16   2.253  -5.465  -3.814
  116    HB3  LEU  16           HB1      LEU  16   3.170  -4.125  -3.334
  117    HG   LEU  16           HG       LEU  16   4.534  -6.557  -4.511
  118   HD11  LEU  16          HD11      LEU  16   3.020  -5.591  -6.162
  119   HD12  LEU  16          HD12      LEU  16   4.703  -5.263  -6.579
  120   HD13  LEU  16          HD13      LEU  16   3.708  -3.994  -5.868
  121   HD21  LEU  16          HD21      LEU  16   5.940  -5.093  -3.138
  122   HD22  LEU  16          HD22      LEU  16   5.433  -3.711  -4.114
  123   HD23  LEU  16          HD23      LEU  16   6.381  -5.010  -4.846
  124    H    VAL  17           HN       VAL  17   4.856  -6.440  -0.244
  125    HA   VAL  17           HA       VAL  17   6.401  -8.274  -1.737
  126    HB   VAL  17           HB       VAL  17   7.345  -6.913   0.059
  127   HG11  VAL  17          HG11      VAL  17   7.197  -7.541   2.414
  128   HG12  VAL  17          HG12      VAL  17   5.967  -8.740   2.004
  129   HG13  VAL  17          HG13      VAL  17   5.642  -7.040   1.746
  130   HG21  VAL  17          HG21      VAL  17   8.753  -8.727   1.111
  131   HG22  VAL  17          HG22      VAL  17   8.726  -8.590  -0.642
  132   HG23  VAL  17          HG23      VAL  17   7.797  -9.867   0.138
  133    H    HIS  18           HN       HIS  18   4.415  -9.031   1.067
  134    HA   HIS  18           HA       HIS  18   3.952 -11.651  -0.210
  135    HB2  HIS  18           HB2      HIS  18   4.137 -11.037   2.757
  136    HB3  HIS  18           HB1      HIS  18   3.526 -12.549   2.104
  137    HD1  HIS  18           HD1      HIS  18   5.256 -14.321   2.278
  138    HD2  HIS  18           HD2      HIS  18   6.781 -10.593   1.508
  139    HE1  HIS  18           HE1      HIS  18   7.736 -14.684   2.172
  140    HE2  HIS  18           HE2      HIS  18   8.589 -12.481   1.318
  141    H    SER  19           HN       SER  19   2.770  -8.789   0.281
  142    HA   SER  19           HA       SER  19   0.377  -9.094   1.575
  143    HB2  SER  19           HB2      SER  19   0.996  -7.143  -0.618
  144    HB3  SER  19           HB1      SER  19  -0.186  -6.981   0.686
  145    HG   SER  19           HG       SER  19   1.741  -5.853   1.055
  146    H    SER  20           HN       SER  20   1.448 -10.121  -1.452
  147    HA   SER  20           HA       SER  20  -0.709  -9.815  -3.232
  148    HB2  SER  20           HB2      SER  20   1.402 -11.961  -3.217
  149    HB3  SER  20           HB1      SER  20   0.534 -11.328  -4.619
  150    HG   SER  20           HG       SER  20   1.492  -9.210  -3.856
  151    H    ASN  21           HN       ASN  21  -0.761 -11.485  -0.519
  152    HA   ASN  21           HA       ASN  21  -2.279 -13.808  -1.471
  153    HB2  ASN  21           HB2      ASN  21  -0.811 -13.184   1.024
  154    HB3  ASN  21           HB1      ASN  21  -2.021 -14.500   1.029
  155   HD21  ASN  21          HD21      ASN  21   1.096 -13.413   0.152
  156   HD22  ASN  21          HD22      ASN  21   1.683 -14.879  -0.537
  157    H    ASN  22           HN       ASN  22  -2.681 -10.777  -0.380
  158    HA   ASN  22           HA       ASN  22  -5.468 -11.259   0.341
  159    HB2  ASN  22           HB2      ASN  22  -3.359  -9.653   1.613
  160    HB3  ASN  22           HB1      ASN  22  -4.905  -8.849   1.538
  161   HD21  ASN  22          HD21      ASN  22  -4.656 -12.336   1.828
  162   HD22  ASN  22          HD22      ASN  22  -5.194 -12.443   3.441
  163    H    PHE  23           HN       PHE  23  -3.081  -9.100  -0.754
  164    HA   PHE  23           HA       PHE  23  -4.461  -7.258  -2.225
  165    HB2  PHE  23           HB2      PHE  23  -1.887  -8.408  -2.063
  166    HB3  PHE  23           HB1      PHE  23  -1.972  -7.516  -3.522
  167    HD1  PHE  23           HD1      PHE  23  -1.410  -5.189  -3.285
  168    HD2  PHE  23           HD2      PHE  23  -2.798  -7.339   0.099
  169    HE1  PHE  23           HE1      PHE  23  -0.997  -3.227  -1.862
  170    HE2  PHE  23           HE2      PHE  23  -2.394  -5.442   1.523
  171    HZ   PHE  23           HZ       PHE  23  -1.482  -3.336   0.552
  172    H    GLY  24           HN       GLY  24  -5.934  -7.867  -3.341
  173    HA2  GLY  24           HA2      GLY  24  -7.240  -8.715  -4.986
  174    HA3  GLY  24           HA1      GLY  24  -5.892  -8.789  -6.039
  175    H    ALA  25           HN       ALA  25  -6.507 -10.397  -2.994
  176    HA   ALA  25           HA       ALA  25  -6.585 -12.969  -4.367
  177    HB1  ALA  25           HB1      ALA  25  -6.022 -12.235  -1.486
  178    HB2  ALA  25           HB2      ALA  25  -4.828 -12.717  -2.674
  179    HB3  ALA  25           HB3      ALA  25  -6.044 -13.879  -2.125
  180    H    ILE  26           HN       ILE  26  -7.729 -11.200  -1.668
  181    HA   ILE  26           HA       ILE  26 -10.267 -12.412  -1.723
  182    HB   ILE  26           HB       ILE  26  -9.533 -11.947   0.452
  183   HG12  ILE  26          HG12      ILE  26 -11.135  -9.581  -0.284
  184   HG13  ILE  26          HG11      ILE  26 -11.863 -11.153   0.054
  185   HG21  ILE  26          HG21      ILE  26  -8.666  -9.251  -0.538
  186   HG22  ILE  26          HG22      ILE  26  -7.624 -10.545   0.043
  187   HG23  ILE  26          HG23      ILE  26  -8.672  -9.679   1.170
  188   HD11  ILE  26          HD11      ILE  26 -10.392  -9.362   2.007
  189   HD12  ILE  26          HD12      ILE  26 -10.978 -10.982   2.386
  190   HD13  ILE  26          HD13      ILE  26 -12.123  -9.697   1.998
  191    H    LEU  27           HN       LEU  27  -8.689  -9.427  -2.588
  192    HA   LEU  27           HA       LEU  27 -10.900  -7.856  -3.257
  193    HB2  LEU  27           HB2      LEU  27  -9.103  -6.561  -3.032
  194    HB3  LEU  27           HB1      LEU  27  -7.997  -7.819  -3.472
  195    HG   LEU  27           HG       LEU  27  -8.396  -7.263  -5.886
  196   HD11  LEU  27          HD11      LEU  27 -10.586  -6.306  -5.701
  197   HD12  LEU  27          HD12      LEU  27  -9.407  -5.258  -6.503
  198   HD13  LEU  27          HD13      LEU  27  -9.903  -4.910  -4.828
  199   HD21  LEU  27          HD21      LEU  27  -7.480  -4.985  -4.163
  200   HD22  LEU  27          HD22      LEU  27  -7.133  -5.202  -5.876
  201   HD23  LEU  27          HD23      LEU  27  -6.499  -6.352  -4.699
  202    H    SER  28           HN       SER  28  -8.934 -10.041  -5.058
  203    HA   SER  28           HA       SER  28 -10.512  -9.472  -7.439
  204    HB2  SER  28           HB2      SER  28  -8.036  -9.618  -7.650
  205    HB3  SER  28           HB1      SER  28  -8.127 -11.325  -7.245
  206    HG   SER  28           HG       SER  28  -9.467 -11.584  -9.103
  207    H    SER  29           HN       SER  29 -10.940 -11.431  -4.882
  208    HA   SER  29           HA       SER  29 -12.092 -13.304  -4.390
  209    HB2  SER  29           HB2      SER  29 -13.419 -12.605  -7.006
  210    HB3  SER  29           HB1      SER  29 -14.102 -13.685  -5.790
  211    HG   SER  29           HG       SER  29 -14.327 -12.026  -4.400
  212    H    THR  30           HN       THR  30  -9.622 -13.857  -5.629
  213    HA   THR  30           HA       THR  30 -10.136 -16.027  -7.507
  214    HB   THR  30           HB       THR  30  -7.615 -15.792  -7.829
  215    HG1  THR  30           HG1      THR  30  -6.704 -13.973  -7.029
  216   HG21  THR  30          HG21      THR  30  -7.969 -13.843  -9.312
  217   HG22  THR  30          HG22      THR  30  -9.500 -13.560  -8.440
  218   HG23  THR  30          HG23      THR  30  -9.297 -15.023  -9.391
  219    H    ASN  31           HN       ASN  31 -10.088 -15.807  -4.416
  220    HA   ASN  31           HA       ASN  31  -8.144 -17.959  -3.963
  221    HB2  ASN  31           HB2      ASN  31  -9.329 -15.973  -2.062
  222    HB3  ASN  31           HB1      ASN  31  -8.651 -17.479  -1.456
  223   HD21  ASN  31          HD21      ASN  31  -7.349 -15.926  -4.279
  224   HD22  ASN  31          HD22      ASN  31  -5.876 -15.394  -3.564
  225    H    VAL  32           HN       VAL  32 -11.219 -17.840  -4.731
  226    HA   VAL  32           HA       VAL  32 -12.240 -19.819  -2.890
  227    HB   VAL  32           HB       VAL  32 -13.386 -19.175  -5.608
  228   HG11  VAL  32          HG11      VAL  32 -14.375 -21.077  -4.505
  229   HG12  VAL  32          HG12      VAL  32 -15.527 -19.748  -4.637
  230   HG13  VAL  32          HG13      VAL  32 -14.748 -20.080  -3.096
  231   HG21  VAL  32          HG21      VAL  32 -13.846 -17.601  -3.074
  232   HG22  VAL  32          HG22      VAL  32 -14.771 -17.428  -4.569
  233   HG23  VAL  32          HG23      VAL  32 -13.057 -17.038  -4.551
  234    H    GLY  33           HN       GLY  33 -10.666 -19.650  -5.970
  235    HA2  GLY  33           HA2      GLY  33  -9.314 -21.881  -6.123
  236    HA3  GLY  33           HA1      GLY  33 -10.928 -22.525  -6.403
  237    H    SER  34           HN       SER  34 -11.741 -20.040  -7.741
  238    HA   SER  34           HA       SER  34 -11.979 -19.193  -9.816
  239    HB2  SER  34           HB2      SER  34  -9.040 -19.874 -10.082
  240    HB3  SER  34           HB1      SER  34  -9.992 -18.806 -11.127
  241    HG   SER  34           HG       SER  34 -10.454 -17.608  -9.139
  242    H    ASN  35           HN       ASN  35 -12.580 -21.818  -9.357
  243    HA   ASN  35           HA       ASN  35 -11.669 -23.451 -11.540
  244    HB2  ASN  35           HB2      ASN  35 -12.127 -24.478  -9.334
  245    HB3  ASN  35           HB1      ASN  35 -13.819 -24.036  -9.491
  246   HD21  ASN  35          HD21      ASN  35 -11.315 -26.180 -10.656
  247   HD22  ASN  35          HD22      ASN  35 -12.365 -27.285 -11.443
  248    H    THR  36           HN       THR  36 -12.286 -22.404 -13.267
  249    HA   THR  36           HA       THR  36 -15.066 -21.868 -13.857
  250    HB   THR  36           HB       THR  36 -14.063 -21.168 -16.072
  251    HG1  THR  36           HG1      THR  36 -11.686 -20.960 -15.900
  252   HG21  THR  36          HG21      THR  36 -12.934 -19.169 -15.170
  253   HG22  THR  36          HG22      THR  36 -12.806 -19.950 -13.596
  254   HG23  THR  36          HG23      THR  36 -14.390 -19.527 -14.243
  255    H    TYC  37           HN       ATY  37 -13.253 -24.444 -13.741
  256    HA   TYC  37           HA       ATY  37 -13.666 -25.735 -16.266
  257    HB1  TYC  37           HB1      ATY  37 -12.573 -27.674 -15.224
  258    HB2  TYC  37           HB2      ATY  37 -12.662 -26.885 -13.655
  259    HD1  TYC  37           HD1      ATY  37 -11.096 -25.185 -13.024
  260    HD2  TYC  37           HD2      ATY  37 -11.027 -26.793 -16.961
  261    HE1  TYC  37           HE1      ATY  37  -8.920 -24.114 -13.417
  262    HE2  TYC  37           HE2      ATY  37  -8.845 -25.727 -17.360
  263    HH   TYC  37           HH       ATY  37  -6.961 -24.449 -14.873
  264   HT21  TYC  37          HT21      ATY  37 -15.746 -26.036 -16.660
  265   HT22  TYC  37          HT22      ATY  37 -16.817 -27.001 -15.709
  Start of MODEL   20
    1    H1   LYS   1           HT1      LYS   1   9.981   5.757  10.398
    2    H2   LYS   1           HT2      LYS   1  10.562   7.243   9.799
    3    H3   LYS   1           HT3      LYS   1  11.582   5.922   9.869
    4    HA   LYS   1           HA       LYS   1  10.355   4.772   8.223
    5    HB2  LYS   1           HB2      LYS   1   8.488   5.851   7.079
    6    HB3  LYS   1           HB1      LYS   1   8.141   5.784   8.794
    7    HG2  LYS   1           HG2      LYS   1   8.687   8.142   9.023
    8    HG3  LYS   1           HG1      LYS   1   9.146   8.211   7.319
    9    HD2  LYS   1           HD2      LYS   1   6.856   7.533   6.709
   10    HD3  LYS   1           HD1      LYS   1   6.415   7.570   8.412
   11    HE2  LYS   1           HE2      LYS   1   6.895   9.953   8.504
   12    HE3  LYS   1           HE1      LYS   1   7.428   9.925   6.822
   13    HZ1  LYS   1           HZ1      LYS   1   4.679   9.328   7.776
   14    HZ2  LYS   1           HZ2      LYS   1   5.191   9.212   6.196
   15    HZ3  LYS   1           HZ3      LYS   1   5.160  10.721   6.943
   16    H    CYS   2           HN       CYS   2  10.329   5.707   5.767
   17    HA   CYS   2           HA       CYS   2  12.261   7.858   5.587
   18    HB2  CYS   2           HB2      CYS   2  13.393   6.538   3.753
   19    HB3  CYS   2           HB1      CYS   2  13.676   5.956   5.400
   20    H    ASN   3           HN       ASN   3  12.441   8.603   3.247
   21    HA   ASN   3           HA       ASN   3  10.010   8.182   1.719
   22    HB2  ASN   3           HB2      ASN   3   9.434  10.593   1.664
   23    HB3  ASN   3           HB1      ASN   3   9.258   9.882   3.268
   24   HD21  ASN   3          HD21      ASN   3  10.981  12.173   1.321
   25   HD22  ASN   3          HD22      ASN   3  11.868  12.899   2.616
   26    H    THR   4           HN       THR   4  13.000   7.988   1.457
   27    HA   THR   4           HA       THR   4  13.357   9.823  -0.783
   28    HB   THR   4           HB       THR   4  15.211   9.814   0.858
   29    HG1  THR   4           HG1      THR   4  15.956  10.255  -1.099
   30   HG21  THR   4          HG21      THR   4  16.616   7.831   1.176
   31   HG22  THR   4          HG22      THR   4  15.533   6.909   0.128
   32   HG23  THR   4          HG23      THR   4  14.949   7.524   1.671
   33    H    ALA   5           HN       ALA   5  14.339   8.895  -2.721
   34    HA   ALA   5           HA       ALA   5  12.761   6.797  -3.745
   35    HB1  ALA   5           HB1      ALA   5  15.252   8.025  -4.918
   36    HB2  ALA   5           HB2      ALA   5  13.609   8.630  -5.134
   37    HB3  ALA   5           HB3      ALA   5  14.065   7.058  -5.792
   38    H    THR   6           HN       THR   6  15.756   6.826  -2.124
   39    HA   THR   6           HA       THR   6  16.716   4.301  -3.068
   40    HB   THR   6           HB       THR   6  17.419   5.885  -0.596
   41    HG1  THR   6           HG1      THR   6  18.198   6.099  -3.294
   42   HG21  THR   6          HG21      THR   6  18.993   3.823  -2.160
   43   HG22  THR   6          HG22      THR   6  18.253   3.615  -0.569
   44   HG23  THR   6          HG23      THR   6  19.593   4.749  -0.769
   45    H    CYS   7           HN       CYS   7  14.220   5.203  -0.923
   46    HA   CYS   7           HA       CYS   7  14.600   2.761   0.699
   47    HB2  CYS   7           HB2      CYS   7  15.317   4.976   1.596
   48    HB3  CYS   7           HB1      CYS   7  13.662   5.348   1.712
   49    H    ALA   8           HN       ALA   8  12.314   5.378  -0.189
   50    HA   ALA   8           HA       ALA   8  10.103   4.155   0.963
   51    HB1  ALA   8           HB1      ALA   8  10.158   6.511   0.424
   52    HB2  ALA   8           HB2      ALA   8   8.786   5.742  -0.378
   53    HB3  ALA   8           HB3      ALA   8  10.241   6.146  -1.300
   54    H    THR   9           HN       THR   9  11.792   3.722  -1.923
   55    HA   THR   9           HA       THR   9   9.798   2.439  -3.529
   56    HB   THR   9           HB       THR   9  11.811   1.490  -4.683
   57    HG1  THR   9           HG1      THR   9  13.629   3.189  -3.858
   58   HG21  THR   9          HG21      THR   9  12.388   3.676  -5.691
   59   HG22  THR   9          HG22      THR   9  11.599   4.486  -4.338
   60   HG23  THR   9          HG23      THR   9  10.652   3.490  -5.448
   61    H    GLN  10           HN       GLN  10  12.022   1.461  -1.182
   62    HA   GLN  10           HA       GLN  10  11.880  -1.392  -1.505
   63    HB2  GLN  10           HB2      GLN  10  12.689   0.128   0.970
   64    HB3  GLN  10           HB1      GLN  10  13.182  -1.504   0.516
   65    HG2  GLN  10           HG2      GLN  10  13.963   1.070  -0.828
   66    HG3  GLN  10           HG1      GLN  10  14.969   0.106   0.241
   67   HE21  GLN  10          HE21      GLN  10  15.257   0.980  -2.502
   68   HE22  GLN  10          HE22      GLN  10  15.599  -0.419  -3.440
   69    H    ARG  11           HN       ARG  11  10.453   1.067   0.468
   70    HA   ARG  11           HA       ARG  11   8.877  -0.612   2.191
   71    HB2  ARG  11           HB2      ARG  11   8.116   2.181   1.332
   72    HB3  ARG  11           HB1      ARG  11   7.757   1.392   2.857
   73    HG2  ARG  11           HG2      ARG  11  10.489   2.273   1.954
   74    HG3  ARG  11           HG1      ARG  11   9.452   3.174   3.048
   75    HD2  ARG  11           HD2      ARG  11  10.504   0.396   3.553
   76    HD3  ARG  11           HD1      ARG  11  11.246   1.883   4.145
   77    HE   ARG  11           HE       ARG  11   8.476   1.550   4.855
   78   HH11  ARG  11          HH11      ARG  11  11.817   0.924   5.836
   79   HH12  ARG  11          HH12      ARG  11  11.451   0.831   7.497
   80   HH21  ARG  11          HH21      ARG  11   7.996   1.430   7.133
   81   HH22  ARG  11          HH22      ARG  11   9.240   1.086   8.242
   82    H    LEU  12           HN       LEU  12   8.372   0.966  -0.885
   83    HA   LEU  12           HA       LEU  12   5.767   0.185  -1.423
   84    HB2  LEU  12           HB2      LEU  12   8.181   0.746  -2.974
   85    HB3  LEU  12           HB1      LEU  12   6.809   0.376  -3.881
   86    HG   LEU  12           HG       LEU  12   7.319   2.778  -2.140
   87   HD11  LEU  12          HD11      LEU  12   6.673   4.009  -4.148
   88   HD12  LEU  12          HD12      LEU  12   6.386   2.486  -4.983
   89   HD13  LEU  12          HD13      LEU  12   8.014   2.909  -4.456
   90   HD21  LEU  12          HD21      LEU  12   4.616   1.907  -3.166
   91   HD22  LEU  12          HD22      LEU  12   4.987   3.488  -2.480
   92   HD23  LEU  12          HD23      LEU  12   5.097   2.055  -1.472
   93    H    ALA  13           HN       ALA  13   8.859  -1.419  -1.984
   94    HA   ALA  13           HA       ALA  13   7.759  -3.584  -3.320
   95    HB1  ALA  13           HB1      ALA  13  10.145  -3.068  -3.440
   96    HB2  ALA  13           HB2      ALA  13   9.907  -4.734  -2.912
   97    HB3  ALA  13           HB3      ALA  13  10.334  -3.488  -1.737
   98    H    ASN  14           HN       ASN  14   8.152  -2.790  -0.012
   99    HA   ASN  14           HA       ASN  14   7.450  -5.372   1.093
  100    HB2  ASN  14           HB2      ASN  14   7.785  -2.658   2.374
  101    HB3  ASN  14           HB1      ASN  14   7.302  -4.101   3.255
  102   HD21  ASN  14          HD21      ASN  14   9.590  -4.304   0.688
  103   HD22  ASN  14          HD22      ASN  14  10.987  -4.586   1.659
  104    H    PHE  15           HN       PHE  15   5.656  -2.968  -0.399
  105    HA   PHE  15           HA       PHE  15   3.413  -3.098   1.420
  106    HB2  PHE  15           HB2      PHE  15   3.226  -0.962   0.705
  107    HB3  PHE  15           HB1      PHE  15   4.498  -1.247  -0.475
  108    HD1  PHE  15           HD1      PHE  15   3.913  -1.817  -2.797
  109    HD2  PHE  15           HD2      PHE  15   0.889  -0.944   0.064
  110    HE1  PHE  15           HE1      PHE  15   2.308  -1.520  -4.610
  111    HE2  PHE  15           HE2      PHE  15  -0.740  -0.650  -1.757
  112    HZ   PHE  15           HZ       PHE  15  -0.027  -0.936  -4.103
  113    H    LEU  16           HN       LEU  16   4.717  -4.613  -1.267
  114    HA   LEU  16           HA       LEU  16   2.183  -5.868  -1.772
  115    HB2  LEU  16           HB2      LEU  16   2.214  -5.190  -3.812
  116    HB3  LEU  16           HB1      LEU  16   3.361  -4.056  -3.304
  117    HG   LEU  16           HG       LEU  16   4.265  -6.641  -4.594
  118   HD11  LEU  16          HD11      LEU  16   2.933  -5.368  -6.181
  119   HD12  LEU  16          HD12      LEU  16   4.643  -5.286  -6.607
  120   HD13  LEU  16          HD13      LEU  16   3.861  -3.916  -5.814
  121   HD21  LEU  16          HD21      LEU  16   6.362  -5.421  -4.900
  122   HD22  LEU  16          HD22      LEU  16   5.927  -5.502  -3.191
  123   HD23  LEU  16          HD23      LEU  16   5.660  -4.014  -4.100
  124    H    VAL  17           HN       VAL  17   4.647  -6.472  -0.201
  125    HA   VAL  17           HA       VAL  17   6.054  -8.451  -1.671
  126    HB   VAL  17           HB       VAL  17   7.197  -7.071  -0.015
  127   HG11  VAL  17          HG11      VAL  17   5.542  -6.935   1.735
  128   HG12  VAL  17          HG12      VAL  17   7.097  -7.462   2.371
  129   HG13  VAL  17          HG13      VAL  17   5.797  -8.624   2.147
  130   HG21  VAL  17          HG21      VAL  17   8.541  -8.870   1.056
  131   HG22  VAL  17          HG22      VAL  17   8.322  -8.998  -0.690
  132   HG23  VAL  17          HG23      VAL  17   7.385 -10.035   0.383
  133    H    HIS  18           HN       HIS  18   4.205  -8.913   1.293
  134    HA   HIS  18           HA       HIS  18   3.429 -11.572   0.210
  135    HB2  HIS  18           HB2      HIS  18   3.661 -10.827   3.156
  136    HB3  HIS  18           HB1      HIS  18   3.035 -12.337   2.534
  137    HD1  HIS  18           HD1      HIS  18   4.665 -14.126   2.882
  138    HD2  HIS  18           HD2      HIS  18   6.388 -10.525   1.917
  139    HE1  HIS  18           HE1      HIS  18   7.153 -14.592   2.898
  140    HE2  HIS  18           HE2      HIS  18   8.151 -12.462   1.996
  141    H    SER  19           HN       SER  19   2.552  -8.536   0.739
  142    HA   SER  19           HA       SER  19   0.136  -8.409   1.989
  143    HB2  SER  19           HB2      SER  19   0.974  -6.899  -0.420
  144    HB3  SER  19           HB1      SER  19   0.087  -6.332   1.000
  145    HG   SER  19           HG       SER  19   1.923  -5.801   1.776
  146    H    SER  20           HN       SER  20   1.054  -9.668  -0.943
  147    HA   SER  20           HA       SER  20  -1.072  -9.307  -2.702
  148    HB2  SER  20           HB2      SER  20   0.603 -11.787  -2.562
  149    HB3  SER  20           HB1      SER  20  -0.053 -10.982  -3.988
  150    HG   SER  20           HG       SER  20   2.287 -10.668  -3.146
  151    H    ASN  21           HN       ASN  21  -0.865 -11.274   0.043
  152    HA   ASN  21           HA       ASN  21  -3.028 -13.051  -0.798
  153    HB2  ASN  21           HB2      ASN  21  -0.944 -13.107   1.288
  154    HB3  ASN  21           HB1      ASN  21  -2.278 -14.296   1.333
  155   HD21  ASN  21          HD21      ASN  21   0.770 -13.405   0.096
  156   HD22  ASN  21          HD22      ASN  21   0.987 -14.697  -1.013
  157    H    ASN  22           HN       ASN  22  -2.780 -10.070   0.768
  158    HA   ASN  22           HA       ASN  22  -4.956 -10.712   2.569
  159    HB2  ASN  22           HB2      ASN  22  -2.293 -10.045   3.226
  160    HB3  ASN  22           HB1      ASN  22  -3.449  -8.794   3.722
  161   HD21  ASN  22          HD21      ASN  22  -4.174 -12.137   3.272
  162   HD22  ASN  22          HD22      ASN  22  -4.526 -12.522   4.863
  163    H    PHE  23           HN       PHE  23  -3.082  -8.343   1.000
  164    HA   PHE  23           HA       PHE  23  -4.267  -6.077   1.879
  165    HB2  PHE  23           HB2      PHE  23  -2.924  -4.971   0.245
  166    HB3  PHE  23           HB1      PHE  23  -2.182  -6.474   0.736
  167    HD1  PHE  23           HD1      PHE  23  -1.760  -4.716  -1.792
  168    HD2  PHE  23           HD2      PHE  23  -3.745  -8.304  -0.916
  169    HE1  PHE  23           HE1      PHE  23  -1.375  -5.440  -4.090
  170    HE2  PHE  23           HE2      PHE  23  -3.402  -9.098  -3.216
  171    HZ   PHE  23           HZ       PHE  23  -2.209  -7.641  -4.847
  172    H    GLY  24           HN       GLY  24  -6.268  -6.096   2.004
  173    HA2  GLY  24           HA2      GLY  24  -8.504  -6.052   1.596
  174    HA3  GLY  24           HA1      GLY  24  -8.254  -5.259   0.083
  175    H    ALA  25           HN       ALA  25  -7.117  -8.409   1.099
  176    HA   ALA  25           HA       ALA  25  -8.556  -9.642  -1.106
  177    HB1  ALA  25           HB1      ALA  25  -7.045 -11.547  -0.653
  178    HB2  ALA  25           HB2      ALA  25  -6.415 -10.674   0.745
  179    HB3  ALA  25           HB3      ALA  25  -6.137 -10.039  -0.879
  180    H    ILE  26           HN       ILE  26  -7.841  -9.719   2.229
  181    HA   ILE  26           HA       ILE  26  -9.893 -11.525   2.777
  182    HB   ILE  26           HB       ILE  26  -7.973 -11.944   4.043
  183   HG12  ILE  26          HG12      ILE  26  -9.667 -10.266   5.776
  184   HG13  ILE  26          HG11      ILE  26 -10.087 -11.933   5.393
  185   HG21  ILE  26          HG21      ILE  26  -7.884  -8.999   4.625
  186   HG22  ILE  26          HG22      ILE  26  -6.720  -9.934   3.679
  187   HG23  ILE  26          HG23      ILE  26  -6.829 -10.167   5.427
  188   HD11  ILE  26          HD11      ILE  26  -9.111 -11.835   7.633
  189   HD12  ILE  26          HD12      ILE  26  -7.707 -10.966   7.008
  190   HD13  ILE  26          HD13      ILE  26  -7.980 -12.647   6.553
  191    H    LEU  27           HN       LEU  27  -9.020  -8.182   3.280
  192    HA   LEU  27           HA       LEU  27 -11.179  -7.321   4.801
  193    HB2  LEU  27           HB2      LEU  27  -9.703  -5.644   4.827
  194    HB3  LEU  27           HB1      LEU  27  -8.951  -6.279   3.395
  195    HG   LEU  27           HG       LEU  27 -10.506  -4.925   2.002
  196   HD11  LEU  27          HD11      LEU  27 -11.327  -3.678   4.607
  197   HD12  LEU  27          HD12      LEU  27 -12.336  -4.681   3.532
  198   HD13  LEU  27          HD13      LEU  27 -11.702  -3.128   2.962
  199   HD21  LEU  27          HD21      LEU  27  -9.442  -2.793   2.466
  200   HD22  LEU  27          HD22      LEU  27  -8.290  -4.130   2.513
  201   HD23  LEU  27          HD23      LEU  27  -8.881  -3.417   4.013
  202    H    SER  28           HN       SER  28 -10.694  -7.360   1.340
  203    HA   SER  28           HA       SER  28 -13.371  -6.389   1.000
  204    HB2  SER  28           HB2      SER  28 -11.712  -5.624  -0.623
  205    HB3  SER  28           HB1      SER  28 -11.401  -7.280  -1.129
  206    HG   SER  28           HG       SER  28 -13.901  -5.972  -1.364
  207    H    SER  29           HN       SER  29 -12.032  -9.343   1.597
  208    HA   SER  29           HA       SER  29 -12.646 -11.482   1.598
  209    HB2  SER  29           HB2      SER  29 -15.360 -10.354   1.109
  210    HB3  SER  29           HB1      SER  29 -15.045 -11.974   1.731
  211    HG   SER  29           HG       SER  29 -15.344  -9.801   3.114
  212    H    THR  30           HN       THR  30 -12.220  -9.997  -0.985
  213    HA   THR  30           HA       THR  30 -13.635 -11.257  -3.053
  214    HB   THR  30           HB       THR  30 -12.441  -9.146  -3.422
  215    HG1  THR  30           HG1      THR  30 -10.971  -9.949  -5.206
  216   HG21  THR  30          HG21      THR  30 -10.569  -9.422  -1.912
  217   HG22  THR  30          HG22      THR  30  -9.949  -9.074  -3.529
  218   HG23  THR  30          HG23      THR  30  -9.920 -10.724  -2.896
  219    H    ASN  31           HN       ASN  31 -10.849 -12.078  -1.182
  220    HA   ASN  31           HA       ASN  31 -10.351 -14.394  -2.883
  221    HB2  ASN  31           HB2      ASN  31  -8.408 -12.943  -2.441
  222    HB3  ASN  31           HB1      ASN  31  -8.623 -13.165  -0.715
  223   HD21  ASN  31          HD21      ASN  31  -7.943 -14.992   0.185
  224   HD22  ASN  31          HD22      ASN  31  -6.966 -16.201  -0.577
  225    H    VAL  32           HN       VAL  32 -11.741 -13.493  -0.034
  226    HA   VAL  32           HA       VAL  32 -11.636 -15.988   1.361
  227    HB   VAL  32           HB       VAL  32 -13.684 -13.739   1.566
  228   HG11  VAL  32          HG11      VAL  32 -14.242 -14.660   3.767
  229   HG12  VAL  32          HG12      VAL  32 -13.131 -15.999   3.490
  230   HG13  VAL  32          HG13      VAL  32 -14.570 -15.824   2.482
  231   HG21  VAL  32          HG21      VAL  32 -11.406 -13.026   2.083
  232   HG22  VAL  32          HG22      VAL  32 -11.280 -14.305   3.293
  233   HG23  VAL  32          HG23      VAL  32 -12.442 -12.995   3.508
  234    H    GLY  33           HN       GLY  33 -13.557 -14.561  -1.117
  235    HA2  GLY  33           HA2      GLY  33 -14.516 -16.016  -2.784
  236    HA3  GLY  33           HA1      GLY  33 -14.922 -17.141  -1.492
  237    H    SER  34           HN       SER  34 -15.495 -14.033  -0.456
  238    HA   SER  34           HA       SER  34 -18.320 -14.529  -0.470
  239    HB2  SER  34           HB2      SER  34 -16.859 -12.026   0.375
  240    HB3  SER  34           HB1      SER  34 -18.470 -12.539   0.879
  241    HG   SER  34           HG       SER  34 -17.332 -14.488   1.708
  242    H    ASN  35           HN       ASN  35 -16.214 -13.158  -2.635
  243    HA   ASN  35           HA       ASN  35 -17.830 -11.048  -3.707
  244    HB2  ASN  35           HB2      ASN  35 -15.404 -10.967  -3.872
  245    HB3  ASN  35           HB1      ASN  35 -15.391 -12.433  -4.846
  246   HD21  ASN  35          HD21      ASN  35 -14.420 -11.505  -6.570
  247   HD22  ASN  35          HD22      ASN  35 -15.151 -10.337  -7.597
  248    H    THR  36           HN       THR  36 -17.550 -14.454  -4.279
  249    HA   THR  36           HA       THR  36 -18.837 -14.242  -6.833
  250    HB   THR  36           HB       THR  36 -18.580 -16.825  -6.718
  251    HG1  THR  36           HG1      THR  36 -16.433 -16.722  -5.161
  252   HG21  THR  36          HG21      THR  36 -16.166 -15.010  -6.752
  253   HG22  THR  36          HG22      THR  36 -17.218 -15.337  -8.124
  254   HG23  THR  36          HG23      THR  36 -16.240 -16.634  -7.431
  255    H    TYC  37           HN       ATY  37 -19.961 -13.992  -3.939
  256    HA   TYC  37           HA       ATY  37 -22.418 -15.496  -4.432
  257    HB1  TYC  37           HB1      ATY  37 -23.026 -14.740  -2.081
  258    HB2  TYC  37           HB2      ATY  37 -21.399 -14.094  -1.946
  259    HD1  TYC  37           HD1      ATY  37 -19.463 -15.602  -1.827
  260    HD2  TYC  37           HD2      ATY  37 -23.429 -17.099  -1.914
  261    HE1  TYC  37           HE1      ATY  37 -18.653 -17.772  -1.005
  262    HE2  TYC  37           HE2      ATY  37 -22.638 -19.282  -1.097
  263    HH   TYC  37           HH       ATY  37 -19.558 -19.662   0.209
  264   HT21  TYC  37          HT21      ATY  37 -23.196 -14.189  -6.039
  265   HT22  TYC  37          HT22      ATY  37 -23.763 -12.577  -5.785