*HEADER    RNA BINDING PROTEIN                     03-JUL-18   6DZA              
*TITLE     SOLUTION STRUCTURE OF RBFOX2 RRM MIMETIC PEPTIDE CPFOX4               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: CPFOX4;                                                    
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT;                            
*SOURCE   4 ORGANISM_TAXID: 36630                                                
*KEYWDS    PEPTIDOMIMETICS, PEPTIDE STRUCTURE, RNA RECOGNITION, RNA BINDING      
*KEYWDS   2 PROTEIN                                                              
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    Y.-T.SUN,M.D.SHORTRIDGE,G.VARANI                                      
*REVDAT   1   15-MAY-19 6DZA    0                                                
# Restraints file 1: peaklist_rrm04_sort.tbl
!-------------------------------------------------------------------------!
!NOE Table for RRM04 peptide !
!Updated 120816 YTS
!RRM04, 16mer GLY SER LYS ARG PHE ARG PHE pro PRO GLE ILE ILE PHE ASN GLU ARG
!Upper case L-Amino Acid
!Lower case D-Amino Acid
!
!! NOE binning !!
!strong     2.5 0.7 0.7
!medium     3.5 1.2 1.2
!weak       4.5 1.6 1.6
!very weak  5.0 2.0 2.0

!TOTAL NOES                    =
!long range          (j-i >6)  =
!short range    (2 > j-i < 5)  =
!sequential          (i to j)  =
!intraresidue        (i to i)  =

!------------------------------------------------------------------------!

!**backbone**!
!HA-HN
assign  (residue  1   and  name  HA1)   (residue  1   and  name  HN)   2.5  0.7  0.7
assign  (residue  1   and  name  HA1)   (residue  2   and  name  HN)   3.5  1.2  1.2
assign  (residue  1   and  name  HA2)   (residue  1   and  name  HN)   2.5  0.7  0.7
assign  (residue  1   and  name  HA2)   (residue  2   and  name  HN)   3.5  1.2  1.2
assign  (residue  2   and  name  HA)    (residue  2   and  name  HN)   2.5  0.7  0.7
assign  (residue  2   and  name  HA)    (residue  3   and  name  HN)   2.5  0.7  0.7
assign  (residue  3   and  name  HA)    (residue  3   and  name  HN)   2.5  0.7  0.7
assign  (residue  4   and  name  HA)    (residue  12  and  name  HN)   3.5  1.2  1.2
assign  (residue  4   and  name  HA)    (residue  14  and  name  HN)   4.5  1.6  1.6
assign  (residue  4   and  name  HA)    (residue  4   and  name  HN)   3.5  1.2  1.2
assign  (residue  4   and  name  HA)    (residue  5   and  name  HN)   2.5  0.7  0.7
assign  (residue  5   and  name  HA)    (residue  5   and  name  HN)   3.5  1.2  1.2
assign  (residue  5   and  name  HA)    (residue  6   and  name  HN)   2.5  0.7  0.7
assign  (residue  6   and  name  HA)    (residue  6   and  name  HN)   2.5  0.7  0.7
assign  (residue  6   and  name  HA)    (residue  7   and  name  HN)   2.5  0.7  0.7
assign  (residue  8   and  name  HA)    (residue  10  and  name  HN)   3.5  1.2  1.2
assign  (residue  9   and  name  HA)    (residue  10  and  name  HN)   2.5  0.7  0.7
assign  (residue  10  and  name  HA)    (residue  10  and  name  HN)   2.5  0.7  0.7
assign  (residue  10  and  name  HA)    (residue  11  and  name  HN)   2.5  0.7  0.7
assign  (residue  11  and  name  HA)    (residue  11  and  name  HN)   2.5  0.7  0.7
assign  (residue  11  and  name  HA)    (residue  7   and  name  HN)   4.5  1.6  1.6
assign  (residue  12  and  name  HA)    (residue  12  and  name  HN)   2.5  0.7  0.7
assign  (residue  12  and  name  HA)    (residue  13  and  name  HN)   2.5  0.7  0.7
assign  (residue  13  and  name  HA)    (residue  13  and  name  HN)   3.5  1.2  1.2
assign  (residue  13  and  name  HA)    (residue  14  and  name  HN)   2.5  0.7  0.7
assign  (residue  14  and  name  HA)    (residue  14  and  name  HN)   2.5  0.7  0.7
assign  (residue  14  and  name  HA)    (residue  15  and  name  HN)   2.5  0.7  0.7
assign  (residue  15  and  name  HA)    (residue  15  and  name  HN)   2.5  0.7  0.7
assign  (residue  15  and  name  HA)    (residue  16  and  name  HN)   2.5  0.7  0.7
assign  (residue  16  and  name  HA)    (residue  16  and  name  HN)   2.5  0.7  0.7

!HN-HN
assign  (residue  1   and  name  HN)    (residue  2   and  name  HN)   2.5  0.7  0.7
assign  (residue  3   and  name  HN)    (residue  2   and  name  HN)   2.5  0.7  0.7
assign  (residue  5   and  name  HN)    (residue  4   and  name  HN)   3.5  1.2  1.2
assign  (residue  7   and  name  HN)    (residue  6   and  name  HN)   3.5  1.2  1.2
assign  (residue  10  and  name  HN)    (residue  11  and  name  HN)   3.5  1.2  1.2
assign  (residue  10  and  name  HN)    (residue  7   and  name  HN)   4.5  1.6  1.6
assign  (residue  15  and  name  HN)    (residue  14  and  name  HN)   3.5  1.2  1.2
assign  (residue  15  and  name  HN)    (residue  16  and  name  HN)   3.5  1.2  1.2

!HA-HA
assign  (residue  6   and  name  HA)    (residue  11  and  name  HA)   3.5  1.2  1.2
assign  (residue  13  and  name  HA)    (residue  4   and  name  HA)   4.5  1.6  1.6

!HN-CO
assign  (residue  10  and  name  O)    (residue  7   and  name  HN)   2.0  0.5  0.5
assign  (residue  10  and  name  HN)    (residue  7   and  name  O)   2.0  0.5  0.5
assign  (residue  12  and  name  O)    (residue  5   and  name  HN)   2.0  0.5  0.5
assign  (residue  12  and  name  HN)    (residue  5   and  name  O)   2.0  0.5  0.5


!**sidechain**!
!SER	2
assign  (residue  2   and  name  HB1)   (residue  2   and  name  HN)   2.5  0.7  0.7
assign  (residue  2   and  name  HB1)   (residue  3   and  name  HN)   4.5  1.6  1.6
assign  (residue  2   and  name  HB2)   (residue  2   and  name  HN)   3.5  1.2  1.2
assign  (residue  2   and  name  HB2)   (residue  3   and  name  HN)   3.5  1.2  1.2

!LYS	3
assign  (residue  3   and  name  HB#)    (residue  5   and  name  HD#)  2.5  0.7  0.7

!ARG	4
assign  (residue  4   and  name  HA)    (residue  13  and  name  HD#)   3.5  1.2  1.2
assign  (residue  4   and  name  HB#)   (residue  13  and  name  HD#)   3.5  1.2  1.2
assign  (residue  4   and  name  HB#)   (residue  4   and  name  HE)   3.5  1.2  1.2
assign  (residue  4   and  name  HB#)   (residue  4   and  name  HN)   2.5  0.7  0.7
assign  (residue  4   and  name  HB#)   (residue  5   and  name  HN)   3.5  1.2  1.2
assign  (residue  4   and  name  HD#)    (residue  11  and  name  HD#)   4.5  1.6  1.6
assign  (residue  4   and  name  HD#)    (residue  4   and  name  HE)   2.5  0.7  0.7
assign  (residue  4   and  name  HD#)    (residue  4   and  name  HN)   4.5  1.6  1.6
assign  (residue  4   and  name  HG1)   (residue  13  and  name  HD#)   3.5  1.2  1.2
assign  (residue  4   and  name  HG1)   (residue  4   and  name  HE)   3.5  1.2  1.2
assign  (residue  4   and  name  HG1)   (residue  4   and  name  HN)   3.5  1.2  1.2
assign  (residue  4   and  name  HG1)   (residue  5   and  name  HN)   3.5  1.2  1.2
assign  (residue  4   and  name  HG2)   (residue  13  and  name  HD#)   4.5  1.6  1.6
assign  (residue  4   and  name  HG2)   (residue  4   and  name  HE)   3.5  1.2  1.2
assign  (residue  4   and  name  HG2)   (residue  4   and  name  HN)   3.5  1.2  1.2

!PHE	5
assign  (residue  5   and  name  HB1)   (residue  5   and  name  HD#)   2.5  0.7  0.7
assign  (residue  5   and  name  HB1)   (residue  5   and  name  HN)   2.5  0.7  0.7
assign  (residue  5   and  name  HB1)   (residue  6   and  name  HN)   3.5  1.2  1.2
assign  (residue  5   and  name  HB2)   (residue  5   and  name  HD#)   2.5  0.7  0.7
assign  (residue  5   and  name  HB2)   (residue  6   and  name  HN)   3.5  1.2  1.2
assign  (residue  5   and  name  HD#)    (residue  6   and  name  HN)   4.5  1.6  1.6

!ARG	6
assign  (residue  6   and  name  HA)    (residue  6   and  name  HE)   3.5  1.2  1.2
assign  (residue  6   and  name  HB1)   (residue  6   and  name  HN)   2.5  0.7  0.7
assign  (residue  6   and  name  HB1)   (residue  7   and  name  HN)   4.5  1.6  1.6
assign  (residue  6   and  name  HB2)   (residue  6   and  name  HN)   2.5  0.7  0.7
assign  (residue  6   and  name  HB2)   (residue  7   and  name  HN)   3.5  1.2  1.2
assign  (residue  6   and  name  HD#)    (residue  6   and  name  HE)   2.5  0.7  0.7
assign  (residue  6   and  name  HD#)    (residue  6   and  name  HN)   4.5  1.6  1.6
assign  (residue  6   and  name  HG1)   (residue  6   and  name  HE)   3.5  1.2  1.2
assign  (residue  6   and  name  HG1)   (residue  6   and  name  HN)   3.5  1.2  1.2
assign  (residue  6   and  name  HG1)   (residue  7   and  name  HN)   4.5  1.6  1.6
assign  (residue  6   and  name  HG2)   (residue  6   and  name  HE)   3.5  1.2  1.2
assign  (residue  6   and  name  HG2)   (residue  6   and  name  HN)   3.5  1.2  1.2
assign  (residue  6   and  name  HG2)   (residue  7   and  name  HN)   4.5  1.6  1.6

!PHE	7
assign  (residue  7   and  name  HA)    (residue  8   and  name  HD#)   4.5  1.6  1.6
assign  (residue  7   and  name  HB1)   (residue  7   and  name  HD#)   3.5  1.2  1.2
assign  (residue  7   and  name  HB1)   (residue  7   and  name  HN)   2.5  0.7  0.7
assign  (residue  7   and  name  HB2)   (residue  7   and  name  HD#)   3.5  1.2  1.2
assign  (residue  7   and  name  HB2)   (residue  7   and  name  HN)   3.5  1.2  1.2

!pro	8
assign  (residue  8   and  name  HA)    (residue  8   and  name  HB1)  3.5  1.2  1.2
assign  (residue  8   and  name  HA)    (residue  8   and  name  HB2)  2.5  0.7  0.7
assign  (residue  8   and  name  HA)    (residue  8   and  name  HD#)   4.5  1.6  1.6
!assign  (residue  8   and  name  HA)    (residue  8   and  name  HG1)  2.5  0.7  0.7
assign  (residue  8   and  name  HA)    (residue  8   and  name  HG2)  3.5  1.2  1.2
assign  (residue  8   and  name  HA)    (residue  9   and  name  HD1)  2.5  0.7  0.7
assign  (residue  8   and  name  HA)    (residue  9   and  name  HD2)  2.5  0.7  0.7
assign  (residue  8   and  name  HD#)    (residue  7   and  name  HB2)  4.5  1.6  1.6

!PRO	9
assign  (residue  9   and  name  HA)    (residue  9   and  name  HB1)  2.5  0.7  0.7
assign  (residue  9   and  name  HA)    (residue  9   and  name  HB2)  2.5  0.7  0.7
assign  (residue  9   and  name  HA)    (residue  9   and  name  HD1)  4.5  1.6  1.6
assign  (residue  9   and  name  HA)    (residue  9   and  name  HD2)  4.5  1.6  1.6
assign  (residue  9   and  name  HA)    (residue  9   and  name  HG1)  3.5  1.2  1.2
!assign  (residue  9   and  name  HA)    (residue  9   and  name  HG2)  2.5  0.7  0.7
assign  (residue  9   and  name  HD1)   (residue  10  and  name  HN)   4.5  1.6  1.6
assign  (residue  9   and  name  HD2)   (residue  10  and  name  HN)   3.5  1.2  1.2

!GLE	10
assign  (residue  10  and  name  HB#)   (residue  10  and  name  HN)   2.5  0.7  0.7
assign  (residue  10  and  name  HB#)   (residue  11  and  name  HN)   3.5  1.2  1.2
assign  (residue  10  and  name  HG1)   (residue  10  and  name  HN)   3.5  1.2  1.2
assign  (residue  10  and  name  HG2)   (residue  10  and  name  HN)   3.5  1.2  1.2

!ILE	11
assign  (residue  11  and  name  HD#)    (residue  11  and  name  HN)   3.5  1.2  1.2
assign  (residue  11  and  name  HD#)    (residue  13  and  name  HD#)   3.5  1.2  1.2
assign  (residue  11  and  name  HD#)    (residue  5   and  name  HN)   4.5  1.6  1.6
assign  (residue  11  and  name  HD#)    (residue  6   and  name  HE)   3.5  1.2  1.2
assign  (residue  11  and  name  HG1#)   (residue  11  and  name  HN)   3.5  1.2  1.2

!PHE	13
assign  (residue  13  and  name  HB1)   (residue  13  and  name  HD#)   2.5  0.7  0.7
assign  (residue  13  and  name  HB1)   (residue  14  and  name  HN)   3.5  1.2  1.2
assign  (residue  13  and  name  HB2)   (residue  13  and  name  HD#)   2.5  0.7  0.7
assign  (residue  13  and  name  HB2)   (residue  13  and  name  HN)   2.5  0.7  0.7
assign  (residue  13  and  name  HB2)   (residue  14  and  name  HN)   3.5  1.2  1.2
assign  (residue  13  and  name  HD#)    (residue  14  and  name  HN)   3.5  1.2  1.2
assign  (residue  13  and  name  HD#)    (residue  4   and  name  HN)   4.5  1.6  1.6
assign  (residue  13  and  name  HD#)    (residue  6   and  name  HN)   3.5  1.2  1.2

!ASN	14
assign  (residue  14  and  name  HB#)    (residue  14  and  name  HD#)  3.5  1.2  1.2
assign  (residue  14  and  name  HB#)    (residue  14  and  name  HD#)  2.5  0.7  0.7
assign  (residue  14  and  name  HB#)    (residue  14  and  name  HN)   2.5  0.7  0.7
!assign  (residue  14  and  name  HD#)   (residue  14  and  name  HD#)  2.5  0.7  0.7

!GLE	15
assign  (residue  15  and  name  HB1)   (residue  15  and  name  HN)   3.5  1.2  1.2
assign  (residue  15  and  name  HB1)   (residue  16  and  name  HN)   3.5  1.2  1.2
assign  (residue  15  and  name  HB2)   (residue  15  and  name  HN)   3.5  1.2  1.2
assign  (residue  15  and  name  HG#)    (residue  15  and  name  HN)   3.5  1.2  1.2
assign  (residue  15  and  name  HG#)    (residue  16  and  name  HN)   4.5  1.6  1.6

!ARG	16
assign  (residue  16  and  name  HA)    (residue  16  and  name  HE)   4.5  1.6  1.6
assign  (residue  16  and  name  HB1)   (residue  16  and  name  HE)   3.5  1.2  1.2
assign  (residue  16  and  name  HB1)   (residue  16  and  name  HN)   2.5  0.7  0.7
assign  (residue  16  and  name  HB2)   (residue  16  and  name  HE)   4.5  1.6  1.6
assign  (residue  16  and  name  HB2)   (residue  16  and  name  HN)   3.5  1.2  1.2
assign  (residue  16  and  name  HD#)    (residue  16  and  name  HE)   3.5  1.2  1.2
assign  (residue  16  and  name  HE)    (residue  15  and  name  HN)   4.5  1.6  1.6
assign  (residue  16  and  name  HG#)    (residue  16  and  name  HN)   3.5  1.2  1.2
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           HN       GLY   1  -7.515  -1.811   1.014
    2    HA2  GLY   1           HA2      GLY   1  -9.477  -2.669  -0.857
    3    HA3  GLY   1           HA1      GLY   1  -8.133  -1.897  -1.697
    4    H    SER   2           HN       SER   2  -5.925  -2.718  -1.111
    5    HA   SER   2           HA       SER   2  -5.948  -5.568  -0.356
    6    HB2  SER   2           HB2      SER   2  -4.379  -6.058  -2.172
    7    HB3  SER   2           HB1      SER   2  -5.891  -5.419  -2.811
    8    HG   SER   2           HG       SER   2  -3.376  -4.418  -2.965
    9    H    LYS   3           HN       LYS   3  -3.112  -4.239  -1.662
   10    HA   LYS   3           HA       LYS   3  -1.875  -4.216   1.004
   11    HB2  LYS   3           HB2      LYS   3  -0.758  -4.447  -1.789
   12    HB3  LYS   3           HB1      LYS   3   0.270  -4.154  -0.385
   13    HG2  LYS   3           HG2      LYS   3  -1.686  -6.343  -0.049
   14    HG3  LYS   3           HG1      LYS   3  -0.440  -6.643  -1.261
   15    HD2  LYS   3           HD2      LYS   3   1.316  -6.169   0.361
   16    HD3  LYS   3           HD1      LYS   3   0.115  -5.729   1.576
   17    HE2  LYS   3           HE2      LYS   3  -0.809  -8.035   1.464
   18    HE3  LYS   3           HE1      LYS   3   0.455  -8.465   0.311
   19    HZ1  LYS   3           HZ1      LYS   3   1.575  -9.031   2.150
   20    HZ2  LYS   3           HZ2      LYS   3   0.614  -8.074   3.174
   21    HZ3  LYS   3           HZ3      LYS   3   1.882  -7.369   2.290
   22    H    ARG   4           HN       ARG   4  -3.448  -2.034   0.631
   23    HA   ARG   4           HA       ARG   4  -2.054   0.183  -0.524
   24    HB2  ARG   4           HB2      ARG   4  -3.790   1.547   0.617
   25    HB3  ARG   4           HB1      ARG   4  -4.478   0.231  -0.331
   26    HG2  ARG   4           HG2      ARG   4  -5.426  -0.675   1.498
   27    HG3  ARG   4           HG1      ARG   4  -3.895  -0.658   2.368
   28    HD2  ARG   4           HD2      ARG   4  -4.235   1.693   2.974
   29    HD3  ARG   4           HD1      ARG   4  -5.732   1.732   2.047
   30    HE   ARG   4           HE       ARG   4  -5.652  -0.299   4.120
   31   HH11  ARG   4          HH11      ARG   4  -7.156  -0.013   5.797
   32   HH12  ARG   4          HH12      ARG   4  -7.980   1.500   5.966
   33   HH21  ARG   4          HH21      ARG   4  -6.410   2.962   3.242
   34   HH22  ARG   4          HH22      ARG   4  -7.558   3.184   4.519
   35    H    PHE   5           HN       PHE   5   0.033  -0.364   0.627
   36    HA   PHE   5           HA       PHE   5   0.465   1.483   2.746
   37    HB2  PHE   5           HB2      PHE   5   0.629   0.163   4.625
   38    HB3  PHE   5           HB1      PHE   5  -0.671  -0.678   3.785
   39    HD1  PHE   5           HD1      PHE   5   0.662  -2.136   1.662
   40    HD2  PHE   5           HD2      PHE   5   1.947  -1.450   5.704
   41    HE1  PHE   5           HE1      PHE   5   2.043  -4.195   1.574
   42    HE2  PHE   5           HE2      PHE   5   3.327  -3.507   5.614
   43    HZ   PHE   5           HZ       PHE   5   3.375  -4.880   3.549
   44    H    ARG   6           HN       ARG   6   2.723   0.711   3.880
   45    HA   ARG   6           HA       ARG   6   4.771   1.229   2.197
   46    HB2  ARG   6           HB2      ARG   6   4.524   0.267   4.822
   47    HB3  ARG   6           HB1      ARG   6   5.605  -0.863   4.011
   48    HG2  ARG   6           HG2      ARG   6   7.030   0.992   3.269
   49    HG3  ARG   6           HG1      ARG   6   5.927   2.153   4.007
   50    HD2  ARG   6           HD2      ARG   6   6.416   1.349   6.210
   51    HD3  ARG   6           HD1      ARG   6   7.280  -0.050   5.575
   52    HE   ARG   6           HE       ARG   6   8.387   2.526   4.805
   53   HH11  ARG   6          HH11      ARG   6  10.482   2.933   5.586
   54   HH12  ARG   6          HH12      ARG   6  11.149   1.921   6.824
   55   HH21  ARG   6          HH21      ARG   6   8.341  -0.099   7.057
   56   HH22  ARG   6          HH22      ARG   6   9.937   0.205   7.657
   57    H    PHE   7           HN       PHE   7   6.021   0.189   0.718
   58    HA   PHE   7           HA       PHE   7   5.803  -2.691   0.331
   59    HB2  PHE   7           HB2      PHE   7   3.903  -1.433  -0.932
   60    HB3  PHE   7           HB1      PHE   7   5.189  -0.966  -2.043
   61    HD1  PHE   7           HD1      PHE   7   5.892  -2.449  -3.724
   62    HD2  PHE   7           HD2      PHE   7   3.714  -3.957  -0.344
   63    HE1  PHE   7           HE1      PHE   7   5.779  -4.682  -4.795
   64    HE2  PHE   7           HE2      PHE   7   3.601  -6.191  -1.414
   65    HZ   PHE   7           HZ       PHE   7   4.634  -6.554  -3.640
   66    HA   DPR   8           HA       DPR   8   9.937  -2.093  -1.117
   67    HB2  DPR   8           HB1      DPR   8  11.443  -0.994   0.890
   68    HB3  DPR   8           HB2      DPR   8  10.878  -2.675   0.901
   69    HG2  DPR   8           HG1      DPR   8   9.779  -0.281   2.300
   70    HG3  DPR   8           HG2      DPR   8   9.969  -1.942   2.887
   71    HD2  DPR   8           HD1      DPR   8   7.586  -0.905   2.008
   72    HD3  DPR   8           HD2      DPR   8   7.994  -2.634   1.907
   73    HA   PRO   9           HA       PRO   9  11.726   2.174  -1.624
   74    HB2  PRO   9           HB2      PRO   9  11.667   1.178  -4.435
   75    HB3  PRO   9           HB1      PRO   9  12.963   2.019  -3.563
   76    HG2  PRO   9           HG2      PRO   9  13.076  -0.599  -4.048
   77    HG3  PRO   9           HG1      PRO   9  13.709   0.104  -2.550
   78    HD2  PRO   9           HD2      PRO   9  11.224  -1.490  -2.975
   79    HD3  PRO   9           HD1      PRO   9  12.261  -1.376  -1.536
   80    H    GLU  10           HN       GLU  10   8.855   0.688  -2.465
   81    HA   GLU  10           HA       GLU  10   7.711   3.255  -3.345
   82    HB2  GLU  10           HB2      GLU  10   6.238   1.925  -4.927
   83    HB3  GLU  10           HB1      GLU  10   7.932   2.063  -5.404
   84    HG2  GLU  10           HG2      GLU  10   8.417  -0.153  -4.560
   85    HG3  GLU  10           HG1      GLU  10   6.803  -0.289  -3.865
   86    H    ILE  11           HN       ILE  11   5.409   3.426  -2.956
   87    HA   ILE  11           HA       ILE  11   4.239   1.408  -1.184
   88    HB   ILE  11           HB       ILE  11   5.148   2.790   0.485
   89   HG12  ILE  11          HG12      ILE  11   2.497   4.169   0.034
   90   HG13  ILE  11          HG11      ILE  11   2.570   2.466   0.490
   91   HG21  ILE  11          HG21      ILE  11   4.298   5.138  -1.238
   92   HG22  ILE  11          HG22      ILE  11   5.951   4.586  -0.969
   93   HG23  ILE  11          HG23      ILE  11   5.024   5.277   0.363
   94   HD11  ILE  11          HD11      ILE  11   3.220   2.936   2.619
   95   HD12  ILE  11          HD12      ILE  11   2.551   4.532   2.279
   96   HD13  ILE  11          HD13      ILE  11   4.282   4.247   2.106
   97    H    ILE  12           HN       ILE  12   1.996   1.424  -1.129
   98    HA   ILE  12           HA       ILE  12   0.673   3.264  -3.034
   99    HB   ILE  12           HB       ILE  12   0.694   1.128  -4.094
  100   HG12  ILE  12          HG12      ILE  12  -1.972   1.036  -2.710
  101   HG13  ILE  12          HG11      ILE  12  -1.567   2.428  -3.716
  102   HG21  ILE  12          HG21      ILE  12  -0.637  -0.623  -2.348
  103   HG22  ILE  12          HG22      ILE  12   0.574   0.182  -1.351
  104   HG23  ILE  12          HG23      ILE  12   1.065  -0.684  -2.807
  105   HD11  ILE  12          HD11      ILE  12  -1.060  -0.297  -4.834
  106   HD12  ILE  12          HD12      ILE  12  -1.527   1.186  -5.664
  107   HD13  ILE  12          HD13      ILE  12  -2.729   0.267  -4.758
  108    H    PHE  13           HN       PHE  13  -0.937   4.423  -2.198
  109    HA   PHE  13           HA       PHE  13  -2.473   3.389   0.067
  110    HB2  PHE  13           HB2      PHE  13  -0.389   4.880   0.746
  111    HB3  PHE  13           HB1      PHE  13  -1.482   6.194   0.309
  112    HD1  PHE  13           HD1      PHE  13  -3.346   6.773   1.685
  113    HD2  PHE  13           HD2      PHE  13  -1.093   3.206   2.490
  114    HE1  PHE  13           HE1      PHE  13  -4.527   6.516   3.850
  115    HE2  PHE  13           HE2      PHE  13  -2.274   2.949   4.656
  116    HZ   PHE  13           HZ       PHE  13  -3.991   4.604   5.336
  117    H    ASN  14           HN       ASN  14  -4.567   3.770  -0.263
  118    HA   ASN  14           HA       ASN  14  -5.775   6.152  -0.956
  119    HB2  ASN  14           HB2      ASN  14  -4.638   4.749  -3.271
  120    HB3  ASN  14           HB1      ASN  14  -6.349   5.136  -3.443
  121   HD21  ASN  14          HD21      ASN  14  -6.758   7.563  -2.434
  122   HD22  ASN  14          HD22      ASN  14  -5.690   8.727  -3.056
  123    H    GLU  15           HN       GLU  15  -7.247   5.301   0.534
  124    HA   GLU  15           HA       GLU  15  -9.148   4.208   1.213
  125    HB2  GLU  15           HB2      GLU  15  -9.428   4.679  -1.598
  126    HB3  GLU  15           HB1      GLU  15 -10.138   3.112  -1.211
  127    HG2  GLU  15           HG2      GLU  15 -10.729   5.677   0.292
  128    HG3  GLU  15           HG1      GLU  15 -11.759   5.000  -0.969
  129    H    ARG  16           HN       ARG  16  -9.230   2.326   2.240
  130    HA   ARG  16           HA       ARG  16  -7.529   0.222   2.024
  131    HB2  ARG  16           HB2      ARG  16  -9.509  -1.200   2.907
  132    HB3  ARG  16           HB1      ARG  16  -8.960   0.162   3.881
  133    HG2  ARG  16           HG2      ARG  16 -10.999   0.857   1.863
  134    HG3  ARG  16           HG1      ARG  16 -11.563  -0.249   3.113
  135    HD2  ARG  16           HD2      ARG  16 -11.110   1.277   4.845
  136    HD3  ARG  16           HD1      ARG  16 -10.016   2.231   3.848
  137    HE   ARG  16           HE       ARG  16 -12.337   2.565   2.542
  138   HH11  ARG  16          HH11      ARG  16 -13.946   4.081   3.060
  139   HH12  ARG  16          HH12      ARG  16 -14.121   4.627   4.694
  140   HH21  ARG  16          HH21      ARG  16 -11.521   2.679   5.905
  141   HH22  ARG  16          HH22      ARG  16 -12.748   3.834   6.304
  Start of MODEL    2
    1    H1   GLY   1           HN       GLY   1  -8.843   0.212  -0.278
    2    HA2  GLY   1           HA2      GLY   1  -7.878  -1.341   1.985
    3    HA3  GLY   1           HA1      GLY   1  -9.047  -2.164   0.956
    4    H    SER   2           HN       SER   2  -8.501  -2.605  -1.233
    5    HA   SER   2           HA       SER   2  -7.027  -3.527  -2.757
    6    HB2  SER   2           HB2      SER   2  -6.223  -1.827  -3.994
    7    HB3  SER   2           HB1      SER   2  -6.860  -0.759  -2.747
    8    HG   SER   2           HG       SER   2  -4.700  -1.412  -1.692
    9    H    LYS   3           HN       LYS   3  -6.379  -3.806   0.206
   10    HA   LYS   3           HA       LYS   3  -4.660  -4.564   1.544
   11    HB2  LYS   3           HB2      LYS   3  -4.313  -5.863  -1.117
   12    HB3  LYS   3           HB1      LYS   3  -3.023  -6.061   0.070
   13    HG2  LYS   3           HG2      LYS   3  -4.462  -7.099   1.634
   14    HG3  LYS   3           HG1      LYS   3  -5.912  -6.532   0.805
   15    HD2  LYS   3           HD2      LYS   3  -5.353  -7.977  -1.132
   16    HD3  LYS   3           HD1      LYS   3  -3.939  -8.573  -0.263
   17    HE2  LYS   3           HE2      LYS   3  -5.470 -10.216   0.299
   18    HE3  LYS   3           HE1      LYS   3  -5.739  -9.083   1.624
   19    HZ1  LYS   3           HZ1      LYS   3  -7.422  -9.682  -0.683
   20    HZ2  LYS   3           HZ2      LYS   3  -7.396  -8.070  -0.148
   21    HZ3  LYS   3           HZ3      LYS   3  -7.861  -9.313   0.913
   22    H    ARG   4           HN       ARG   4  -3.919  -2.284   1.727
   23    HA   ARG   4           HA       ARG   4  -2.042  -0.980   0.237
   24    HB2  ARG   4           HB2      ARG   4  -1.285   0.099   2.298
   25    HB3  ARG   4           HB1      ARG   4  -3.039  -0.078   2.313
   26    HG2  ARG   4           HG2      ARG   4  -2.227  -2.450   3.438
   27    HG3  ARG   4           HG1      ARG   4  -1.015  -1.324   4.051
   28    HD2  ARG   4           HD2      ARG   4  -2.775  -1.226   5.636
   29    HD3  ARG   4           HD1      ARG   4  -2.984   0.215   4.644
   30    HE   ARG   4           HE       ARG   4  -4.568  -1.558   3.375
   31   HH11  ARG   4          HH11      ARG   4  -6.721  -2.021   3.933
   32   HH12  ARG   4          HH12      ARG   4  -7.250  -1.811   5.569
   33   HH21  ARG   4          HH21      ARG   4  -4.160  -0.728   6.710
   34   HH22  ARG   4          HH22      ARG   4  -5.800  -1.080   7.141
   35    H    PHE   5           HN       PHE   5   0.113  -1.113  -0.165
   36    HA   PHE   5           HA       PHE   5   1.643  -3.245   1.193
   37    HB2  PHE   5           HB2      PHE   5   0.775  -3.353  -1.454
   38    HB3  PHE   5           HB1      PHE   5   2.457  -2.837  -1.566
   39    HD1  PHE   5           HD1      PHE   5   4.269  -4.291  -0.910
   40    HD2  PHE   5           HD2      PHE   5   0.183  -5.478  -0.316
   41    HE1  PHE   5           HE1      PHE   5   5.013  -6.606  -0.421
   42    HE2  PHE   5           HE2      PHE   5   0.928  -7.793   0.173
   43    HZ   PHE   5           HZ       PHE   5   3.342  -8.357   0.120
   44    H    ARG   6           HN       ARG   6   2.993  -2.032   2.407
   45    HA   ARG   6           HA       ARG   6   4.255   0.349   1.279
   46    HB2  ARG   6           HB2      ARG   6   3.551  -0.536   3.895
   47    HB3  ARG   6           HB1      ARG   6   5.300  -0.318   3.849
   48    HG2  ARG   6           HG2      ARG   6   5.032   1.948   2.976
   49    HG3  ARG   6           HG1      ARG   6   3.282   1.738   2.903
   50    HD2  ARG   6           HD2      ARG   6   4.272   2.967   4.962
   51    HD3  ARG   6           HD1      ARG   6   3.061   1.720   5.245
   52    HE   ARG   6           HE       ARG   6   5.813   0.786   5.307
   53   HH11  ARG   6          HH11      ARG   6   6.499  -0.019   7.317
   54   HH12  ARG   6          HH12      ARG   6   5.544   0.273   8.732
   55   HH21  ARG   6          HH21      ARG   6   3.102   2.061   7.040
   56   HH22  ARG   6          HH22      ARG   6   3.621   1.450   8.576
   57    H    PHE   7           HN       PHE   7   6.435   0.553   0.861
   58    HA   PHE   7           HA       PHE   7   8.340  -1.500   1.518
   59    HB2  PHE   7           HB2      PHE   7   6.925  -2.360  -0.486
   60    HB3  PHE   7           HB1      PHE   7   7.860  -1.198  -1.425
   61    HD1  PHE   7           HD1      PHE   7  10.025  -1.738  -2.166
   62    HD2  PHE   7           HD2      PHE   7   8.250  -3.994   1.030
   63    HE1  PHE   7           HE1      PHE   7  11.937  -3.316  -2.218
   64    HE2  PHE   7           HE2      PHE   7  10.162  -5.573   0.977
   65    HZ   PHE   7           HZ       PHE   7  12.006  -5.234  -0.647
   66    HA   DPR   8           HA       DPR   8  11.083   2.029   1.407
   67    HB2  DPR   8           HB1      DPR   8   8.794   3.963   1.564
   68    HB3  DPR   8           HB2      DPR   8  10.363   4.008   2.392
   69    HG2  DPR   8           HG1      DPR   8   8.119   3.157   3.594
   70    HG3  DPR   8           HG2      DPR   8   9.710   2.474   3.963
   71    HD2  DPR   8           HD1      DPR   8   7.425   1.258   2.547
   72    HD3  DPR   8           HD2      DPR   8   8.830   0.471   3.300
   73    HA   PRO   9           HA       PRO   9  11.114   3.944  -2.636
   74    HB2  PRO   9           HB2      PRO   9  12.321   1.951  -4.111
   75    HB3  PRO   9           HB1      PRO   9  13.192   3.066  -3.043
   76    HG2  PRO   9           HG2      PRO   9  12.336   0.260  -2.556
   77    HG3  PRO   9           HG1      PRO   9  13.833   1.084  -2.087
   78    HD2  PRO   9           HD2      PRO   9  11.807   0.636  -0.327
   79    HD3  PRO   9           HD1      PRO   9  12.875   2.050  -0.211
   80    H    GLU  10           HN       GLU  10   8.728   2.353  -1.804
   81    HA   GLU  10           HA       GLU  10   7.288   2.357  -4.194
   82    HB2  GLU  10           HB2      GLU  10   8.383   0.484  -5.058
   83    HB3  GLU  10           HB1      GLU  10   8.539  -0.278  -3.475
   84    HG2  GLU  10           HG2      GLU  10   6.286  -0.943  -3.432
   85    HG3  GLU  10           HG1      GLU  10   5.819   0.234  -4.659
   86    H    ILE  11           HN       ILE  11   5.256   2.656  -3.536
   87    HA   ILE  11           HA       ILE  11   4.264   1.140  -1.219
   88    HB   ILE  11           HB       ILE  11   5.004   3.336  -0.375
   89   HG12  ILE  11          HG12      ILE  11   1.986   3.340  -0.512
   90   HG13  ILE  11          HG11      ILE  11   2.861   2.109   0.399
   91   HG21  ILE  11          HG21      ILE  11   4.182   4.278  -2.825
   92   HG22  ILE  11          HG22      ILE  11   4.535   5.294  -1.427
   93   HG23  ILE  11          HG23      ILE  11   2.873   4.814  -1.771
   94   HD11  ILE  11          HD11      ILE  11   3.967   3.845   1.731
   95   HD12  ILE  11          HD12      ILE  11   2.216   4.031   1.832
   96   HD13  ILE  11          HD13      ILE  11   3.157   5.101   0.793
   97    H    ILE  12           HN       ILE  12   2.079   0.699  -1.252
   98    HA   ILE  12           HA       ILE  12   0.560   1.635  -3.608
   99    HB   ILE  12           HB       ILE  12   0.616  -1.185  -2.504
  100   HG12  ILE  12          HG12      ILE  12   1.513  -0.129  -5.203
  101   HG13  ILE  12          HG11      ILE  12   2.615  -0.460  -3.866
  102   HG21  ILE  12          HG21      ILE  12  -0.644  -1.101  -5.006
  103   HG22  ILE  12          HG22      ILE  12  -1.297   0.284  -4.131
  104   HG23  ILE  12          HG23      ILE  12  -1.429  -1.335  -3.444
  105   HD11  ILE  12          HD11      ILE  12   2.574  -2.406  -5.314
  106   HD12  ILE  12          HD12      ILE  12   0.811  -2.454  -5.264
  107   HD13  ILE  12          HD13      ILE  12   1.744  -2.815  -3.812
  108    H    PHE  13           HN       PHE  13   0.177   3.046  -1.445
  109    HA   PHE  13           HA       PHE  13  -1.825   1.901   0.311
  110    HB2  PHE  13           HB2      PHE  13  -0.101   4.210   0.306
  111    HB3  PHE  13           HB1      PHE  13  -1.765   4.702   0.619
  112    HD1  PHE  13           HD1      PHE  13  -2.567   4.569   2.811
  113    HD2  PHE  13           HD2      PHE  13   0.661   2.007   1.594
  114    HE1  PHE  13           HE1      PHE  13  -2.385   3.698   5.125
  115    HE2  PHE  13           HE2      PHE  13   0.842   1.137   3.908
  116    HZ   PHE  13           HZ       PHE  13  -0.681   1.982   5.674
  117    H    ASN  14           HN       ASN  14  -3.999   2.360   0.338
  118    HA   ASN  14           HA       ASN  14  -5.065   4.089  -1.798
  119    HB2  ASN  14           HB2      ASN  14  -5.670   1.192  -1.308
  120    HB3  ASN  14           HB1      ASN  14  -6.920   2.249  -1.962
  121   HD21  ASN  14          HD21      ASN  14  -6.543   0.662  -3.899
  122   HD22  ASN  14          HD22      ASN  14  -5.350   1.115  -5.019
  123    H    GLU  15           HN       GLU  15  -7.179   4.910  -1.386
  124    HA   GLU  15           HA       GLU  15  -7.704   5.280   1.449
  125    HB2  GLU  15           HB2      GLU  15  -9.087   6.416  -0.995
  126    HB3  GLU  15           HB1      GLU  15  -9.394   6.903   0.673
  127    HG2  GLU  15           HG2      GLU  15  -7.465   8.108   0.814
  128    HG3  GLU  15           HG1      GLU  15  -6.551   6.942  -0.141
  129    H    ARG  16           HN       ARG  16  -8.115   2.698   1.093
  130    HA   ARG  16           HA       ARG  16 -10.815   2.293   1.811
  131    HB2  ARG  16           HB2      ARG  16 -11.454   2.575  -0.454
  132    HB3  ARG  16           HB1      ARG  16 -10.074   1.646  -1.040
  133    HG2  ARG  16           HG2      ARG  16 -11.023  -0.392  -0.465
  134    HG3  ARG  16           HG1      ARG  16 -12.013   0.313   0.814
  135    HD2  ARG  16           HD2      ARG  16 -13.330  -0.389  -1.208
  136    HD3  ARG  16           HD1      ARG  16 -13.505   1.316  -0.802
  137    HE   ARG  16           HE       ARG  16 -11.415   0.743  -2.736
  138   HH11  ARG  16          HH11      ARG  16 -11.761   1.617  -4.804
  139   HH12  ARG  16          HH12      ARG  16 -13.324   2.230  -5.229
  140   HH21  ARG  16          HH21      ARG  16 -14.743   1.491  -2.153
  141   HH22  ARG  16          HH22      ARG  16 -15.012   2.159  -3.728
  Start of MODEL    3
    1    H1   GLY   1           HN       GLY   1  -9.594  -1.237  -1.561
    2    HA2  GLY   1           HA2      GLY   1 -10.196  -3.299  -2.626
    3    HA3  GLY   1           HA1      GLY   1 -10.282  -2.442  -4.163
    4    H    SER   2           HN       SER   2  -7.809  -2.713  -1.601
    5    HA   SER   2           HA       SER   2  -5.989  -4.335  -2.910
    6    HB2  SER   2           HB2      SER   2  -5.585  -2.961  -4.717
    7    HB3  SER   2           HB1      SER   2  -5.918  -1.489  -3.808
    8    HG   SER   2           HG       SER   2  -3.578  -2.858  -4.166
    9    H    LYS   3           HN       LYS   3  -5.617  -4.940  -0.788
   10    HA   LYS   3           HA       LYS   3  -5.173  -3.547   1.476
   11    HB2  LYS   3           HB2      LYS   3  -3.380  -5.296   2.029
   12    HB3  LYS   3           HB1      LYS   3  -4.986  -5.898   1.617
   13    HG2  LYS   3           HG2      LYS   3  -3.297  -5.528  -0.743
   14    HG3  LYS   3           HG1      LYS   3  -2.603  -6.668   0.409
   15    HD2  LYS   3           HD2      LYS   3  -4.735  -7.917   0.459
   16    HD3  LYS   3           HD1      LYS   3  -5.420  -6.786  -0.709
   17    HE2  LYS   3           HE2      LYS   3  -4.637  -8.187  -2.302
   18    HE3  LYS   3           HE1      LYS   3  -3.039  -7.560  -1.901
   19    HZ1  LYS   3           HZ1      LYS   3  -3.637 -10.123  -1.763
   20    HZ2  LYS   3           HZ2      LYS   3  -4.092  -9.670  -0.190
   21    HZ3  LYS   3           HZ3      LYS   3  -2.504  -9.398  -0.730
   22    H    ARG   4           HN       ARG   4  -3.969  -1.853   2.002
   23    HA   ARG   4           HA       ARG   4  -1.968  -0.716   0.409
   24    HB2  ARG   4           HB2      ARG   4  -1.445   0.681   2.317
   25    HB3  ARG   4           HB1      ARG   4  -3.193   0.456   2.251
   26    HG2  ARG   4           HG2      ARG   4  -2.637  -1.625   3.814
   27    HG3  ARG   4           HG1      ARG   4  -1.210  -0.661   4.193
   28    HD2  ARG   4           HD2      ARG   4  -2.790   0.055   5.787
   29    HD3  ARG   4           HD1      ARG   4  -2.867   1.295   4.540
   30    HE   ARG   4           HE       ARG   4  -4.993   0.503   3.924
   31   HH11  ARG   4          HH11      ARG   4  -6.889  -0.631   4.437
   32   HH12  ARG   4          HH12      ARG   4  -6.850  -1.880   5.636
   33   HH21  ARG   4          HH21      ARG   4  -3.465  -1.520   6.290
   34   HH22  ARG   4          HH22      ARG   4  -4.915  -2.381   6.684
   35    H    PHE   5           HN       PHE   5   0.081  -1.249   0.035
   36    HA   PHE   5           HA       PHE   5   1.467  -2.980   1.994
   37    HB2  PHE   5           HB2      PHE   5   0.657  -3.720  -0.585
   38    HB3  PHE   5           HB1      PHE   5   2.387  -3.404  -0.713
   39    HD1  PHE   5           HD1      PHE   5  -0.169  -5.274   1.264
   40    HD2  PHE   5           HD2      PHE   5   3.978  -4.907   0.196
   41    HE1  PHE   5           HE1      PHE   5   0.317  -7.426   2.398
   42    HE2  PHE   5           HE2      PHE   5   4.461  -7.058   1.331
   43    HZ   PHE   5           HZ       PHE   5   2.630  -8.317   2.432
   44    H    ARG   6           HN       ARG   6   3.029  -1.772   2.851
   45    HA   ARG   6           HA       ARG   6   4.368   0.270   1.244
   46    HB2  ARG   6           HB2      ARG   6   3.687   0.059   3.959
   47    HB3  ARG   6           HB1      ARG   6   5.444  -0.084   3.909
   48    HG2  ARG   6           HG2      ARG   6   5.469   1.966   2.415
   49    HG3  ARG   6           HG1      ARG   6   3.751   2.153   2.767
   50    HD2  ARG   6           HD2      ARG   6   6.032   2.195   4.758
   51    HD3  ARG   6           HD1      ARG   6   4.991   3.542   4.312
   52    HE   ARG   6           HE       ARG   6   3.287   1.578   5.256
   53   HH11  ARG   6          HH11      ARG   6   2.624   1.534   7.428
   54   HH12  ARG   6          HH12      ARG   6   3.599   2.291   8.642
   55   HH21  ARG   6          HH21      ARG   6   6.028   3.352   6.405
   56   HH22  ARG   6          HH22      ARG   6   5.527   3.322   8.063
   57    H    PHE   7           HN       PHE   7   6.148  -0.201   0.147
   58    HA   PHE   7           HA       PHE   7   8.007  -2.230   1.211
   59    HB2  PHE   7           HB2      PHE   7   6.342  -2.696  -0.919
   60    HB3  PHE   7           HB1      PHE   7   7.809  -2.159  -1.723
   61    HD1  PHE   7           HD1      PHE   7   6.762  -4.354   1.130
   62    HD2  PHE   7           HD2      PHE   7   9.454  -3.766  -2.165
   63    HE1  PHE   7           HE1      PHE   7   7.789  -6.566   1.576
   64    HE2  PHE   7           HE2      PHE   7  10.482  -5.979  -1.719
   65    HZ   PHE   7           HZ       PHE   7   9.649  -7.378   0.152
   66    HA   DPR   8           HA       DPR   8  11.060   0.816   0.251
   67    HB2  DPR   8           HB1      DPR   8  10.665   3.033   1.796
   68    HB3  DPR   8           HB2      DPR   8  11.236   1.485   2.449
   69    HG2  DPR   8           HG1      DPR   8   8.512   2.690   2.500
   70    HG3  DPR   8           HG2      DPR   8   9.365   1.775   3.754
   71    HD2  DPR   8           HD1      DPR   8   7.424   0.717   2.099
   72    HD3  DPR   8           HD2      DPR   8   8.695  -0.246   2.884
   73    HA   PRO   9           HA       PRO   9   9.962   4.793  -1.867
   74    HB2  PRO   9           HB2      PRO   9  11.382   3.314  -4.038
   75    HB3  PRO   9           HB1      PRO   9  11.568   4.998  -3.513
   76    HG2  PRO   9           HG2      PRO   9  13.367   3.136  -2.888
   77    HG3  PRO   9           HG1      PRO   9  12.951   4.447  -1.771
   78    HD2  PRO   9           HD2      PRO   9  12.203   1.562  -1.648
   79    HD3  PRO   9           HD1      PRO   9  12.449   2.723  -0.325
   80    H    GLU  10           HN       GLU  10   9.044   1.590  -2.230
   81    HA   GLU  10           HA       GLU  10   7.198   2.191  -4.459
   82    HB2  GLU  10           HB2      GLU  10   8.111  -0.474  -3.347
   83    HB3  GLU  10           HB1      GLU  10   6.982  -0.258  -4.686
   84    HG2  GLU  10           HG2      GLU  10   8.741  -0.160  -6.082
   85    HG3  GLU  10           HG1      GLU  10   9.219   1.347  -5.301
   86    H    ILE  11           HN       ILE  11   5.746   3.337  -3.035
   87    HA   ILE  11           HA       ILE  11   4.451   1.788  -0.921
   88    HB   ILE  11           HB       ILE  11   5.001   4.145  -0.491
   89   HG12  ILE  11          HG12      ILE  11   2.001   3.872  -0.767
   90   HG13  ILE  11          HG11      ILE  11   2.916   2.981   0.450
   91   HG21  ILE  11          HG21      ILE  11   4.528   4.676  -3.029
   92   HG22  ILE  11          HG22      ILE  11   4.227   5.908  -1.804
   93   HG23  ILE  11          HG23      ILE  11   2.886   4.967  -2.456
   94   HD11  ILE  11          HD11      ILE  11   2.971   5.996   0.132
   95   HD12  ILE  11          HD12      ILE  11   3.750   5.061   1.407
   96   HD13  ILE  11          HD13      ILE  11   1.990   5.135   1.318
   97    H    ILE  12           HN       ILE  12   2.266   1.232  -0.907
   98    HA   ILE  12           HA       ILE  12   0.780   1.623  -3.422
   99    HB   ILE  12           HB       ILE  12   0.739  -1.001  -1.942
  100   HG12  ILE  12          HG12      ILE  12   2.545  -0.156  -4.232
  101   HG13  ILE  12          HG11      ILE  12   3.061  -0.629  -2.612
  102   HG21  ILE  12          HG21      ILE  12  -0.927  -0.032  -3.828
  103   HG22  ILE  12          HG22      ILE  12  -0.514  -1.743  -3.719
  104   HG23  ILE  12          HG23      ILE  12   0.323  -0.706  -4.875
  105   HD11  ILE  12          HD11      ILE  12   3.312  -2.674  -3.614
  106   HD12  ILE  12          HD12      ILE  12   2.125  -2.321  -4.869
  107   HD13  ILE  12          HD13      ILE  12   1.590  -2.800  -3.259
  108    H    PHE  13           HN       PHE  13   0.400   3.194  -1.238
  109    HA   PHE  13           HA       PHE  13  -1.659   2.131   0.485
  110    HB2  PHE  13           HB2      PHE  13  -0.168   4.681   0.213
  111    HB3  PHE  13           HB1      PHE  13  -1.780   4.784   0.921
  112    HD1  PHE  13           HD1      PHE  13  -1.394   5.088   3.231
  113    HD2  PHE  13           HD2      PHE  13   0.704   1.996   1.111
  114    HE1  PHE  13           HE1      PHE  13  -0.509   4.216   5.377
  115    HE2  PHE  13           HE2      PHE  13   1.590   1.125   3.257
  116    HZ   PHE  13           HZ       PHE  13   0.983   2.234   5.390
  117    H    ASN  14           HN       ASN  14  -3.631   1.768  -0.299
  118    HA   ASN  14           HA       ASN  14  -5.174   3.900  -1.438
  119    HB2  ASN  14           HB2      ASN  14  -4.069   1.749  -3.201
  120    HB3  ASN  14           HB1      ASN  14  -5.695   2.354  -3.512
  121   HD21  ASN  14          HD21      ASN  14  -5.558   5.045  -3.082
  122   HD22  ASN  14          HD22      ASN  14  -4.370   5.766  -4.058
  123    H    GLU  15           HN       GLU  15  -6.409   3.323   0.424
  124    HA   GLU  15           HA       GLU  15  -7.511   0.700   0.749
  125    HB2  GLU  15           HB2      GLU  15  -8.059   3.385   1.994
  126    HB3  GLU  15           HB1      GLU  15  -9.090   1.997   2.338
  127    HG2  GLU  15           HG2      GLU  15  -7.108   0.708   3.061
  128    HG3  GLU  15           HG1      GLU  15  -6.086   2.107   2.736
  129    H    ARG  16           HN       ARG  16  -8.205   0.608  -1.586
  130    HA   ARG  16           HA       ARG  16 -11.051   1.156  -1.723
  131    HB2  ARG  16           HB2      ARG  16  -9.522   3.148  -2.681
  132    HB3  ARG  16           HB1      ARG  16  -9.554   2.111  -4.106
  133    HG2  ARG  16           HG2      ARG  16 -12.019   2.071  -4.031
  134    HG3  ARG  16           HG1      ARG  16 -11.996   3.098  -2.596
  135    HD2  ARG  16           HD2      ARG  16 -10.486   4.078  -4.966
  136    HD3  ARG  16           HD1      ARG  16 -12.243   4.099  -5.081
  137    HE   ARG  16           HE       ARG  16 -10.601   5.739  -3.322
  138   HH11  ARG  16          HH11      ARG  16 -11.743   7.336  -2.180
  139   HH12  ARG  16          HH12      ARG  16 -13.474   7.287  -2.130
  140   HH21  ARG  16          HH21      ARG  16 -13.713   4.420  -4.065
  141   HH22  ARG  16          HH22      ARG  16 -14.589   5.637  -3.198
  Start of MODEL    4
    1    H1   GLY   1           HN       GLY   1  -9.440   0.983  -0.356
    2    HA2  GLY   1           HA2      GLY   1 -10.234  -1.002   1.669
    3    HA3  GLY   1           HA1      GLY   1 -11.209  -0.482   0.297
    4    H    SER   2           HN       SER   2  -7.820  -1.543   0.366
    5    HA   SER   2           HA       SER   2  -8.565  -3.919  -1.213
    6    HB2  SER   2           HB2      SER   2  -6.657  -3.529  -2.698
    7    HB3  SER   2           HB1      SER   2  -7.780  -2.174  -2.761
    8    HG   SER   2           HG       SER   2  -5.191  -2.276  -1.908
    9    H    LYS   3           HN       LYS   3  -5.284  -3.104  -0.935
   10    HA   LYS   3           HA       LYS   3  -4.815  -4.505   1.558
   11    HB2  LYS   3           HB2      LYS   3  -3.150  -6.018   0.066
   12    HB3  LYS   3           HB1      LYS   3  -4.780  -6.527   0.505
   13    HG2  LYS   3           HG2      LYS   3  -5.664  -5.728  -1.605
   14    HG3  LYS   3           HG1      LYS   3  -4.109  -5.014  -2.033
   15    HD2  LYS   3           HD2      LYS   3  -3.397  -6.972  -2.883
   16    HD3  LYS   3           HD1      LYS   3  -3.736  -7.791  -1.358
   17    HE2  LYS   3           HE2      LYS   3  -6.119  -8.000  -2.021
   18    HE3  LYS   3           HE1      LYS   3  -5.741  -7.238  -3.566
   19    HZ1  LYS   3           HZ1      LYS   3  -3.900  -9.271  -3.230
   20    HZ2  LYS   3           HZ2      LYS   3  -5.207  -9.236  -4.315
   21    HZ3  LYS   3           HZ3      LYS   3  -5.394  -9.934  -2.778
   22    H    ARG   4           HN       ARG   4  -3.869  -2.440   2.022
   23    HA   ARG   4           HA       ARG   4  -1.876  -1.149   0.580
   24    HB2  ARG   4           HB2      ARG   4  -2.150  -1.362   3.588
   25    HB3  ARG   4           HB1      ARG   4  -1.192  -0.156   2.729
   26    HG2  ARG   4           HG2      ARG   4  -3.018   1.128   2.465
   27    HG3  ARG   4           HG1      ARG   4  -3.822  -0.181   1.599
   28    HD2  ARG   4           HD2      ARG   4  -3.711   0.054   4.618
   29    HD3  ARG   4           HD1      ARG   4  -5.075   0.572   3.632
   30    HE   ARG   4           HE       ARG   4  -4.285  -2.183   3.203
   31   HH11  ARG   4          HH11      ARG   4  -5.818  -3.736   3.835
   32   HH12  ARG   4          HH12      ARG   4  -7.148  -3.271   4.843
   33   HH21  ARG   4          HH21      ARG   4  -6.181   0.053   5.041
   34   HH22  ARG   4          HH22      ARG   4  -7.353  -1.126   5.526
   35    H    PHE   5           HN       PHE   5   0.156  -1.622   0.069
   36    HA   PHE   5           HA       PHE   5   1.636  -3.547   1.740
   37    HB2  PHE   5           HB2      PHE   5   0.552  -4.245  -0.702
   38    HB3  PHE   5           HB1      PHE   5   2.208  -3.806  -1.119
   39    HD1  PHE   5           HD1      PHE   5   4.122  -4.857   0.195
   40    HD2  PHE   5           HD2      PHE   5   0.073  -6.275   0.425
   41    HE1  PHE   5           HE1      PHE   5   4.928  -7.009   1.129
   42    HE2  PHE   5           HE2      PHE   5   0.880  -8.426   1.359
   43    HZ   PHE   5           HZ       PHE   5   3.308  -8.794   1.710
   44    H    ARG   6           HN       ARG   6   3.063  -2.097   2.576
   45    HA   ARG   6           HA       ARG   6   4.279  -0.010   1.049
   46    HB2  ARG   6           HB2      ARG   6   4.241  -0.924   3.796
   47    HB3  ARG   6           HB1      ARG   6   5.877  -0.512   3.289
   48    HG2  ARG   6           HG2      ARG   6   5.049   1.680   2.457
   49    HG3  ARG   6           HG1      ARG   6   3.434   1.267   3.034
   50    HD2  ARG   6           HD2      ARG   6   5.616   2.396   4.504
   51    HD3  ARG   6           HD1      ARG   6   3.987   2.050   5.066
   52    HE   ARG   6           HE       ARG   6   6.328   0.295   5.323
   53   HH11  ARG   6          HH11      ARG   6   6.095  -1.328   6.882
   54   HH12  ARG   6          HH12      ARG   6   4.549  -1.614   7.609
   55   HH21  ARG   6          HH21      ARG   6   2.935   0.866   5.812
   56   HH22  ARG   6          HH22      ARG   6   2.769  -0.375   7.006
   57    H    PHE   7           HN       PHE   7   6.556   0.166   0.553
   58    HA   PHE   7           HA       PHE   7   8.277  -2.134   0.626
   59    HB2  PHE   7           HB2      PHE   7   6.705  -2.738  -1.215
   60    HB3  PHE   7           HB1      PHE   7   7.226  -1.292  -2.078
   61    HD1  PHE   7           HD1      PHE   7   9.153  -1.343  -3.425
   62    HD2  PHE   7           HD2      PHE   7   8.548  -4.401  -0.471
   63    HE1  PHE   7           HE1      PHE   7  11.128  -2.569  -4.290
   64    HE2  PHE   7           HE2      PHE   7  10.523  -5.628  -1.336
   65    HZ   PHE   7           HZ       PHE   7  11.812  -4.711  -3.245
   66    HA   DPR   8           HA       DPR   8  11.226   1.108   0.030
   67    HB2  DPR   8           HB1      DPR   8  10.946   2.970   2.017
   68    HB3  DPR   8           HB2      DPR   8  11.619   1.350   2.286
   69    HG2  DPR   8           HG1      DPR   8   8.877   2.393   2.828
   70    HG3  DPR   8           HG2      DPR   8   9.885   1.310   3.803
   71    HD2  DPR   8           HD1      DPR   8   7.826   0.449   2.199
   72    HD3  DPR   8           HD2      DPR   8   9.240  -0.554   2.601
   73    HA   PRO   9           HA       PRO   9   9.897   5.414  -1.093
   74    HB2  PRO   9           HB2      PRO   9  11.198   4.496  -3.616
   75    HB3  PRO   9           HB1      PRO   9  11.380   6.032  -2.749
   76    HG2  PRO   9           HG2      PRO   9  13.260   4.144  -2.660
   77    HG3  PRO   9           HG1      PRO   9  12.897   5.171  -1.262
   78    HD2  PRO   9           HD2      PRO   9  12.227   2.301  -1.713
   79    HD3  PRO   9           HD1      PRO   9  12.534   3.164  -0.190
   80    H    GLU  10           HN       GLU  10   9.042   2.334  -2.089
   81    HA   GLU  10           HA       GLU  10   6.950   3.354  -3.916
   82    HB2  GLU  10           HB2      GLU  10   7.636   0.459  -3.862
   83    HB3  GLU  10           HB1      GLU  10   7.152   1.478  -5.218
   84    HG2  GLU  10           HG2      GLU  10   9.453   2.661  -4.807
   85    HG3  GLU  10           HG1      GLU  10   9.865   1.171  -3.961
   86    H    ILE  11           HN       ILE  11   5.164   3.628  -2.712
   87    HA   ILE  11           HA       ILE  11   4.415   1.497  -0.805
   88    HB   ILE  11           HB       ILE  11   4.736   3.770   0.160
   89   HG12  ILE  11          HG12      ILE  11   1.785   3.209   0.235
   90   HG13  ILE  11          HG11      ILE  11   2.902   2.004   0.872
   91   HG21  ILE  11          HG21      ILE  11   2.228   4.718  -1.123
   92   HG22  ILE  11          HG22      ILE  11   3.670   4.701  -2.137
   93   HG23  ILE  11          HG23      ILE  11   3.657   5.628  -0.637
   94   HD11  ILE  11          HD11      ILE  11   2.768   4.912   1.724
   95   HD12  ILE  11          HD12      ILE  11   3.902   3.716   2.350
   96   HD13  ILE  11          HD13      ILE  11   2.176   3.538   2.656
   97    H    ILE  12           HN       ILE  12   2.327   0.649  -0.850
   98    HA   ILE  12           HA       ILE  12   0.759   1.286  -3.281
   99    HB   ILE  12           HB       ILE  12   1.033  -1.363  -1.839
  100   HG12  ILE  12          HG12      ILE  12   1.847  -0.749  -4.677
  101   HG13  ILE  12          HG11      ILE  12   2.952  -0.423  -3.340
  102   HG21  ILE  12          HG21      ILE  12  -0.979  -1.774  -2.787
  103   HG22  ILE  12          HG22      ILE  12  -0.127  -1.763  -4.332
  104   HG23  ILE  12          HG23      ILE  12  -0.913  -0.296  -3.748
  105   HD11  ILE  12          HD11      ILE  12   2.836  -2.817  -4.596
  106   HD12  ILE  12          HD12      ILE  12   1.641  -3.089  -3.327
  107   HD13  ILE  12          HD13      ILE  12   3.294  -2.645  -2.902
  108    H    PHE  13           HN       PHE  13   0.231   2.848  -1.166
  109    HA   PHE  13           HA       PHE  13  -1.808   1.712   0.539
  110    HB2  PHE  13           HB2      PHE  13  -0.327   4.223   0.346
  111    HB3  PHE  13           HB1      PHE  13  -2.030   4.463   0.736
  112    HD1  PHE  13           HD1      PHE  13   0.411   1.739   1.597
  113    HD2  PHE  13           HD2      PHE  13  -2.259   4.783   3.041
  114    HE1  PHE  13           HE1      PHE  13   0.840   1.012   3.929
  115    HE2  PHE  13           HE2      PHE  13  -1.829   4.053   5.371
  116    HZ   PHE  13           HZ       PHE  13  -0.280   2.169   5.815
  117    H    ASN  14           HN       ASN  14  -1.948   2.079  -2.575
  118    HA   ASN  14           HA       ASN  14  -4.125   3.818  -3.094
  119    HB2  ASN  14           HB2      ASN  14  -4.256   2.724  -5.245
  120    HB3  ASN  14           HB1      ASN  14  -2.556   2.924  -4.824
  121   HD21  ASN  14          HD21      ASN  14  -3.144   0.941  -6.675
  122   HD22  ASN  14          HD22      ASN  14  -2.983  -0.592  -5.964
  123    H    GLU  15           HN       GLU  15  -6.318   3.280  -3.573
  124    HA   GLU  15           HA       GLU  15  -8.341   2.403  -2.896
  125    HB2  GLU  15           HB2      GLU  15  -6.837  -0.154  -3.507
  126    HB3  GLU  15           HB1      GLU  15  -8.590  -0.003  -3.381
  127    HG2  GLU  15           HG2      GLU  15  -6.890   1.575  -5.331
  128    HG3  GLU  15           HG1      GLU  15  -7.744   0.090  -5.744
  129    H    ARG  16           HN       ARG  16  -7.654   3.198  -0.674
  130    HA   ARG  16           HA       ARG  16  -6.559   1.784   1.367
  131    HB2  ARG  16           HB2      ARG  16  -8.349   2.862   2.847
  132    HB3  ARG  16           HB1      ARG  16  -7.376   3.952   1.859
  133    HG2  ARG  16           HG2      ARG  16  -9.741   2.962   0.444
  134    HG3  ARG  16           HG1      ARG  16 -10.148   3.864   1.905
  135    HD2  ARG  16           HD2      ARG  16  -8.261   4.851  -0.253
  136    HD3  ARG  16           HD1      ARG  16  -9.952   5.324  -0.113
  137    HE   ARG  16           HE       ARG  16  -7.758   6.200   1.592
  138   HH11  ARG  16          HH11      ARG  16  -8.306   7.835   3.070
  139   HH12  ARG  16          HH12      ARG  16  -9.972   8.218   3.351
  140   HH21  ARG  16          HH21      ARG  16 -11.169   5.844   1.125
  141   HH22  ARG  16          HH22      ARG  16 -11.593   7.091   2.250
  Start of MODEL    5
    1    H1   GLY   1           HN       GLY   1  -4.613  -1.326  -5.795
    2    HA2  GLY   1           HA2      GLY   1  -7.444  -2.109  -6.162
    3    HA3  GLY   1           HA1      GLY   1  -6.214  -3.130  -5.429
    4    H    SER   2           HN       SER   2  -5.754  -2.916  -3.256
    5    HA   SER   2           HA       SER   2  -6.383  -0.667  -1.670
    6    HB2  SER   2           HB2      SER   2  -8.696  -1.140  -1.979
    7    HB3  SER   2           HB1      SER   2  -8.448  -2.868  -1.747
    8    HG   SER   2           HG       SER   2  -8.019  -2.498   0.401
    9    H    LYS   3           HN       LYS   3  -4.386  -2.833  -2.105
   10    HA   LYS   3           HA       LYS   3  -4.360  -4.113   0.548
   11    HB2  LYS   3           HB2      LYS   3  -3.742  -5.086  -1.993
   12    HB3  LYS   3           HB1      LYS   3  -2.173  -4.839  -1.225
   13    HG2  LYS   3           HG2      LYS   3  -3.054  -6.078   0.788
   14    HG3  LYS   3           HG1      LYS   3  -4.493  -6.468  -0.154
   15    HD2  LYS   3           HD2      LYS   3  -3.008  -7.506  -1.889
   16    HD3  LYS   3           HD1      LYS   3  -1.636  -7.237  -0.812
   17    HE2  LYS   3           HE2      LYS   3  -3.387  -8.465   0.884
   18    HE3  LYS   3           HE1      LYS   3  -3.798  -9.245  -0.644
   19    HZ1  LYS   3           HZ1      LYS   3  -1.708  -9.899   0.968
   20    HZ2  LYS   3           HZ2      LYS   3  -0.974  -8.980  -0.258
   21    HZ3  LYS   3           HZ3      LYS   3  -1.888 -10.356  -0.656
   22    H    ARG   4           HN       ARG   4  -3.469  -2.772   2.019
   23    HA   ARG   4           HA       ARG   4  -1.498  -0.816   1.416
   24    HB2  ARG   4           HB2      ARG   4  -2.651  -1.953   3.934
   25    HB3  ARG   4           HB1      ARG   4  -1.209  -0.940   4.019
   26    HG2  ARG   4           HG2      ARG   4  -2.315   0.933   3.139
   27    HG3  ARG   4           HG1      ARG   4  -3.604  -0.042   2.434
   28    HD2  ARG   4           HD2      ARG   4  -3.139   0.362   5.402
   29    HD3  ARG   4           HD1      ARG   4  -4.381   1.169   4.448
   30    HE   ARG   4           HE       ARG   4  -4.910  -1.441   3.980
   31   HH11  ARG   4          HH11      ARG   4  -6.199  -2.758   5.309
   32   HH12  ARG   4          HH12      ARG   4  -6.344  -2.398   6.997
   33   HH21  ARG   4          HH21      ARG   4  -4.273   0.380   6.852
   34   HH22  ARG   4          HH22      ARG   4  -5.254  -0.621   7.870
   35    H    PHE   5           HN       PHE   5   0.090  -2.029   0.261
   36    HA   PHE   5           HA       PHE   5   1.800  -3.714   1.986
   37    HB2  PHE   5           HB2      PHE   5   0.701  -4.229  -0.569
   38    HB3  PHE   5           HB1      PHE   5   2.429  -3.994  -0.806
   39    HD1  PHE   5           HD1      PHE   5  -0.116  -5.934   1.069
   40    HD2  PHE   5           HD2      PHE   5   4.036  -5.562   0.035
   41    HE1  PHE   5           HE1      PHE   5   0.321  -8.184   2.017
   42    HE2  PHE   5           HE2      PHE   5   4.474  -7.812   0.981
   43    HZ   PHE   5           HZ       PHE   5   2.616  -9.122   1.972
   44    H    ARG   6           HN       ARG   6   2.876  -1.886   2.847
   45    HA   ARG   6           HA       ARG   6   4.134   0.103   1.278
   46    HB2  ARG   6           HB2      ARG   6   3.945  -0.634   4.060
   47    HB3  ARG   6           HB1      ARG   6   5.608  -0.222   3.651
   48    HG2  ARG   6           HG2      ARG   6   4.859   1.905   2.667
   49    HG3  ARG   6           HG1      ARG   6   3.184   1.489   3.031
   50    HD2  ARG   6           HD2      ARG   6   5.410   1.912   5.042
   51    HD3  ARG   6           HD1      ARG   6   4.037   2.979   4.762
   52    HE   ARG   6           HE       ARG   6   2.818   0.655   5.393
   53   HH11  ARG   6          HH11      ARG   6   2.388  -0.058   7.508
   54   HH12  ARG   6          HH12      ARG   6   3.390   0.475   8.816
   55   HH21  ARG   6          HH21      ARG   6   5.444   2.411   6.802
   56   HH22  ARG   6          HH22      ARG   6   5.120   1.873   8.416
   57    H    PHE   7           HN       PHE   7   6.344   0.346   0.728
   58    HA   PHE   7           HA       PHE   7   8.177  -1.880   1.072
   59    HB2  PHE   7           HB2      PHE   7   6.650  -2.399  -0.930
   60    HB3  PHE   7           HB1      PHE   7   7.504  -1.094  -1.753
   61    HD1  PHE   7           HD1      PHE   7   9.607  -1.478  -2.742
   62    HD2  PHE   7           HD2      PHE   7   8.077  -4.265   0.145
   63    HE1  PHE   7           HE1      PHE   7  11.492  -3.015  -3.229
   64    HE2  PHE   7           HE2      PHE   7   9.962  -5.802  -0.340
   65    HZ   PHE   7           HZ       PHE   7  11.669  -5.178  -2.027
   66    HA   DPR   8           HA       DPR   8  10.877   1.668   1.078
   67    HB2  DPR   8           HB1      DPR   8   8.989   3.837   1.788
   68    HB3  DPR   8           HB2      DPR   8  10.465   3.307   2.615
   69    HG2  DPR   8           HG1      DPR   8   8.011   2.798   3.572
   70    HG3  DPR   8           HG2      DPR   8   9.367   1.678   3.790
   71    HD2  DPR   8           HD1      DPR   8   7.041   1.518   1.900
   72    HD3  DPR   8           HD2      DPR   8   7.879   0.217   2.773
   73    HA   PRO   9           HA       PRO   9  10.839   4.651  -2.347
   74    HB2  PRO   9           HB2      PRO   9  11.591   2.227  -3.918
   75    HB3  PRO   9           HB1      PRO   9  12.335   3.836  -3.904
   76    HG2  PRO   9           HG2      PRO   9  13.418   1.730  -2.640
   77    HG3  PRO   9           HG1      PRO   9  13.584   3.393  -2.054
   78    HD2  PRO   9           HD2      PRO   9  12.002   1.169  -0.919
   79    HD3  PRO   9           HD1      PRO   9  12.580   2.658  -0.141
   80    H    GLU  10           HN       GLU  10   8.980   1.828  -2.044
   81    HA   GLU  10           HA       GLU  10   7.078   2.820  -4.068
   82    HB2  GLU  10           HB2      GLU  10   8.086  -0.009  -3.752
   83    HB3  GLU  10           HB1      GLU  10   6.583   0.376  -4.588
   84    HG2  GLU  10           HG2      GLU  10   7.678   1.107  -6.423
   85    HG3  GLU  10           HG1      GLU  10   8.797   2.069  -5.462
   86    H    ILE  11           HN       ILE  11   4.922   2.561  -3.552
   87    HA   ILE  11           HA       ILE  11   4.263   1.184  -1.039
   88    HB   ILE  11           HB       ILE  11   4.651   3.583  -0.513
   89   HG12  ILE  11          HG12      ILE  11   1.720   2.812  -0.395
   90   HG13  ILE  11          HG11      ILE  11   2.949   2.166   0.692
   91   HG21  ILE  11          HG21      ILE  11   2.171   4.301  -2.014
   92   HG22  ILE  11          HG22      ILE  11   3.665   4.138  -2.938
   93   HG23  ILE  11          HG23      ILE  11   3.568   5.299  -1.613
   94   HD11  ILE  11          HD11      ILE  11   1.844   4.053   1.771
   95   HD12  ILE  11          HD12      ILE  11   2.179   5.082   0.377
   96   HD13  ILE  11          HD13      ILE  11   3.505   4.500   1.384
   97    H    ILE  12           HN       ILE  12   2.373   0.118  -1.104
   98    HA   ILE  12           HA       ILE  12   0.703   0.457  -3.518
   99    HB   ILE  12           HB       ILE  12   0.782  -1.914  -1.641
  100   HG12  ILE  12          HG12      ILE  12   2.223  -1.453  -4.275
  101   HG13  ILE  12          HG11      ILE  12   2.985  -1.611  -2.692
  102   HG21  ILE  12          HG21      ILE  12   0.007  -2.338  -4.418
  103   HG22  ILE  12          HG22      ILE  12  -1.026  -1.144  -3.636
  104   HG23  ILE  12          HG23      ILE  12  -0.861  -2.756  -2.942
  105   HD11  ILE  12          HD11      ILE  12   2.048  -3.694  -4.503
  106   HD12  ILE  12          HD12      ILE  12   1.355  -3.870  -2.890
  107   HD13  ILE  12          HD13      ILE  12   3.106  -3.829  -3.098
  108    H    PHE  13           HN       PHE  13   0.067   2.396  -1.970
  109    HA   PHE  13           HA       PHE  13  -1.912   1.616   0.026
  110    HB2  PHE  13           HB2      PHE  13  -0.315   3.972  -0.557
  111    HB3  PHE  13           HB1      PHE  13  -2.007   4.384  -0.285
  112    HD1  PHE  13           HD1      PHE  13  -2.338   5.083   1.921
  113    HD2  PHE  13           HD2      PHE  13   0.280   1.760   1.144
  114    HE1  PHE  13           HE1      PHE  13  -2.022   4.758   4.357
  115    HE2  PHE  13           HE2      PHE  13   0.592   1.441   3.582
  116    HZ   PHE  13           HZ       PHE  13  -0.558   2.939   5.188
  117    H    ASN  14           HN       ASN  14  -3.929   3.233  -0.066
  118    HA   ASN  14           HA       ASN  14  -5.764   2.346  -1.822
  119    HB2  ASN  14           HB2      ASN  14  -6.386   3.862  -0.051
  120    HB3  ASN  14           HB1      ASN  14  -5.482   5.177  -0.800
  121   HD21  ASN  14          HD21      ASN  14  -6.277   5.811  -3.079
  122   HD22  ASN  14          HD22      ASN  14  -7.943   5.704  -3.379
  123    H    GLU  15           HN       GLU  15  -4.915   1.924  -3.874
  124    HA   GLU  15           HA       GLU  15  -5.037   4.174  -5.707
  125    HB2  GLU  15           HB2      GLU  15  -2.534   2.504  -5.403
  126    HB3  GLU  15           HB1      GLU  15  -2.852   3.584  -6.761
  127    HG2  GLU  15           HG2      GLU  15  -3.192   5.431  -5.017
  128    HG3  GLU  15           HG1      GLU  15  -2.479   4.316  -3.854
  129    H    ARG  16           HN       ARG  16  -3.284   1.372  -6.589
  130    HA   ARG  16           HA       ARG  16  -4.897   0.670  -8.743
  131    HB2  ARG  16           HB2      ARG  16  -2.490  -0.154  -7.977
  132    HB3  ARG  16           HB1      ARG  16  -3.416  -1.495  -7.308
  133    HG2  ARG  16           HG2      ARG  16  -3.514  -0.545 -10.188
  134    HG3  ARG  16           HG1      ARG  16  -2.684  -1.989  -9.611
  135    HD2  ARG  16           HD2      ARG  16  -5.651  -1.446  -9.685
  136    HD3  ARG  16           HD1      ARG  16  -4.766  -2.777 -10.423
  137    HE   ARG  16           HE       ARG  16  -5.601  -2.586  -7.640
  138   HH11  ARG  16          HH11      ARG  16  -5.254  -4.467  -6.418
  139   HH12  ARG  16          HH12      ARG  16  -4.248  -5.730  -7.047
  140   HH21  ARG  16          HH21      ARG  16  -3.555  -4.065 -10.008
  141   HH22  ARG  16          HH22      ARG  16  -3.287  -5.502  -9.080
  Start of MODEL    6
    1    H1   GLY   1           HN       GLY   1  -3.913  -2.061  -5.515
    2    HA2  GLY   1           HA2      GLY   1  -4.566  -4.655  -6.503
    3    HA3  GLY   1           HA1      GLY   1  -3.649  -4.303  -5.042
    4    H    SER   2           HN       SER   2  -4.887  -3.698  -3.106
    5    HA   SER   2           HA       SER   2  -7.562  -3.746  -2.667
    6    HB2  SER   2           HB2      SER   2  -8.147  -5.789  -3.514
    7    HB3  SER   2           HB1      SER   2  -6.542  -6.467  -3.259
    8    HG   SER   2           HG       SER   2  -8.492  -5.906  -1.267
    9    H    LYS   3           HN       LYS   3  -4.408  -4.541  -1.671
   10    HA   LYS   3           HA       LYS   3  -5.138  -3.974   1.119
   11    HB2  LYS   3           HB2      LYS   3  -4.066  -6.493   0.077
   12    HB3  LYS   3           HB1      LYS   3  -3.102  -5.815   1.391
   13    HG2  LYS   3           HG2      LYS   3  -5.094  -5.642   2.803
   14    HG3  LYS   3           HG1      LYS   3  -6.106  -6.233   1.484
   15    HD2  LYS   3           HD2      LYS   3  -4.877  -8.366   1.481
   16    HD3  LYS   3           HD1      LYS   3  -3.846  -7.780   2.787
   17    HE2  LYS   3           HE2      LYS   3  -5.753  -9.240   3.559
   18    HE3  LYS   3           HE1      LYS   3  -5.724  -7.641   4.300
   19    HZ1  LYS   3           HZ1      LYS   3  -7.656  -7.113   3.367
   20    HZ2  LYS   3           HZ2      LYS   3  -7.830  -8.760   2.987
   21    HZ3  LYS   3           HZ3      LYS   3  -7.184  -7.686   1.842
   22    H    ARG   4           HN       ARG   4  -4.036  -2.200   1.638
   23    HA   ARG   4           HA       ARG   4  -1.965  -1.004   0.300
   24    HB2  ARG   4           HB2      ARG   4  -1.464   0.201   2.356
   25    HB3  ARG   4           HB1      ARG   4  -3.210   0.018   2.188
   26    HG2  ARG   4           HG2      ARG   4  -2.684  -2.238   3.557
   27    HG3  ARG   4           HG1      ARG   4  -1.355  -1.238   4.146
   28    HD2  ARG   4           HD2      ARG   4  -2.979   0.537   4.745
   29    HD3  ARG   4           HD1      ARG   4  -4.294  -0.502   4.205
   30    HE   ARG   4           HE       ARG   4  -2.757  -0.780   6.661
   31   HH11  ARG   4          HH11      ARG   4  -3.538  -2.364   8.090
   32   HH12  ARG   4          HH12      ARG   4  -4.717  -3.510   7.543
   33   HH21  ARG   4          HH21      ARG   4  -4.873  -2.216   4.330
   34   HH22  ARG   4          HH22      ARG   4  -5.472  -3.427   5.416
   35    H    PHE   5           HN       PHE   5   0.155  -1.343   0.030
   36    HA   PHE   5           HA       PHE   5   1.544  -3.205   1.846
   37    HB2  PHE   5           HB2      PHE   5   0.718  -3.953  -0.680
   38    HB3  PHE   5           HB1      PHE   5   2.386  -3.446  -0.945
   39    HD1  PHE   5           HD1      PHE   5   4.243  -4.642   0.045
   40    HD2  PHE   5           HD2      PHE   5   0.190  -5.770   0.913
   41    HE1  PHE   5           HE1      PHE   5   5.050  -6.754   1.064
   42    HE2  PHE   5           HE2      PHE   5   0.997  -7.884   1.931
   43    HZ   PHE   5           HZ       PHE   5   3.426  -8.374   2.007
   44    H    ARG   6           HN       ARG   6   2.971  -1.852   2.777
   45    HA   ARG   6           HA       ARG   6   4.242   0.281   1.286
   46    HB2  ARG   6           HB2      ARG   6   3.818  -0.409   4.056
   47    HB3  ARG   6           HB1      ARG   6   5.517  -0.041   3.771
   48    HG2  ARG   6           HG2      ARG   6   4.931   2.098   2.757
   49    HG3  ARG   6           HG1      ARG   6   3.214   1.720   2.885
   50    HD2  ARG   6           HD2      ARG   6   5.137   2.048   5.204
   51    HD3  ARG   6           HD1      ARG   6   3.900   3.204   4.717
   52    HE   ARG   6           HE       ARG   6   2.469   0.932   5.136
   53   HH11  ARG   6          HH11      ARG   6   1.622   0.321   7.152
   54   HH12  ARG   6          HH12      ARG   6   2.384   0.869   8.608
   55   HH21  ARG   6          HH21      ARG   6   4.859   2.650   6.956
   56   HH22  ARG   6          HH22      ARG   6   4.218   2.187   8.497
   57    H    PHE   7           HN       PHE   7   6.357   0.373   0.630
   58    HA   PHE   7           HA       PHE   7   8.188  -1.810   1.274
   59    HB2  PHE   7           HB2      PHE   7   6.837  -2.521  -0.736
   60    HB3  PHE   7           HB1      PHE   7   7.561  -1.170  -1.609
   61    HD1  PHE   7           HD1      PHE   7   9.653  -1.426  -2.642
   62    HD2  PHE   7           HD2      PHE   7   8.477  -4.157   0.458
   63    HE1  PHE   7           HE1      PHE   7  11.678  -2.790  -3.075
   64    HE2  PHE   7           HE2      PHE   7  10.503  -5.522   0.025
   65    HZ   PHE   7           HZ       PHE   7  12.104  -4.837  -1.742
   66    HA   DPR   8           HA       DPR   8  10.883   1.766   1.304
   67    HB2  DPR   8           HB1      DPR   8   8.888   3.956   1.530
   68    HB3  DPR   8           HB2      DPR   8  10.296   3.601   2.548
   69    HG2  DPR   8           HG1      DPR   8   7.806   3.105   3.364
   70    HG3  DPR   8           HG2      DPR   8   9.157   2.039   3.789
   71    HD2  DPR   8           HD1      DPR   8   6.990   1.660   1.743
   72    HD3  DPR   8           HD2      DPR   8   7.757   0.460   2.808
   73    HA   PRO   9           HA       PRO   9  11.416   4.214  -2.451
   74    HB2  PRO   9           HB2      PRO   9  11.915   1.520  -3.652
   75    HB3  PRO   9           HB1      PRO   9  12.853   3.016  -3.819
   76    HG2  PRO   9           HG2      PRO   9  13.616   1.015  -2.206
   77    HG3  PRO   9           HG1      PRO   9  13.942   2.716  -1.837
   78    HD2  PRO   9           HD2      PRO   9  12.067   0.858  -0.517
   79    HD3  PRO   9           HD1      PRO   9  12.753   2.384   0.080
   80    H    GLU  10           HN       GLU  10   9.253   1.590  -2.063
   81    HA   GLU  10           HA       GLU  10   7.507   2.684  -4.162
   82    HB2  GLU  10           HB2      GLU  10   7.965  -0.283  -3.799
   83    HB3  GLU  10           HB1      GLU  10   6.989   0.502  -5.040
   84    HG2  GLU  10           HG2      GLU  10   9.290   1.752  -5.541
   85    HG3  GLU  10           HG1      GLU  10   9.961   0.295  -4.812
   86    H    ILE  11           HN       ILE  11   5.310   2.510  -3.738
   87    HA   ILE  11           HA       ILE  11   4.408   1.035  -1.391
   88    HB   ILE  11           HB       ILE  11   4.984   3.033  -0.267
   89   HG12  ILE  11          HG12      ILE  11   2.124   3.597  -1.064
   90   HG13  ILE  11          HG11      ILE  11   2.541   2.199  -0.071
   91   HG21  ILE  11          HG21      ILE  11   4.162   5.270  -1.220
   92   HG22  ILE  11          HG22      ILE  11   3.880   4.398  -2.726
   93   HG23  ILE  11          HG23      ILE  11   5.509   4.505  -2.061
   94   HD11  ILE  11          HD11      ILE  11   3.581   3.650   1.594
   95   HD12  ILE  11          HD12      ILE  11   1.927   4.186   1.300
   96   HD13  ILE  11          HD13      ILE  11   3.280   5.063   0.584
   97    H    ILE  12           HN       ILE  12   2.137   0.767  -1.313
   98    HA   ILE  12           HA       ILE  12   0.618   1.769  -3.626
   99    HB   ILE  12           HB       ILE  12   1.370  -0.474  -4.253
  100   HG12  ILE  12          HG12      ILE  12  -1.437  -1.038  -3.462
  101   HG13  ILE  12          HG11      ILE  12  -1.181   0.452  -4.371
  102   HG21  ILE  12          HG21      ILE  12   1.040  -0.974  -1.491
  103   HG22  ILE  12          HG22      ILE  12   1.580  -2.112  -2.725
  104   HG23  ILE  12          HG23      ILE  12  -0.132  -1.999  -2.317
  105   HD11  ILE  12          HD11      ILE  12   0.069  -2.126  -5.296
  106   HD12  ILE  12          HD12      ILE  12  -0.313  -0.684  -6.235
  107   HD13  ILE  12          HD13      ILE  12  -1.607  -1.752  -5.697
  108    H    PHE  13           HN       PHE  13   0.011   3.150  -1.685
  109    HA   PHE  13           HA       PHE  13  -1.787   1.869   0.221
  110    HB2  PHE  13           HB2      PHE  13  -0.286   4.351   0.072
  111    HB3  PHE  13           HB1      PHE  13  -1.962   4.636   0.541
  112    HD1  PHE  13           HD1      PHE  13   0.498   1.873   1.195
  113    HD2  PHE  13           HD2      PHE  13  -2.179   4.793   2.861
  114    HE1  PHE  13           HE1      PHE  13   0.996   1.032   3.474
  115    HE2  PHE  13           HE2      PHE  13  -1.681   3.950   5.137
  116    HZ   PHE  13           HZ       PHE  13  -0.093   2.070   5.445
  117    H    ASN  14           HN       ASN  14  -2.127   2.650  -2.877
  118    HA   ASN  14           HA       ASN  14  -4.605   4.151  -2.769
  119    HB2  ASN  14           HB2      ASN  14  -3.602   2.702  -5.200
  120    HB3  ASN  14           HB1      ASN  14  -4.501   4.215  -5.101
  121   HD21  ASN  14          HD21      ASN  14  -2.128   4.168  -6.608
  122   HD22  ASN  14          HD22      ASN  14  -0.927   5.054  -5.798
  123    H    GLU  15           HN       GLU  15  -6.194   2.989  -4.629
  124    HA   GLU  15           HA       GLU  15  -7.003   0.475  -3.302
  125    HB2  GLU  15           HB2      GLU  15  -8.865   1.945  -5.102
  126    HB3  GLU  15           HB1      GLU  15  -9.198   1.065  -3.610
  127    HG2  GLU  15           HG2      GLU  15  -9.480   3.299  -2.955
  128    HG3  GLU  15           HG1      GLU  15  -7.821   2.958  -2.464
  129    H    ARG  16           HN       ARG  16  -4.958   0.397  -5.232
  130    HA   ARG  16           HA       ARG  16  -6.135  -0.401  -7.766
  131    HB2  ARG  16           HB2      ARG  16  -3.716   0.655  -7.126
  132    HB3  ARG  16           HB1      ARG  16  -3.308  -1.058  -7.208
  133    HG2  ARG  16           HG2      ARG  16  -3.018  -0.334  -9.429
  134    HG3  ARG  16           HG1      ARG  16  -4.631  -1.047  -9.444
  135    HD2  ARG  16           HD2      ARG  16  -5.255   0.933 -10.366
  136    HD3  ARG  16           HD1      ARG  16  -5.197   1.527  -8.710
  137    HE   ARG  16           HE       ARG  16  -2.655   1.903  -9.495
  138   HH11  ARG  16          HH11      ARG  16  -1.879   3.691 -10.660
  139   HH12  ARG  16          HH12      ARG  16  -2.946   4.563 -11.710
  140   HH21  ARG  16          HH21      ARG  16  -5.690   2.558 -11.026
  141   HH22  ARG  16          HH22      ARG  16  -5.102   3.923 -11.917
  Start of MODEL    7
    1    H1   GLY   1           HN       GLY   1  -8.899   0.264   1.223
    2    HA2  GLY   1           HA2      GLY   1  -8.555  -2.000  -0.124
    3    HA3  GLY   1           HA1      GLY   1  -7.249  -1.037  -0.809
    4    H    SER   2           HN       SER   2  -8.393  -2.734   2.004
    5    HA   SER   2           HA       SER   2  -6.420  -1.866   3.850
    6    HB2  SER   2           HB2      SER   2  -7.099  -4.469   4.572
    7    HB3  SER   2           HB1      SER   2  -7.872  -2.991   5.137
    8    HG   SER   2           HG       SER   2  -9.532  -3.420   3.917
    9    H    LYS   3           HN       LYS   3  -5.850  -3.227   0.998
   10    HA   LYS   3           HA       LYS   3  -3.957  -5.282   1.787
   11    HB2  LYS   3           HB2      LYS   3  -4.631  -4.060  -0.898
   12    HB3  LYS   3           HB1      LYS   3  -3.465  -5.364  -0.666
   13    HG2  LYS   3           HG2      LYS   3  -5.139  -6.864   0.115
   14    HG3  LYS   3           HG1      LYS   3  -6.309  -5.563   0.338
   15    HD2  LYS   3           HD2      LYS   3  -5.249  -5.791  -2.406
   16    HD3  LYS   3           HD1      LYS   3  -6.202  -7.176  -1.875
   17    HE2  LYS   3           HE2      LYS   3  -7.166  -4.336  -1.507
   18    HE3  LYS   3           HE1      LYS   3  -7.501  -5.257  -2.973
   19    HZ1  LYS   3           HZ1      LYS   3  -8.859  -6.695  -1.878
   20    HZ2  LYS   3           HZ2      LYS   3  -9.122  -5.308  -0.931
   21    HZ3  LYS   3           HZ3      LYS   3  -8.059  -6.519  -0.392
   22    H    ARG   4           HN       ARG   4  -3.634  -2.397   2.610
   23    HA   ARG   4           HA       ARG   4  -1.710  -0.958   1.341
   24    HB2  ARG   4           HB2      ARG   4  -2.197  -1.514   4.244
   25    HB3  ARG   4           HB1      ARG   4  -0.781  -0.576   3.771
   26    HG2  ARG   4           HG2      ARG   4  -2.133   1.077   2.679
   27    HG3  ARG   4           HG1      ARG   4  -3.575   0.071   2.807
   28    HD2  ARG   4           HD2      ARG   4  -2.174   0.728   5.347
   29    HD3  ARG   4           HD1      ARG   4  -3.033   2.046   4.555
   30    HE   ARG   4           HE       ARG   4  -4.567  -0.405   4.831
   31   HH11  ARG   4          HH11      ARG   4  -6.392  -0.243   6.174
   32   HH12  ARG   4          HH12      ARG   4  -6.581   1.134   7.207
   33   HH21  ARG   4          HH21      ARG   4  -3.621   2.632   6.194
   34   HH22  ARG   4          HH22      ARG   4  -5.012   2.762   7.219
   35    H    PHE   5           HN       PHE   5   0.162  -1.520   0.435
   36    HA   PHE   5           HA       PHE   5   1.853  -3.516   1.815
   37    HB2  PHE   5           HB2      PHE   5   0.615  -3.740  -0.732
   38    HB3  PHE   5           HB1      PHE   5   2.346  -3.546  -0.997
   39    HD1  PHE   5           HD1      PHE   5   3.940  -5.018   0.417
   40    HD2  PHE   5           HD2      PHE   5  -0.260  -5.806  -0.036
   41    HE1  PHE   5           HE1      PHE   5   4.305  -7.370   1.116
   42    HE2  PHE   5           HE2      PHE   5   0.106  -8.158   0.664
   43    HZ   PHE   5           HZ       PHE   5   2.388  -8.939   1.240
   44    H    ARG   6           HN       ARG   6   3.313  -2.126   2.703
   45    HA   ARG   6           HA       ARG   6   4.464   0.052   1.174
   46    HB2  ARG   6           HB2      ARG   6   4.240  -0.662   3.929
   47    HB3  ARG   6           HB1      ARG   6   5.952  -0.483   3.545
   48    HG2  ARG   6           HG2      ARG   6   5.489   1.728   2.536
   49    HG3  ARG   6           HG1      ARG   6   3.783   1.554   2.949
   50    HD2  ARG   6           HD2      ARG   6   4.844   1.083   5.372
   51    HD3  ARG   6           HD1      ARG   6   6.117   2.106   4.716
   52    HE   ARG   6           HE       ARG   6   3.880   3.521   4.143
   53   HH11  ARG   6          HH11      ARG   6   2.893   4.990   5.568
   54   HH12  ARG   6          HH12      ARG   6   3.084   4.789   7.277
   55   HH21  ARG   6          HH21      ARG   6   5.061   1.955   6.993
   56   HH22  ARG   6          HH22      ARG   6   4.310   3.071   8.085
   57    H    PHE   7           HN       PHE   7   6.545   0.158   0.363
   58    HA   PHE   7           HA       PHE   7   8.358  -2.103   0.711
   59    HB2  PHE   7           HB2      PHE   7   6.738  -2.570  -1.235
   60    HB3  PHE   7           HB1      PHE   7   7.620  -1.305  -2.090
   61    HD1  PHE   7           HD1      PHE   7   9.675  -1.772  -3.135
   62    HD2  PHE   7           HD2      PHE   7   8.119  -4.490  -0.196
   63    HE1  PHE   7           HE1      PHE   7  11.484  -3.383  -3.667
   64    HE2  PHE   7           HE2      PHE   7   9.928  -6.102  -0.728
   65    HZ   PHE   7           HZ       PHE   7  11.611  -5.548  -2.464
   66    HA   DPR   8           HA       DPR   8  11.269   1.190   0.203
   67    HB2  DPR   8           HB1      DPR   8  10.861   3.145   2.050
   68    HB3  DPR   8           HB2      DPR   8  11.454   1.526   2.465
   69    HG2  DPR   8           HG1      DPR   8   8.736   2.696   2.748
   70    HG3  DPR   8           HG2      DPR   8   9.602   1.575   3.810
   71    HD2  DPR   8           HD1      DPR   8   7.627   0.860   1.987
   72    HD3  DPR   8           HD2      DPR   8   8.835  -0.255   2.660
   73    HA   PRO   9           HA       PRO   9   9.912   5.033  -1.758
   74    HB2  PRO   9           HB2      PRO   9  10.783   4.561  -4.287
   75    HB3  PRO   9           HB1      PRO   9  11.887   4.981  -2.962
   76    HG2  PRO   9           HG2      PRO   9  11.299   2.325  -4.164
   77    HG3  PRO   9           HG1      PRO   9  12.838   2.994  -3.595
   78    HD2  PRO   9           HD2      PRO   9  11.307   1.214  -2.141
   79    HD3  PRO   9           HD1      PRO   9  12.458   2.360  -1.418
   80    H    GLU  10           HN       GLU  10   8.822   1.910  -2.395
   81    HA   GLU  10           HA       GLU  10   6.596   2.917  -4.063
   82    HB2  GLU  10           HB2      GLU  10   7.818   1.434  -5.441
   83    HB3  GLU  10           HB1      GLU  10   8.080   0.295  -4.121
   84    HG2  GLU  10           HG2      GLU  10   5.265   0.937  -4.898
   85    HG3  GLU  10           HG1      GLU  10   6.201  -0.133  -5.936
   86    H    ILE  11           HN       ILE  11   4.632   2.746  -3.172
   87    HA   ILE  11           HA       ILE  11   4.149   0.655  -1.163
   88    HB   ILE  11           HB       ILE  11   3.287   2.134   0.455
   89   HG12  ILE  11          HG12      ILE  11   3.279   4.153  -1.798
   90   HG13  ILE  11          HG11      ILE  11   1.914   3.597  -0.829
   91   HG21  ILE  11          HG21      ILE  11   5.552   3.775  -0.680
   92   HG22  ILE  11          HG22      ILE  11   5.837   2.184   0.026
   93   HG23  ILE  11          HG23      ILE  11   5.156   3.475   1.013
   94   HD11  ILE  11          HD11      ILE  11   4.154   5.445  -0.022
   95   HD12  ILE  11          HD12      ILE  11   3.201   4.582   1.187
   96   HD13  ILE  11          HD13      ILE  11   2.413   5.711   0.084
   97    H    ILE  12           HN       ILE  12   2.095  -0.153  -1.156
   98    HA   ILE  12           HA       ILE  12   0.328   0.813  -3.306
   99    HB   ILE  12           HB       ILE  12  -0.033  -1.771  -1.813
  100   HG12  ILE  12          HG12      ILE  12   1.831  -1.226  -4.145
  101   HG13  ILE  12          HG11      ILE  12   2.302  -1.775  -2.536
  102   HG21  ILE  12          HG21      ILE  12  -1.437  -2.309  -3.546
  103   HG22  ILE  12          HG22      ILE  12  -0.468  -1.439  -4.736
  104   HG23  ILE  12          HG23      ILE  12  -1.564  -0.554  -3.674
  105   HD11  ILE  12          HD11      ILE  12   0.473  -3.676  -3.162
  106   HD12  ILE  12          HD12      ILE  12   2.193  -3.840  -3.513
  107   HD13  ILE  12          HD13      ILE  12   1.083  -3.297  -4.772
  108    H    PHE  13           HN       PHE  13   0.006   2.587  -1.537
  109    HA   PHE  13           HA       PHE  13  -2.036   1.761   0.415
  110    HB2  PHE  13           HB2      PHE  13  -0.144   4.061   0.193
  111    HB3  PHE  13           HB1      PHE  13  -1.666   4.311   1.046
  112    HD1  PHE  13           HD1      PHE  13   0.744   1.434   0.788
  113    HD2  PHE  13           HD2      PHE  13  -1.383   4.146   3.357
  114    HE1  PHE  13           HE1      PHE  13   1.669   0.279   2.777
  115    HE2  PHE  13           HE2      PHE  13  -0.458   2.989   5.343
  116    HZ   PHE  13           HZ       PHE  13   1.068   1.056   5.054
  117    H    ASN  14           HN       ASN  14  -3.924   3.200   0.681
  118    HA   ASN  14           HA       ASN  14  -4.726   5.079  -1.257
  119    HB2  ASN  14           HB2      ASN  14  -4.855   3.377  -2.893
  120    HB3  ASN  14           HB1      ASN  14  -5.558   2.226  -1.758
  121   HD21  ASN  14          HD21      ASN  14  -6.332   5.512  -3.060
  122   HD22  ASN  14          HD22      ASN  14  -7.994   5.206  -3.221
  123    H    GLU  15           HN       GLU  15  -7.068   5.606  -1.075
  124    HA   GLU  15           HA       GLU  15  -7.878   5.473   1.693
  125    HB2  GLU  15           HB2      GLU  15  -9.441   6.608  -0.631
  126    HB3  GLU  15           HB1      GLU  15  -9.607   7.011   1.079
  127    HG2  GLU  15           HG2      GLU  15  -8.185   8.717   0.645
  128    HG3  GLU  15           HG1      GLU  15  -6.927   7.482   0.608
  129    H    ARG  16           HN       ARG  16  -8.029   3.225  -0.593
  130    HA   ARG  16           HA       ARG  16 -10.291   1.898   0.628
  131    HB2  ARG  16           HB2      ARG  16 -11.082   3.430  -1.368
  132    HB3  ARG  16           HB1      ARG  16 -10.426   2.132  -2.358
  133    HG2  ARG  16           HG2      ARG  16 -12.497   1.217  -2.097
  134    HG3  ARG  16           HG1      ARG  16 -11.857   0.680  -0.547
  135    HD2  ARG  16           HD2      ARG  16 -13.367   3.275  -0.994
  136    HD3  ARG  16           HD1      ARG  16 -14.068   1.805  -0.331
  137    HE   ARG  16           HE       ARG  16 -12.468   3.698   1.100
  138   HH11  ARG  16          HH11      ARG  16 -11.941   3.174   3.245
  139   HH12  ARG  16          HH12      ARG  16 -12.079   1.536   3.792
  140   HH21  ARG  16          HH21      ARG  16 -13.185   0.331   0.734
  141   HH22  ARG  16          HH22      ARG  16 -12.783  -0.074   2.370
  Start of MODEL    8
    1    H1   GLY   1           HN       GLY   1  -8.627  -0.576  -0.515
    2    HA2  GLY   1           HA2      GLY   1 -10.030  -2.357   0.272
    3    HA3  GLY   1           HA1      GLY   1 -10.175  -2.929  -1.387
    4    H    SER   2           HN       SER   2  -7.103  -2.251  -1.450
    5    HA   SER   2           HA       SER   2  -6.293  -4.960  -0.705
    6    HB2  SER   2           HB2      SER   2  -5.698  -3.579  -2.902
    7    HB3  SER   2           HB1      SER   2  -4.381  -3.002  -1.887
    8    HG   SER   2           HG       SER   2  -4.915  -5.730  -1.840
    9    H    LYS   3           HN       LYS   3  -6.622  -2.223   0.954
   10    HA   LYS   3           HA       LYS   3  -5.675  -1.326   2.847
   11    HB2  LYS   3           HB2      LYS   3  -4.448  -4.090   3.021
   12    HB3  LYS   3           HB1      LYS   3  -4.520  -2.916   4.336
   13    HG2  LYS   3           HG2      LYS   3  -7.080  -3.585   2.954
   14    HG3  LYS   3           HG1      LYS   3  -6.398  -4.799   4.036
   15    HD2  LYS   3           HD2      LYS   3  -6.464  -3.332   5.902
   16    HD3  LYS   3           HD1      LYS   3  -6.707  -1.916   4.880
   17    HE2  LYS   3           HE2      LYS   3  -8.769  -3.982   4.528
   18    HE3  LYS   3           HE1      LYS   3  -8.720  -3.302   6.154
   19    HZ1  LYS   3           HZ1      LYS   3  -8.991  -1.815   3.602
   20    HZ2  LYS   3           HZ2      LYS   3  -8.736  -1.072   5.108
   21    HZ3  LYS   3           HZ3      LYS   3 -10.154  -1.965   4.828
   22    H    ARG   4           HN       ARG   4  -3.611  -0.666   3.867
   23    HA   ARG   4           HA       ARG   4  -1.791   0.357   2.019
   24    HB2  ARG   4           HB2      ARG   4  -1.387  -0.236   4.960
   25    HB3  ARG   4           HB1      ARG   4  -0.324   0.773   3.980
   26    HG2  ARG   4           HG2      ARG   4  -1.700   2.541   4.202
   27    HG3  ARG   4           HG1      ARG   4  -3.076   1.594   3.633
   28    HD2  ARG   4           HD2      ARG   4  -2.004   1.454   6.462
   29    HD3  ARG   4           HD1      ARG   4  -3.334   2.501   5.976
   30    HE   ARG   4           HE       ARG   4  -3.691  -0.292   5.275
   31   HH11  ARG   4          HH11      ARG   4  -5.419  -1.329   6.321
   32   HH12  ARG   4          HH12      ARG   4  -6.169  -0.581   7.691
   33   HH21  ARG   4          HH21      ARG   4  -4.111   2.209   7.628
   34   HH22  ARG   4          HH22      ARG   4  -5.429   1.423   8.432
   35    H    PHE   5           HN       PHE   5  -0.242  -0.560   0.845
   36    HA   PHE   5           HA       PHE   5   1.006  -3.044   1.848
   37    HB2  PHE   5           HB2      PHE   5  -0.653  -2.741  -0.434
   38    HB3  PHE   5           HB1      PHE   5   0.991  -3.010  -1.007
   39    HD1  PHE   5           HD1      PHE   5   2.021  -5.147  -0.833
   40    HD2  PHE   5           HD2      PHE   5  -1.640  -4.346   1.269
   41    HE1  PHE   5           HE1      PHE   5   1.825  -7.552  -0.257
   42    HE2  PHE   5           HE2      PHE   5  -1.835  -6.750   1.845
   43    HZ   PHE   5           HZ       PHE   5  -0.102  -8.352   1.082
   44    H    ARG   6           HN       ARG   6   2.949  -2.215   2.469
   45    HA   ARG   6           HA       ARG   6   4.420  -0.175   1.285
   46    HB2  ARG   6           HB2      ARG   6   4.832  -2.243   3.259
   47    HB3  ARG   6           HB1      ARG   6   6.270  -2.058   2.263
   48    HG2  ARG   6           HG2      ARG   6   6.405   0.299   2.761
   49    HG3  ARG   6           HG1      ARG   6   4.825   0.274   3.544
   50    HD2  ARG   6           HD2      ARG   6   5.689  -1.209   5.293
   51    HD3  ARG   6           HD1      ARG   6   7.259  -1.258   4.497
   52    HE   ARG   6           HE       ARG   6   6.549   1.435   5.018
   53   HH11  ARG   6          HH11      ARG   6   7.544   2.487   6.767
   54   HH12  ARG   6          HH12      ARG   6   8.284   1.552   8.025
   55   HH21  ARG   6          HH21      ARG   6   7.494  -1.502   6.584
   56   HH22  ARG   6          HH22      ARG   6   8.256  -0.705   7.921
   57    H    PHE   7           HN       PHE   7   6.425  -0.349  -0.015
   58    HA   PHE   7           HA       PHE   7   6.963  -2.718  -1.541
   59    HB2  PHE   7           HB2      PHE   7   4.830  -1.900  -2.578
   60    HB3  PHE   7           HB1      PHE   7   5.689  -0.433  -3.047
   61    HD1  PHE   7           HD1      PHE   7   6.961  -0.383  -5.025
   62    HD2  PHE   7           HD2      PHE   7   5.860  -4.163  -3.309
   63    HE1  PHE   7           HE1      PHE   7   7.874  -1.549  -7.012
   64    HE2  PHE   7           HE2      PHE   7   6.775  -5.330  -5.298
   65    HZ   PHE   7           HZ       PHE   7   7.782  -4.024  -7.148
   66    HA   DPR   8           HA       DPR   8  10.719  -0.482  -2.172
   67    HB2  DPR   8           HB1      DPR   8  11.780   0.258   0.244
   68    HB3  DPR   8           HB2      DPR   8  11.776  -1.411  -0.356
   69    HG2  DPR   8           HG1      DPR   8   9.975  -0.086   1.613
   70    HG3  DPR   8           HG2      DPR   8  10.661  -1.719   1.630
   71    HD2  DPR   8           HD1      DPR   8   8.081  -1.148   0.874
   72    HD3  DPR   8           HD2      DPR   8   8.990  -2.554   0.275
   73    HA   PRO   9           HA       PRO   9  11.095   4.034  -1.151
   74    HB2  PRO   9           HB2      PRO   9  11.192   4.063  -4.134
   75    HB3  PRO   9           HB1      PRO   9  12.217   4.915  -2.965
   76    HG2  PRO   9           HG2      PRO   9  13.087   2.766  -4.281
   77    HG3  PRO   9           HG1      PRO   9  13.557   3.092  -2.604
   78    HD2  PRO   9           HD2      PRO   9  11.656   1.054  -3.661
   79    HD3  PRO   9           HD1      PRO   9  12.674   1.000  -2.205
   80    H    GLU  10           HN       GLU  10   8.807   2.126  -2.678
   81    HA   GLU  10           HA       GLU  10   6.895   4.379  -2.842
   82    HB2  GLU  10           HB2      GLU  10   6.680   1.880  -4.512
   83    HB3  GLU  10           HB1      GLU  10   5.863   3.426  -4.740
   84    HG2  GLU  10           HG2      GLU  10   7.514   3.791  -6.266
   85    HG3  GLU  10           HG1      GLU  10   8.464   4.220  -4.844
   86    H    ILE  11           HN       ILE  11   4.741   3.907  -2.186
   87    HA   ILE  11           HA       ILE  11   4.285   1.313  -0.901
   88    HB   ILE  11           HB       ILE  11   3.505   2.403   1.180
   89   HG12  ILE  11          HG12      ILE  11   4.718   4.897  -0.058
   90   HG13  ILE  11          HG11      ILE  11   2.992   4.623   0.184
   91   HG21  ILE  11          HG21      ILE  11   6.333   3.274   0.560
   92   HG22  ILE  11          HG22      ILE  11   5.898   1.579   0.787
   93   HG23  ILE  11          HG23      ILE  11   5.677   2.731   2.104
   94   HD11  ILE  11          HD11      ILE  11   3.791   5.951   2.038
   95   HD12  ILE  11          HD12      ILE  11   5.124   4.834   2.326
   96   HD13  ILE  11          HD13      ILE  11   3.465   4.326   2.643
   97    H    ILE  12           HN       ILE  12   2.119   0.763  -0.647
   98    HA   ILE  12           HA       ILE  12   0.289   2.309  -2.334
   99    HB   ILE  12           HB       ILE  12   0.004  -0.438  -1.090
  100   HG12  ILE  12          HG12      ILE  12   0.462   0.362  -3.981
  101   HG13  ILE  12          HG11      ILE  12   1.752  -0.159  -2.897
  102   HG21  ILE  12          HG21      ILE  12  -2.192  -0.127  -1.532
  103   HG22  ILE  12          HG22      ILE  12  -1.751  -0.168  -3.239
  104   HG23  ILE  12          HG23      ILE  12  -1.875   1.377  -2.399
  105   HD11  ILE  12          HD11      ILE  12   1.225  -2.319  -3.236
  106   HD12  ILE  12          HD12      ILE  12   0.040  -1.803  -4.435
  107   HD13  ILE  12          HD13      ILE  12  -0.445  -2.023  -2.755
  108    H    PHE  13           HN       PHE  13   0.794   3.704  -0.106
  109    HA   PHE  13           HA       PHE  13  -1.082   3.095   2.007
  110    HB2  PHE  13           HB2      PHE  13   0.990   5.156   1.482
  111    HB3  PHE  13           HB1      PHE  13  -0.338   5.621   2.545
  112    HD1  PHE  13           HD1      PHE  13   0.499   5.554   4.732
  113    HD2  PHE  13           HD2      PHE  13   1.334   2.295   2.055
  114    HE1  PHE  13           HE1      PHE  13   1.536   4.288   6.594
  115    HE2  PHE  13           HE2      PHE  13   2.371   1.033   3.919
  116    HZ   PHE  13           HZ       PHE  13   2.472   2.029   6.188
  117    H    ASN  14           HN       ASN  14  -2.944   2.996   0.493
  118    HA   ASN  14           HA       ASN  14  -4.236   5.625   0.367
  119    HB2  ASN  14           HB2      ASN  14  -4.526   3.842  -2.016
  120    HB3  ASN  14           HB1      ASN  14  -4.692   5.594  -1.898
  121   HD21  ASN  14          HD21      ASN  14  -2.724   6.892  -1.964
  122   HD22  ASN  14          HD22      ASN  14  -1.240   6.222  -2.446
  123    H    GLU  15           HN       GLU  15  -6.331   4.336  -1.362
  124    HA   GLU  15           HA       GLU  15  -7.467   2.349   0.474
  125    HB2  GLU  15           HB2      GLU  15  -9.233   4.595  -0.425
  126    HB3  GLU  15           HB1      GLU  15  -9.389   3.541   0.981
  127    HG2  GLU  15           HG2      GLU  15  -7.347   4.634   1.949
  128    HG3  GLU  15           HG1      GLU  15  -7.371   5.769   0.600
  129    H    ARG  16           HN       ARG  16  -7.665   0.694  -0.921
  130    HA   ARG  16           HA       ARG  16  -9.409   1.079  -3.247
  131    HB2  ARG  16           HB2      ARG  16  -7.919   0.086  -4.802
  132    HB3  ARG  16           HB1      ARG  16  -6.951   1.279  -3.935
  133    HG2  ARG  16           HG2      ARG  16  -6.490  -0.781  -2.318
  134    HG3  ARG  16           HG1      ARG  16  -6.875  -1.707  -3.769
  135    HD2  ARG  16           HD2      ARG  16  -4.780   0.476  -3.575
  136    HD3  ARG  16           HD1      ARG  16  -4.456  -1.254  -3.629
  137    HE   ARG  16           HE       ARG  16  -5.246   0.432  -5.868
  138   HH11  ARG  16          HH11      ARG  16  -5.194  -0.601  -7.891
  139   HH12  ARG  16          HH12      ARG  16  -5.054  -2.325  -7.974
  140   HH21  ARG  16          HH21      ARG  16  -4.962  -2.748  -4.533
  141   HH22  ARG  16          HH22      ARG  16  -4.923  -3.541  -6.073
  Start of MODEL    9
    1    H1   GLY   1           HN       GLY   1  -9.081  -0.445  -0.043
    2    HA2  GLY   1           HA2      GLY   1  -8.029  -1.540  -2.371
    3    HA3  GLY   1           HA1      GLY   1  -6.893  -0.297  -1.853
    4    H    SER   2           HN       SER   2  -8.309  -3.395  -1.093
    5    HA   SER   2           HA       SER   2  -7.209  -3.787   1.471
    6    HB2  SER   2           HB2      SER   2  -7.283  -6.305   0.370
    7    HB3  SER   2           HB1      SER   2  -8.638  -5.500   1.157
    8    HG   SER   2           HG       SER   2  -9.511  -5.775  -0.751
    9    H    LYS   3           HN       LYS   3  -5.541  -3.110  -1.229
   10    HA   LYS   3           HA       LYS   3  -3.437  -5.066  -1.105
   11    HB2  LYS   3           HB2      LYS   3  -3.493  -2.327  -2.396
   12    HB3  LYS   3           HB1      LYS   3  -2.264  -3.565  -2.662
   13    HG2  LYS   3           HG2      LYS   3  -3.566  -4.348  -4.330
   14    HG3  LYS   3           HG1      LYS   3  -4.689  -4.893  -3.084
   15    HD2  LYS   3           HD2      LYS   3  -5.805  -2.674  -3.147
   16    HD3  LYS   3           HD1      LYS   3  -4.718  -2.185  -4.448
   17    HE2  LYS   3           HE2      LYS   3  -5.562  -3.999  -5.868
   18    HE3  LYS   3           HE1      LYS   3  -6.615  -4.548  -4.563
   19    HZ1  LYS   3           HZ1      LYS   3  -7.714  -3.111  -6.248
   20    HZ2  LYS   3           HZ2      LYS   3  -6.730  -1.825  -5.732
   21    HZ3  LYS   3           HZ3      LYS   3  -7.839  -2.534  -4.658
   22    H    ARG   4           HN       ARG   4  -3.294  -1.542  -0.549
   23    HA   ARG   4           HA       ARG   4  -1.854  -0.306   0.765
   24    HB2  ARG   4           HB2      ARG   4  -3.589  -1.137   2.374
   25    HB3  ARG   4           HB1      ARG   4  -2.499  -2.462   2.786
   26    HG2  ARG   4           HG2      ARG   4  -0.936  -0.121   2.920
   27    HG3  ARG   4           HG1      ARG   4  -2.459   0.276   3.714
   28    HD2  ARG   4           HD2      ARG   4  -0.644  -2.065   4.345
   29    HD3  ARG   4           HD1      ARG   4  -0.948  -0.663   5.366
   30    HE   ARG   4           HE       ARG   4  -3.433  -1.673   5.043
   31   HH11  ARG   4          HH11      ARG   4  -4.336  -3.321   6.319
   32   HH12  ARG   4          HH12      ARG   4  -3.304  -4.481   7.084
   33   HH21  ARG   4          HH21      ARG   4  -0.380  -3.094   5.840
   34   HH22  ARG   4          HH22      ARG   4  -1.063  -4.353   6.814
   35    H    PHE   5           HN       PHE   5   0.152  -0.494  -0.138
   36    HA   PHE   5           HA       PHE   5   1.903  -2.623   0.943
   37    HB2  PHE   5           HB2      PHE   5   1.322  -1.983  -1.746
   38    HB3  PHE   5           HB1      PHE   5   2.963  -1.413  -1.440
   39    HD1  PHE   5           HD1      PHE   5   4.663  -3.005  -0.459
   40    HD2  PHE   5           HD2      PHE   5   0.827  -4.307  -1.885
   41    HE1  PHE   5           HE1      PHE   5   5.493  -5.340  -0.558
   42    HE2  PHE   5           HE2      PHE   5   1.656  -6.643  -1.984
   43    HZ   PHE   5           HZ       PHE   5   3.989  -7.159  -1.320
   44    H    ARG   6           HN       ARG   6   3.518  -1.933   2.188
   45    HA   ARG   6           HA       ARG   6   4.550   0.807   1.806
   46    HB2  ARG   6           HB2      ARG   6   2.996   0.828   3.717
   47    HB3  ARG   6           HB1      ARG   6   3.908  -0.481   4.471
   48    HG2  ARG   6           HG2      ARG   6   5.792   0.880   4.846
   49    HG3  ARG   6           HG1      ARG   6   5.284   2.070   3.646
   50    HD2  ARG   6           HD2      ARG   6   4.931   2.413   6.309
   51    HD3  ARG   6           HD1      ARG   6   3.872   3.128   5.096
   52    HE   ARG   6           HE       ARG   6   2.206   1.620   5.721
   53   HH11  ARG   6          HH11      ARG   6   1.355   0.025   7.096
   54   HH12  ARG   6          HH12      ARG   6   2.414  -0.874   8.132
   55   HH21  ARG   6          HH21      ARG   6   5.279   0.761   7.062
   56   HH22  ARG   6          HH22      ARG   6   4.635  -0.456   8.112
   57    H    PHE   7           HN       PHE   7   6.471   0.204   0.898
   58    HA   PHE   7           HA       PHE   7   8.470  -0.894   2.670
   59    HB2  PHE   7           HB2      PHE   7   7.160  -2.859   1.555
   60    HB3  PHE   7           HB1      PHE   7   8.108  -2.440   0.131
   61    HD1  PHE   7           HD1      PHE   7   8.491  -3.105   3.798
   62    HD2  PHE   7           HD2      PHE   7  10.287  -3.277  -0.101
   63    HE1  PHE   7           HE1      PHE   7  10.448  -4.292   4.752
   64    HE2  PHE   7           HE2      PHE   7  12.244  -4.464   0.854
   65    HZ   PHE   7           HZ       PHE   7  12.325  -4.972   3.280
   66    HA   DPR   8           HA       DPR   8  11.052   1.558   0.070
   67    HB2  DPR   8           HB1      DPR   8  10.184   4.153   0.126
   68    HB3  DPR   8           HB2      DPR   8  11.004   3.361   1.486
   69    HG2  DPR   8           HG1      DPR   8   8.097   3.854   1.035
   70    HG3  DPR   8           HG2      DPR   8   9.049   4.004   2.522
   71    HD2  DPR   8           HD1      DPR   8   7.445   1.853   1.960
   72    HD3  DPR   8           HD2      DPR   8   8.900   1.744   2.979
   73    HA   PRO   9           HA       PRO   9   9.719   3.242  -3.985
   74    HB2  PRO   9           HB2      PRO   9  10.718   0.546  -4.807
   75    HB3  PRO   9           HB1      PRO   9  11.036   2.134  -5.531
   76    HG2  PRO   9           HG2      PRO   9  12.844   0.909  -4.008
   77    HG3  PRO   9           HG1      PRO   9  12.644   2.668  -3.990
   78    HD2  PRO   9           HD2      PRO   9  11.868   0.670  -1.929
   79    HD3  PRO   9           HD1      PRO   9  12.283   2.388  -1.738
   80    H    GLU  10           HN       GLU  10   8.624   0.563  -2.238
   81    HA   GLU  10           HA       GLU  10   6.444   0.039  -4.168
   82    HB2  GLU  10           HB2      GLU  10   8.000  -1.845  -3.252
   83    HB3  GLU  10           HB1      GLU  10   7.024  -1.698  -1.792
   84    HG2  GLU  10           HG2      GLU  10   4.971  -1.963  -3.233
   85    HG3  GLU  10           HG1      GLU  10   6.041  -2.331  -4.584
   86    H    ILE  11           HN       ILE  11   5.834   2.280  -3.132
   87    HA   ILE  11           HA       ILE  11   4.313   1.852  -0.643
   88    HB   ILE  11           HB       ILE  11   5.975   3.772  -0.853
   89   HG12  ILE  11          HG12      ILE  11   4.055   5.444  -0.048
   90   HG13  ILE  11          HG11      ILE  11   3.096   3.965  -0.057
   91   HG21  ILE  11          HG21      ILE  11   5.071   4.241  -3.258
   92   HG22  ILE  11          HG22      ILE  11   5.476   5.612  -2.223
   93   HG23  ILE  11          HG23      ILE  11   3.792   5.127  -2.426
   94   HD11  ILE  11          HD11      ILE  11   3.961   3.878   2.092
   95   HD12  ILE  11          HD12      ILE  11   5.464   4.677   1.631
   96   HD13  ILE  11          HD13      ILE  11   5.203   2.983   1.218
   97    H    ILE  12           HN       ILE  12   2.183   1.590  -0.754
   98    HA   ILE  12           HA       ILE  12   0.651   2.917  -2.868
   99    HB   ILE  12           HB       ILE  12   0.193  -0.011  -2.335
  100   HG12  ILE  12          HG12      ILE  12   2.007   1.256  -4.414
  101   HG13  ILE  12          HG11      ILE  12   2.498   0.160  -3.121
  102   HG21  ILE  12          HG21      ILE  12  -1.464   1.639  -3.494
  103   HG22  ILE  12          HG22      ILE  12  -1.143   0.086  -4.265
  104   HG23  ILE  12          HG23      ILE  12  -0.348   1.545  -4.856
  105   HD11  ILE  12          HD11      ILE  12   2.301  -1.353  -4.860
  106   HD12  ILE  12          HD12      ILE  12   1.022  -0.434  -5.653
  107   HD13  ILE  12          HD13      ILE  12   0.655  -1.407  -4.229
  108    H    PHE  13           HN       PHE  13   0.545   3.871  -0.431
  109    HA   PHE  13           HA       PHE  13  -1.485   2.539   1.172
  110    HB2  PHE  13           HB2      PHE  13   0.572   4.437   1.654
  111    HB3  PHE  13           HB1      PHE  13  -0.962   5.207   2.060
  112    HD1  PHE  13           HD1      PHE  13   0.955   2.027   2.558
  113    HD2  PHE  13           HD2      PHE  13  -2.025   4.713   4.094
  114    HE1  PHE  13           HE1      PHE  13   0.845   0.708   4.655
  115    HE2  PHE  13           HE2      PHE  13  -2.133   3.394   6.191
  116    HZ   PHE  13           HZ       PHE  13  -0.698   1.392   6.471
  117    H    ASN  14           HN       ASN  14  -3.604   2.996   1.182
  118    HA   ASN  14           HA       ASN  14  -4.717   5.517   0.495
  119    HB2  ASN  14           HB2      ASN  14  -5.649   5.112  -1.634
  120    HB3  ASN  14           HB1      ASN  14  -3.979   4.564  -1.771
  121   HD21  ASN  14          HD21      ASN  14  -6.029   3.531  -3.492
  122   HD22  ASN  14          HD22      ASN  14  -6.263   1.892  -3.113
  123    H    GLU  15           HN       GLU  15  -7.207   5.173   0.029
  124    HA   GLU  15           HA       GLU  15  -8.210   3.659   2.263
  125    HB2  GLU  15           HB2      GLU  15  -9.773   5.100   0.112
  126    HB3  GLU  15           HB1      GLU  15 -10.357   4.615   1.707
  127    HG2  GLU  15           HG2      GLU  15  -8.048   6.085   2.245
  128    HG3  GLU  15           HG1      GLU  15  -8.830   6.976   0.940
  129    H    ARG  16           HN       ARG  16 -10.470   3.499  -0.190
  130    HA   ARG  16           HA       ARG  16 -10.922   0.821  -0.176
  131    HB2  ARG  16           HB2      ARG  16 -11.817   1.080  -2.504
  132    HB3  ARG  16           HB1      ARG  16 -12.399   2.307  -1.377
  133    HG2  ARG  16           HG2      ARG  16  -9.957   3.261  -2.498
  134    HG3  ARG  16           HG1      ARG  16 -10.967   2.691  -3.826
  135    HD2  ARG  16           HD2      ARG  16 -11.384   5.087  -3.244
  136    HD3  ARG  16           HD1      ARG  16 -12.817   4.077  -3.084
  137    HE   ARG  16           HE       ARG  16 -11.286   4.382  -0.637
  138   HH11  ARG  16          HH11      ARG  16 -12.360   5.485   1.033
  139   HH12  ARG  16          HH12      ARG  16 -13.804   6.375   0.688
  140   HH21  ARG  16          HH21      ARG  16 -13.795   5.594  -2.690
  141   HH22  ARG  16          HH22      ARG  16 -14.617   6.438  -1.420
  Start of MODEL   10
    1    H1   GLY   1           HN       GLY   1  -8.654  -0.663   1.703
    2    HA2  GLY   1           HA2      GLY   1 -10.175  -2.784   2.610
    3    HA3  GLY   1           HA1      GLY   1  -9.516  -3.312   1.064
    4    H    SER   2           HN       SER   2  -7.883  -1.114   3.267
    5    HA   SER   2           HA       SER   2  -5.794  -1.240   4.232
    6    HB2  SER   2           HB2      SER   2  -5.519  -3.023   5.791
    7    HB3  SER   2           HB1      SER   2  -7.249  -2.696   5.723
    8    HG   SER   2           HG       SER   2  -5.950  -4.960   5.180
    9    H    LYS   3           HN       LYS   3  -5.380  -1.395   1.659
   10    HA   LYS   3           HA       LYS   3  -3.881  -3.850   1.060
   11    HB2  LYS   3           HB2      LYS   3  -4.756  -1.528  -0.669
   12    HB3  LYS   3           HB1      LYS   3  -3.743  -2.853  -1.246
   13    HG2  LYS   3           HG2      LYS   3  -6.229  -3.625   0.191
   14    HG3  LYS   3           HG1      LYS   3  -6.439  -2.906  -1.406
   15    HD2  LYS   3           HD2      LYS   3  -4.409  -5.088  -0.995
   16    HD3  LYS   3           HD1      LYS   3  -6.111  -5.495  -1.219
   17    HE2  LYS   3           HE2      LYS   3  -6.123  -4.832  -3.411
   18    HE3  LYS   3           HE1      LYS   3  -4.974  -3.523  -3.129
   19    HZ1  LYS   3           HZ1      LYS   3  -3.204  -5.150  -2.962
   20    HZ2  LYS   3           HZ2      LYS   3  -4.002  -5.295  -4.455
   21    HZ3  LYS   3           HZ3      LYS   3  -4.305  -6.415  -3.214
   22    H    ARG   4           HN       ARG   4  -2.836  -2.021   3.022
   23    HA   ARG   4           HA       ARG   4  -1.008  -0.145   2.263
   24    HB2  ARG   4           HB2      ARG   4  -1.458  -1.088   4.611
   25    HB3  ARG   4           HB1      ARG   4  -0.247  -2.309   4.220
   26    HG2  ARG   4           HG2      ARG   4   1.141  -0.159   3.463
   27    HG3  ARG   4           HG1      ARG   4   0.094   0.630   4.640
   28    HD2  ARG   4           HD2      ARG   4   1.828  -1.798   5.175
   29    HD3  ARG   4           HD1      ARG   4   2.177  -0.154   5.699
   30    HE   ARG   4           HE       ARG   4   0.288  -1.977   6.902
   31   HH11  ARG   4          HH11      ARG   4  -0.795  -1.193   8.740
   32   HH12  ARG   4          HH12      ARG   4  -0.777   0.503   9.092
   33   HH21  ARG   4          HH21      ARG   4   1.148   1.325   6.327
   34   HH22  ARG   4          HH22      ARG   4   0.324   1.927   7.726
   35    H    PHE   5           HN       PHE   5  -0.143  -0.484   0.247
   36    HA   PHE   5           HA       PHE   5   1.409  -2.876  -0.294
   37    HB2  PHE   5           HB2      PHE   5  -0.011  -1.153  -1.881
   38    HB3  PHE   5           HB1      PHE   5   1.646  -0.621  -2.164
   39    HD1  PHE   5           HD1      PHE   5  -0.777  -3.332  -2.582
   40    HD2  PHE   5           HD2      PHE   5   3.341  -2.198  -3.051
   41    HE1  PHE   5           HE1      PHE   5  -0.402  -5.297  -4.049
   42    HE2  PHE   5           HE2      PHE   5   3.715  -4.163  -4.517
   43    HZ   PHE   5           HZ       PHE   5   1.844  -5.712  -5.016
   44    H    ARG   6           HN       ARG   6   2.305  -1.301   1.926
   45    HA   ARG   6           HA       ARG   6   4.414   0.449   1.365
   46    HB2  ARG   6           HB2      ARG   6   3.357  -0.874   3.645
   47    HB3  ARG   6           HB1      ARG   6   5.091  -1.189   3.616
   48    HG2  ARG   6           HG2      ARG   6   5.488   1.256   3.300
   49    HG3  ARG   6           HG1      ARG   6   3.754   1.528   3.467
   50    HD2  ARG   6           HD2      ARG   6   3.923   1.481   5.708
   51    HD3  ARG   6           HD1      ARG   6   4.647  -0.121   5.642
   52    HE   ARG   6           HE       ARG   6   6.438   2.127   5.097
   53   HH11  ARG   6          HH11      ARG   6   8.187   2.290   6.529
   54   HH12  ARG   6          HH12      ARG   6   8.203   1.347   7.982
   55   HH21  ARG   6          HH21      ARG   6   5.147  -0.163   7.356
   56   HH22  ARG   6          HH22      ARG   6   6.485  -0.041   8.448
   57    H    PHE   7           HN       PHE   7   6.427   0.175   0.581
   58    HA   PHE   7           HA       PHE   7   7.807  -2.370   0.777
   59    HB2  PHE   7           HB2      PHE   7   6.264  -2.574  -1.218
   60    HB3  PHE   7           HB1      PHE   7   7.206  -1.291  -1.976
   61    HD1  PHE   7           HD1      PHE   7   9.215  -1.789  -3.097
   62    HD2  PHE   7           HD2      PHE   7   7.552  -4.640  -0.346
   63    HE1  PHE   7           HE1      PHE   7  10.923  -3.451  -3.786
   64    HE2  PHE   7           HE2      PHE   7   9.260  -6.301  -1.035
   65    HZ   PHE   7           HZ       PHE   7  10.945  -5.706  -2.756
   66    HA   DPR   8           HA       DPR   8  11.133   0.607   1.024
   67    HB2  DPR   8           HB1      DPR   8   9.580   3.043   1.733
   68    HB3  DPR   8           HB2      DPR   8  10.976   2.314   2.549
   69    HG2  DPR   8           HG1      DPR   8   8.507   2.114   3.537
   70    HG3  DPR   8           HG2      DPR   8   9.675   0.788   3.674
   71    HD2  DPR   8           HD1      DPR   8   7.323   1.084   1.833
   72    HD3  DPR   8           HD2      DPR   8   7.952  -0.373   2.633
   73    HA   PRO   9           HA       PRO   9  11.772   3.390  -2.471
   74    HB2  PRO   9           HB2      PRO   9  11.651   0.881  -4.081
   75    HB3  PRO   9           HB1      PRO   9  12.865   2.172  -4.098
   76    HG2  PRO   9           HG2      PRO   9  13.272  -0.202  -2.898
   77    HG3  PRO   9           HG1      PRO   9  14.010   1.307  -2.339
   78    HD2  PRO   9           HD2      PRO   9  11.883  -0.296  -1.074
   79    HD3  PRO   9           HD1      PRO   9  12.941   0.942  -0.364
   80    H    GLU  10           HN       GLU  10   9.166   1.259  -2.046
   81    HA   GLU  10           HA       GLU  10   7.479   2.887  -3.801
   82    HB2  GLU  10           HB2      GLU  10   7.592  -0.135  -3.972
   83    HB3  GLU  10           HB1      GLU  10   6.449   0.903  -4.827
   84    HG2  GLU  10           HG2      GLU  10   8.532   2.099  -5.773
   85    HG3  GLU  10           HG1      GLU  10   9.436   0.696  -5.206
   86    H    ILE  11           HN       ILE  11   5.384   3.076  -3.092
   87    HA   ILE  11           HA       ILE  11   4.344   1.340  -1.016
   88    HB   ILE  11           HB       ILE  11   5.602   2.803   0.396
   89   HG12  ILE  11          HG12      ILE  11   2.821   4.003   0.330
   90   HG13  ILE  11          HG11      ILE  11   3.146   2.388   0.962
   91   HG21  ILE  11          HG21      ILE  11   6.234   4.795  -0.439
   92   HG22  ILE  11          HG22      ILE  11   4.606   5.386  -0.101
   93   HG23  ILE  11          HG23      ILE  11   4.992   4.722  -1.689
   94   HD11  ILE  11          HD11      ILE  11   4.348   4.989   1.946
   95   HD12  ILE  11          HD12      ILE  11   4.817   3.392   2.526
   96   HD13  ILE  11          HD13      ILE  11   3.179   3.984   2.803
   97    H    ILE  12           HN       ILE  12   2.158   1.218  -1.139
   98    HA   ILE  12           HA       ILE  12   0.685   3.433  -2.385
   99    HB   ILE  12           HB       ILE  12   0.080   0.660  -3.341
  100   HG12  ILE  12          HG12      ILE  12   2.238   2.502  -4.417
  101   HG13  ILE  12          HG11      ILE  12   2.471   0.878  -3.767
  102   HG21  ILE  12          HG21      ILE  12  -1.314   2.811  -3.732
  103   HG22  ILE  12          HG22      ILE  12  -0.952   1.799  -5.131
  104   HG23  ILE  12          HG23      ILE  12  -0.025   3.272  -4.844
  105   HD11  ILE  12          HD11      ILE  12   0.550   0.456  -5.694
  106   HD12  ILE  12          HD12      ILE  12   2.279   0.192  -5.921
  107   HD13  ILE  12          HD13      ILE  12   1.545   1.712  -6.432
  108    H    PHE  13           HN       PHE  13  -1.110   3.845  -1.290
  109    HA   PHE  13           HA       PHE  13  -2.219   1.729   0.458
  110    HB2  PHE  13           HB2      PHE  13  -1.098   3.884   1.448
  111    HB3  PHE  13           HB1      PHE  13  -2.622   4.648   0.994
  112    HD1  PHE  13           HD1      PHE  13  -4.688   4.106   2.115
  113    HD2  PHE  13           HD2      PHE  13  -1.051   2.032   3.094
  114    HE1  PHE  13           HE1      PHE  13  -5.773   3.161   4.135
  115    HE2  PHE  13           HE2      PHE  13  -2.144   1.090   5.117
  116    HZ   PHE  13           HZ       PHE  13  -4.500   1.653   5.634
  117    H    ASN  14           HN       ASN  14  -2.788   3.102  -2.380
  118    HA   ASN  14           HA       ASN  14  -5.340   4.213  -2.333
  119    HB2  ASN  14           HB2      ASN  14  -5.518   3.327  -4.691
  120    HB3  ASN  14           HB1      ASN  14  -4.069   4.276  -4.363
  121   HD21  ASN  14          HD21      ASN  14  -3.673   1.380  -2.736
  122   HD22  ASN  14          HD22      ASN  14  -2.813   0.522  -3.923
  123    H    GLU  15           HN       GLU  15  -7.191   2.917  -3.629
  124    HA   GLU  15           HA       GLU  15  -8.875   1.370  -3.438
  125    HB2  GLU  15           HB2      GLU  15  -6.407  -0.118  -3.527
  126    HB3  GLU  15           HB1      GLU  15  -7.563  -0.937  -2.475
  127    HG2  GLU  15           HG2      GLU  15  -7.844  -1.685  -4.798
  128    HG3  GLU  15           HG1      GLU  15  -9.271  -0.803  -4.260
  129    H    ARG  16           HN       ARG  16 -10.310   0.573  -1.902
  130    HA   ARG  16           HA       ARG  16  -9.561   1.154   0.879
  131    HB2  ARG  16           HB2      ARG  16 -11.979   1.484  -0.716
  132    HB3  ARG  16           HB1      ARG  16 -12.291   0.650   0.800
  133    HG2  ARG  16           HG2      ARG  16 -12.492   3.072   1.121
  134    HG3  ARG  16           HG1      ARG  16 -11.103   2.464   2.021
  135    HD2  ARG  16           HD2      ARG  16 -10.306   3.127  -0.672
  136    HD3  ARG  16           HD1      ARG  16 -11.119   4.505   0.063
  137    HE   ARG  16           HE       ARG  16  -9.416   3.794   2.015
  138   HH11  ARG  16          HH11      ARG  16  -7.237   4.415   2.159
  139   HH12  ARG  16          HH12      ARG  16  -6.348   4.778   0.718
  140   HH21  ARG  16          HH21      ARG  16  -9.020   4.160  -1.404
  141   HH22  ARG  16          HH22      ARG  16  -7.357   4.634  -1.300