*HEADER    RNA BINDING PROTEIN                     03-JUL-18   6DZC              
*TITLE     SOLUTION STRUCTURE OF RBFOX2 RRM MIMETIC PEPTIDE CPFOX6               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: CPFOX6;                                                    
*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,G.VARANI                                                     
*REVDAT   1   15-MAY-19 6DZC    0                                                
# Restraints file 1: rrm06_peaklist_sort.tbl
!-------------------------------------------------------------------------!
!NOE Table for RRM06 peptide !
!Updated 031518 YTS
!RRM06, 16mer GLY SER ARG GLY PHE ARG PHE pro PRO LYS ILE ILE ARG 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  HA2)   (residue  2   and  name  HN)    4.5  1.6  1.6
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)    3.5  1.2  1.2
assign  (residue  3   and  name  HA)    (residue  4   and  name  HN)    2.5  0.7  0.7
assign  (residue  4   and  name  HA1)   (residue  4   and  name  HN)    2.5  0.7  0.7
assign  (residue  4   and  name  HA1)   (residue  5   and  name  HN)    2.5  0.7  0.7
assign  (residue  4   and  name  HA2)   (residue  4   and  name  HN)    2.5  0.7  0.7
assign  (residue  4   and  name  HA2)   (residue  5   and  name  HN)    2.5  0.7  0.7
assign  (residue  5   and  name  HA)    (residue  5   and  name  HN)    2.5  0.7  0.7
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)    3.5  1.2  1.2
assign  (residue  6   and  name  HA)    (residue  7   and  name  HN)    2.5  0.7  0.7
assign  (residue  7   and  name  HA)    (residue  7   and  name  HN)    4.5  1.6  1.6
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)    3.5  1.2  1.2
assign  (residue  10  and  name  HA)    (residue  11  and  name  HN)    2.5  0.7  0.7
assign  (residue  10  and  name  HA)    (residue  7   and  name  HN)    3.5  1.2  1.2
assign  (residue  11  and  name  HA)    (residue  11  and  name  HN)    2.5  0.7  0.7
assign  (residue  11  and  name  HA)    (residue  12  and  name  HN)    2.5  0.7  0.7
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)    2.5  0.7  0.7
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)    4.5  1.6  1.6
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  16  and  name  HA)    (residue  1   and  name  HN)    3.5  1.2  1.2
assign  (residue  16  and  name  HA)    (residue  16  and  name  HN)    2.5  0.7  0.7
assign  (residue  12  and  name  HA)    (residue  5   and  name  HN)    3.5  1.2  1.2


!HN-HN
assign  (residue  5   and  name  HN)    (residue  12  and  name  HN)    3.5  1.2  1.2
assign  (residue  6   and  name  HN)    (residue  7   and  name  HN)    4.5  1.6  1.6
assign  (residue  10  and  name  HN)    (residue  11  and  name  HN)    4.5  1.6  1.6
assign  (residue  10  and  name  HN)    (residue  7   and  name  HN)    3.5  1.2  1.2
assign  (residue  11  and  name  HN)    (residue  12  and  name  HN)    4.5  1.6  1.6
assign  (residue  13  and  name  HN)    (residue  12  and  name  HN)    4.5  1.6  1.6
assign  (residue  5   and  name  HN)    (residue  6   and  name  HN)    4.5  1.6  1.6

!HA-HA
assign  (residue  4   and  name  HA2)   (residue  4   and  name  HA1)   2.5  0.7  0.7
assign  (residue  13  and  name  HA)    (residue  4   and  name  HA1)   4.5  1.6  1.6
assign  (residue  13  and  name  HA)    (residue  4   and  name  HA2)   3.5  1.2  1.2

!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**!
!GLY	1

!SER	2
assign  (residue  2   and  name  HA)    (residue  2   and  name  HB1)   2.5  0.7  0.7
assign  (residue  2   and  name  HA)    (residue  2   and  name  HB2)   2.5  0.7  0.7
assign  (residue  2   and  name  HB1)   (residue  2   and  name  HN)    4.5  1.6  1.6

!ARG	3
assign  (residue  3   and  name  HA)    (residue  3   and  name  HB1)   2.5  0.7  0.7
assign  (residue  3   and  name  HA)    (residue  3   and  name  HB2)   3.5  1.2  1.2
assign  (residue  3   and  name  HA)    (residue  3   and  name  HG1)   4.5  1.6  1.6
assign  (residue  3   and  name  HA)    (residue  3   and  name  HG2)   3.5  1.2  1.2
assign  (residue  3   and  name  HB1)   (residue  3   and  name  HN)    3.5  1.2  1.2
assign  (residue  3   and  name  HB2)   (residue  3   and  name  HN)    4.5  1.6  1.6
assign  (residue  3   and  name  HG1)   (residue  3   and  name  HN)    4.5  1.6  1.6
assign  (residue  3   and  name  HG2)   (residue  3   and  name  HN)    4.5  1.6  1.6
assign  (residue  3   and  name  HB1)   (residue  4   and  name  HN)    4.5  1.6  1.6
assign  (residue  3   and  name  HB2)   (residue  4   and  name  HN)    4.5  1.6  1.6  
assign  (residue  3   and  name  HG1)   (residue  4   and  name  HN)    4.5  1.6  1.6  
assign  (residue  3   and  name  HB1)   (residue  14  and  name  HD#)   4.5  1.6  1.6

!GLY	4
assign  (residue  4   and  name  HA2)   (residue  13  and  name  HB1)    3.5  1.2  1.2

!PHE	5
assign  (residue  5   and  name  HA)    (residue  5   and  name  HB1)   4.5  1.6  1.6
assign  (residue  5   and  name  HA)    (residue  5   and  name  HB2)   3.5  1.2  1.2
assign  (residue  5   and  name  HB1)   (residue  4   and  name  HN)    4.5  1.6  1.6
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  HN)    3.5  1.2  1.2
assign  (residue  5   and  name  HB2)   (residue  6   and  name  HN)    3.5  1.2  1.2
assign  (residue  5   and  name  HD#)   (residue  5   and  name  HB1)   2.5  0.7  0.7
assign  (residue  5   and  name  HD#)   (residue  5   and  name  HB2)   2.5  0.7  0.7
assign  (residue  5   and  name  HD#)   (residue  5   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
assign  (residue  5   and  name  HD#)   (residue  10  and  name  HD#)   4.5  1.6  1.6



!ARG	6
assign  (residue  6   and  name  HA)    (residue  6   and  name  HB1)   4.5  1.6  1.6
assign  (residue  6   and  name  HA)    (residue  6   and  name  HB2)   4.5  1.6  1.6
assign  (residue  6   and  name  HA)    (residue  6   and  name  HG2)   4.5  1.6  1.6
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)    3.5  1.2  1.2
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  HG1)   (residue  11  and  name  HN)    3.5  1.2  1.2
assign  (residue  6   and  name  HG1)   (residue  6   and  name  HN)    4.5  1.6  1.6
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  HN)    4.5  1.6  1.6

!PHE	7
assign  (residue  7   and  name  HA)    (residue  7   and  name  HB1)   4.5  1.6  1.6
assign  (residue  7   and  name  HA)    (residue  7   and  name  HB2)   2.5  0.7  0.7
assign  (residue  7   and  name  HA)    (residue  8   and  name  HD1)   2.5  0.7  0.7
assign  (residue  7   and  name  HA)    (residue  8   and  name  HD2)   2.5  0.7  0.7
assign  (residue  7   and  name  HA)    (residue  8   and  name  HG#)   4.5  1.6  1.6
assign  (residue  7   and  name  HB1)   (residue  7   and  name  HN)    3.5  1.2  1.2
assign  (residue  7   and  name  HB2)   (residue  7   and  name  HN)    3.5  1.2  1.2
assign  (residue  7   and  name  HB2)   (residue  10  and  name  HN)    4.5  1.6  1.6
assign  (residue  7   and  name  HD#)   (residue  10  and  name  HB#)   4.5  1.6  1.6
assign  (residue  7   and  name  HD#)   (residue  7   and  name  HB1)   4.5  1.6  1.6
assign  (residue  7   and  name  HD#)   (residue  7   and  name  HN)    4.5  1.6  1.6
assign  (residue  7   and  name  HD#)   (residue  12  and  name  HB)    4.5  1.6  1.6
assign  (residue  7   and  name  HD#)   (residue  5   and  name  HB1)   3.5  1.2  1.2

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

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

!LYS	10
assign  (residue  10  and  name  HA)    (residue  10  and  name  HB#)   2.5  0.7  0.7
assign  (residue  10  and  name  HA)    (residue  10  and  name  HD#)   3.5  1.2  1.2
assign  (residue  10  and  name  HA)    (residue  10  and  name  HG1)   4.5  1.6  1.6
assign  (residue  10  and  name  HA)    (residue  10  and  name  HG2)   4.5  1.6  1.6
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)    2.5  0.7  0.7
assign  (residue  10  and  name  HB#)   (residue  7   and  name  HN)    4.5  1.6  1.6
assign  (residue  10  and  name  HG1)   (residue  10  and  name  HN)    4.5  1.6  1.6
assign  (residue  10  and  name  HG2)   (residue  10  and  name  HN)    4.5  1.6  1.6
assign  (residue  10  and  name  HG2)   (residue  11  and  name  HN)    2.5  0.7  0.7
!assign  (residue  10  and  name  HB#)   (residue  7   and  name  HB1)   3.5  1.2  1.2
!assign  (residue  10  and  name  HB#)   (residue  7   and  name  HB2)   3.5  1.2  1.2


!ILE	11
assign  (residue  11  and  name  HA)    (residue  11  and  name  HD#)   2.5  0.7  0.7
assign  (residue  11  and  name  HA)    (residue  11  and  name  HG1#)  4.5  1.6  1.6
assign  (residue  11  and  name  HA)    (residue  11  and  name  HG2#)  3.5  1.2  1.2
assign  (residue  11  and  name  HB)    (residue  11  and  name  HN)    3.5  1.2  1.2
assign  (residue  11  and  name  HD#)   (residue  11  and  name  HN)    3.5  1.2  1.2
assign  (residue  11  and  name  HD#)   (residue  5   and  name  HN)    3.5  1.2  1.2
assign  (residue  11  and  name  HG1#)  (residue  11  and  name  HN)    3.5  1.2  1.2
assign  (residue  11  and  name  HG2#)  (residue  11  and  name  HN)    4.5  1.6  1.6
assign  (residue  11  and  name  HG1#)  (residue  6   and  name  HG1)   3.5  1.2  1.2
assign  (residue  11  and  name  HG2#)  (residue  6   and  name  HG1)   2.5  0.7  0.7
assign  (residue  11  and  name  HD#)   (residue  6   and  name  HG2)   4.5  1.6  1.6
!assign  (residue  11  and  name  HG1#)  (residue  13  and  name  HB1)   4.5  1.6  1.6


!ILE	12
assign  (residue  12  and  name  HA)    (residue  12  and  name  HG1#)  4.5  1.6  1.6
assign  (residue  12  and  name  HA)    (residue  12  and  name  HG1#)  4.5  1.6  1.6
assign  (residue  12  and  name  HA)    (residue  12  and  name  HG2#)  2.5  0.7  0.7
assign  (residue  12  and  name  HB)    (residue  12  and  name  HN)    2.5  0.7  0.7
assign  (residue  12  and  name  HB)    (residue  5   and  name  HN)    3.5  1.2  1.2
assign  (residue  12  and  name  HD#)   (residue  12  and  name  HA)    2.5  0.7  0.7
assign  (residue  12  and  name  HD#)   (residue  12  and  name  HN)    2.5  0.7  0.7
assign  (residue  12  and  name  HD#)   (residue  13  and  name  HN)    4.5  1.6  1.6
assign  (residue  12  and  name  HD#)   (residue  7   and  name  HN)    4.5  1.6  1.6
assign  (residue  12  and  name  HG1#)  (residue  12  and  name  HN)    3.5  1.2  1.2
assign  (residue  12  and  name  HG1#)  (residue  13  and  name  HN)    4.5  1.6  1.6
assign  (residue  12  and  name  HG1#)  (residue  12  and  name  HN)    3.5  1.2  1.2
assign  (residue  12  and  name  HG1#)  (residue  13  and  name  HN)    4.5  1.6  1.6  
assign  (residue  12  and  name  HG1#)  (residue  5   and  name  HN)    4.5  1.6  1.6
assign  (residue  12  and  name  HG2#)  (residue  12  and  name  HN)    3.5  1.2  1.2
assign  (residue  12  and  name  HG2#)  (residue  13  and  name  HN)    2.5  0.7  0.7
assign  (residue  12  and  name  HD#)   (residue  10  and  name  HB#)   4.5  1.6  1.6
assign  (residue  12  and  name  HD#)   (residue  14  and  name  HD#)   4.5  1.6  1.6
assign  (residue  12  and  name  HD#)   (residue  4   and  name  HA#)   3.5  1.2  1.2
!assign  (residue  12  and  name  HG2#)  (residue  3   and  name  HG2)   3.5  1.2  1.2

!ARG	13
assign  (residue  13  and  name  HA)    (residue  13  and  name  HB1)   2.5  0.7  0.7
assign  (residue  13  and  name  HA)    (residue  13  and  name  HB2)   3.5  1.2  1.2
assign  (residue  13  and  name  HA)    (residue  13  and  name  HG1)   3.5  1.2  1.2
assign  (residue  13  and  name  HA)    (residue  13  and  name  HG2)   4.5  1.6  1.6
assign  (residue  13  and  name  HB1)   (residue  13  and  name  HN)    2.5  0.7  0.7
assign  (residue  13  and  name  HG1)   (residue  13  and  name  HN)    4.5  1.6  1.6
assign  (residue  13  and  name  HG2)   (residue  13  and  name  HN)    4.5  1.6  1.6

!ASN	14
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  HD#)   2.5  0.7  0.7
assign  (residue  14  and  name  HB#)   (residue  14  and  name  HN)    3.5  1.2  1.2
assign  (residue  14  and  name  HB#)   (residue  15  and  name  HN)    2.5  0.7  0.7
assign  (residue  14  and  name  HB#)   (residue  16  and  name  HN)    4.5  1.6  1.6
assign  (residue  14  and  name  HD#)   (residue  14  and  name  HB#)   3.5  1.2  1.2
!assign  (residue  14  and  name  HD#)   (residue  14  and  name  HD#)   2.5  0.7  0.7
assign  (residue  14  and  name  HD#)   (residue  14  and  name  HB#)   2.5  0.7  0.7

!GLU	15
assign  (residue  15  and  name  HA)    (residue  15  and  name  HB1)   3.5  1.2  1.2
assign  (residue  15  and  name  HA)    (residue  15  and  name  HG1)   3.5  1.2  1.2
assign  (residue  15  and  name  HA)    (residue  15  and  name  HG2)   3.5  1.2  1.2
assign  (residue  15  and  name  HB1)   (residue  15  and  name  HN)    3.5  1.2  1.2
assign  (residue  15  and  name  HG1)   (residue  15  and  name  HN)    4.5  1.6  1.6
assign  (residue  15  and  name  HG1)   (residue  16  and  name  HN)    4.5  1.6  1.6
assign  (residue  15  and  name  HG2)   (residue  15  and  name  HN)    4.5  1.6  1.6

!ARG	16
assign  (residue  16  and  name  HA)    (residue  16  and  name  HB1)   3.5  1.2  1.2
assign  (residue  16  and  name  HA)    (residue  16  and  name  HB2)   3.5  1.2  1.2
assign  (residue  16  and  name  HA)    (residue  16  and  name  HG2)   4.5  1.6  1.6
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  HN)    4.5  1.6  1.6
assign  (residue  16  and  name  HG2)   (residue  16  and  name  HN)    4.5  1.6  1.6
assign  (residue  16  and  name  HB2)   (residue  1   and  name  HN)    4.5  1.6  1.6  
assign  (residue  16  and  name  HB2)   (residue  14  and  name  HD#)   4.5  1.6  1.6

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           HN       GLY   1  -9.809   1.796   0.563
    2    HA2  GLY   1           HA2      GLY   1 -10.444   4.384   1.612
    3    HA3  GLY   1           HA1      GLY   1  -9.637   3.078   2.475
    4    H    SER   2           HN       SER   2  -8.578   4.564  -0.556
    5    HA   SER   2           HA       SER   2  -6.609   5.600  -1.129
    6    HB2  SER   2           HB2      SER   2  -7.699   6.994   1.067
    7    HB3  SER   2           HB1      SER   2  -5.974   6.846   1.391
    8    HG   SER   2           HG       SER   2  -5.529   7.943  -0.419
    9    H    ARG   3           HN       ARG   3  -4.318   6.211   0.267
   10    HA   ARG   3           HA       ARG   3  -2.333   5.248   0.915
   11    HB2  ARG   3           HB2      ARG   3  -4.208   3.559   2.591
   12    HB3  ARG   3           HB1      ARG   3  -2.467   3.684   2.824
   13    HG2  ARG   3           HG2      ARG   3  -3.023   6.293   2.879
   14    HG3  ARG   3           HG1      ARG   3  -4.604   5.696   3.387
   15    HD2  ARG   3           HD2      ARG   3  -3.306   6.036   5.383
   16    HD3  ARG   3           HD1      ARG   3  -3.416   4.296   5.123
   17    HE   ARG   3           HE       ARG   3  -1.059   5.579   3.991
   18   HH11  ARG   3          HH11      ARG   3   0.913   4.858   4.853
   19   HH12  ARG   3          HH12      ARG   3   0.924   3.900   6.295
   20   HH21  ARG   3          HH21      ARG   3  -2.525   3.921   6.654
   21   HH22  ARG   3          HH22      ARG   3  -1.022   3.370   7.316
   22    H    GLY   4           HN       GLY   4  -1.324   4.189  -0.669
   23    HA2  GLY   4           HA2      GLY   4  -1.257   1.397  -0.834
   24    HA3  GLY   4           HA1      GLY   4  -2.362   1.971  -2.080
   25    H    PHE   5           HN       PHE   5   0.766   1.148  -1.495
   26    HA   PHE   5           HA       PHE   5   1.758   1.789  -4.008
   27    HB2  PHE   5           HB2      PHE   5   1.788   4.093  -3.672
   28    HB3  PHE   5           HB1      PHE   5   2.172   3.939  -1.957
   29    HD1  PHE   5           HD1      PHE   5   3.574   3.279  -5.362
   30    HD2  PHE   5           HD2      PHE   5   4.402   4.097  -1.227
   31    HE1  PHE   5           HE1      PHE   5   5.987   3.495  -5.889
   32    HE2  PHE   5           HE2      PHE   5   6.817   4.315  -1.754
   33    HZ   PHE   5           HZ       PHE   5   7.609   4.014  -4.086
   34    H    ARG   6           HN       ARG   6   3.398   0.417  -4.281
   35    HA   ARG   6           HA       ARG   6   4.510  -1.139  -2.238
   36    HB2  ARG   6           HB2      ARG   6   4.753  -0.898  -5.073
   37    HB3  ARG   6           HB1      ARG   6   6.382  -0.874  -4.403
   38    HG2  ARG   6           HG2      ARG   6   5.888  -3.171  -4.772
   39    HG3  ARG   6           HG1      ARG   6   5.688  -2.938  -3.038
   40    HD2  ARG   6           HD2      ARG   6   3.741  -4.109  -3.611
   41    HD3  ARG   6           HD1      ARG   6   3.193  -2.437  -3.653
   42    HE   ARG   6           HE       ARG   6   3.031  -2.582  -5.987
   43   HH11  ARG   6          HH11      ARG   6   2.897  -3.817  -7.887
   44   HH12  ARG   6          HH12      ARG   6   3.526  -5.430  -7.910
   45   HH21  ARG   6          HH21      ARG   6   4.569  -5.362  -4.607
   46   HH22  ARG   6          HH22      ARG   6   4.471  -6.303  -6.056
   47    H    PHE   7           HN       PHE   7   6.212  -0.852  -0.858
   48    HA   PHE   7           HA       PHE   7   8.019   1.421  -1.346
   49    HB2  PHE   7           HB2      PHE   7   5.966   1.677   0.406
   50    HB3  PHE   7           HB1      PHE   7   7.203   1.039   1.480
   51    HD1  PHE   7           HD1      PHE   7   9.674   2.183   0.196
   52    HD2  PHE   7           HD2      PHE   7   5.839   3.958   1.002
   53    HE1  PHE   7           HE1      PHE   7  10.725   4.423   0.279
   54    HE2  PHE   7           HE2      PHE   7   6.898   6.196   1.083
   55    HZ   PHE   7           HZ       PHE   7   9.339   6.430   0.723
   56    HA   DPR   8           HA       DPR   8  11.502  -1.135  -0.687
   57    HB2  DPR   8           HB2      DPR   8  11.636  -2.895  -2.202
   58    HB3  DPR   8           HB1      DPR   8   9.954  -3.387  -1.928
   59    HG2  DPR   8           HG2      DPR   8  11.034  -1.214  -3.625
   60    HG3  DPR   8           HG1      DPR   8   9.595  -2.221  -3.851
   61    HD2  DPR   8           HD2      DPR   8   9.651   0.419  -2.810
   62    HD3  DPR   8           HD1      DPR   8   8.267  -0.695  -2.800
   63    HA   PRO   9           HA       PRO   9  10.972  -3.939   2.742
   64    HB2  PRO   9           HB2      PRO   9  11.195  -2.207   4.858
   65    HB3  PRO   9           HB1      PRO   9  12.577  -2.764   3.896
   66    HG2  PRO   9           HG2      PRO   9  11.093  -0.191   3.766
   67    HG3  PRO   9           HG1      PRO   9  12.828  -0.508   3.591
   68    HD2  PRO   9           HD2      PRO   9  11.175  -0.059   1.455
   69    HD3  PRO   9           HD1      PRO   9  12.643  -1.055   1.356
   70    H    LYS  10           HN       LYS  10   8.630  -2.018   1.679
   71    HA   LYS  10           HA       LYS  10   6.631  -3.153   3.383
   72    HB2  LYS  10           HB2      LYS  10   7.484  -1.232   4.767
   73    HB3  LYS  10           HB1      LYS  10   6.966  -0.149   3.487
   74    HG2  LYS  10           HG2      LYS  10   4.626  -1.237   3.787
   75    HG3  LYS  10           HG1      LYS  10   5.260  -1.828   5.325
   76    HD2  LYS  10           HD2      LYS  10   6.043   0.748   5.483
   77    HD3  LYS  10           HD1      LYS  10   4.602   0.944   4.483
   78    HE2  LYS  10           HE2      LYS  10   3.807   1.101   6.713
   79    HE3  LYS  10           HE1      LYS  10   3.411  -0.544   6.213
   80    HZ1  LYS  10           HZ1      LYS  10   5.788   0.274   7.793
   81    HZ2  LYS  10           HZ2      LYS  10   5.449  -1.309   7.280
   82    HZ3  LYS  10           HZ3      LYS  10   4.424  -0.536   8.393
   83    H    ILE  11           HN       ILE  11   4.561  -2.922   2.564
   84    HA   ILE  11           HA       ILE  11   4.189  -1.346   0.125
   85    HB   ILE  11           HB       ILE  11   3.534  -3.136  -1.256
   86   HG12  ILE  11          HG12      ILE  11   3.532  -5.533  -0.142
   87   HG13  ILE  11          HG11      ILE  11   3.267  -4.634   1.346
   88   HG21  ILE  11          HG21      ILE  11   5.764  -4.377   0.364
   89   HG22  ILE  11          HG22      ILE  11   6.015  -3.015  -0.725
   90   HG23  ILE  11          HG23      ILE  11   5.443  -4.556  -1.358
   91   HD11  ILE  11          HD11      ILE  11   1.072  -4.552   0.833
   92   HD12  ILE  11          HD12      ILE  11   1.375  -5.293  -0.735
   93   HD13  ILE  11          HD13      ILE  11   1.459  -3.544  -0.560
   94    H    ILE  12           HN       ILE  12   2.236  -0.425   0.060
   95    HA   ILE  12           HA       ILE  12   0.216  -1.346   2.013
   96    HB   ILE  12           HB       ILE  12   0.457   1.396   0.757
   97   HG12  ILE  12          HG12      ILE  12   2.441   1.041   2.096
   98   HG13  ILE  12          HG11      ILE  12   1.346   2.074   3.011
   99   HG21  ILE  12          HG21      ILE  12  -1.751   1.134   1.528
  100   HG22  ILE  12          HG22      ILE  12  -0.935   1.923   2.877
  101   HG23  ILE  12          HG23      ILE  12  -1.250   0.191   2.933
  102   HD11  ILE  12          HD11      ILE  12   1.997   0.506   4.620
  103   HD12  ILE  12          HD12      ILE  12   2.028  -0.818   3.460
  104   HD13  ILE  12          HD13      ILE  12   0.487  -0.187   4.032
  105    H    ARG  13           HN       ARG  13  -2.000  -1.330   1.372
  106    HA   ARG  13           HA       ARG  13  -2.747  -0.788  -1.347
  107    HB2  ARG  13           HB2      ARG  13  -2.953  -2.901  -2.236
  108    HB3  ARG  13           HB1      ARG  13  -1.526  -3.137  -1.228
  109    HG2  ARG  13           HG2      ARG  13  -3.174  -3.840   0.630
  110    HG3  ARG  13           HG1      ARG  13  -4.376  -3.963  -0.656
  111    HD2  ARG  13           HD2      ARG  13  -2.363  -5.329  -1.809
  112    HD3  ARG  13           HD1      ARG  13  -1.996  -5.656  -0.117
  113    HE   ARG  13           HE       ARG  13  -4.325  -6.583  -1.602
  114   HH11  ARG  13          HH11      ARG  13  -5.615  -8.086  -0.496
  115   HH12  ARG  13          HH12      ARG  13  -5.375  -8.345   1.200
  116   HH21  ARG  13          HH21      ARG  13  -2.799  -6.039   1.460
  117   HH22  ARG  13          HH22      ARG  13  -3.780  -7.188   2.306
  118    H    ASN  14           HN       ASN  14  -4.926  -0.593  -1.589
  119    HA   ASN  14           HA       ASN  14  -6.816  -1.751   0.230
  120    HB2  ASN  14           HB2      ASN  14  -6.042   1.141   0.519
  121    HB3  ASN  14           HB1      ASN  14  -7.657   0.586   0.952
  122   HD21  ASN  14          HD21      ASN  14  -7.502  -1.593   2.388
  123   HD22  ASN  14          HD22      ASN  14  -6.371  -1.511   3.651
  124    H    GLU  15           HN       GLU  15  -5.912   0.073  -2.472
  125    HA   GLU  15           HA       GLU  15  -7.106   1.057  -4.222
  126    HB2  GLU  15           HB2      GLU  15  -6.890  -1.554  -4.470
  127    HB3  GLU  15           HB1      GLU  15  -8.643  -1.508  -4.278
  128    HG2  GLU  15           HG2      GLU  15  -8.365  -1.303  -6.602
  129    HG3  GLU  15           HG1      GLU  15  -8.564   0.368  -6.078
  130    H    ARG  16           HN       ARG  16  -8.297   1.871  -1.798
  131    HA   ARG  16           HA       ARG  16 -10.851   2.690  -2.718
  132    HB2  ARG  16           HB2      ARG  16 -11.279   0.264  -2.037
  133    HB3  ARG  16           HB1      ARG  16 -10.982   0.785  -0.380
  134    HG2  ARG  16           HG2      ARG  16 -13.260   1.135  -0.460
  135    HG3  ARG  16           HG1      ARG  16 -12.720   2.697  -1.078
  136    HD2  ARG  16           HD2      ARG  16 -14.462   1.792  -2.537
  137    HD3  ARG  16           HD1      ARG  16 -12.924   1.826  -3.395
  138    HE   ARG  16           HE       ARG  16 -13.472  -0.689  -2.068
  139   HH11  ARG  16          HH11      ARG  16 -13.792  -2.465  -3.448
  140   HH12  ARG  16          HH12      ARG  16 -14.075  -2.202  -5.136
  141   HH21  ARG  16          HH21      ARG  16 -13.879   1.251  -4.904
  142   HH22  ARG  16          HH22      ARG  16 -14.124  -0.099  -5.961
  Start of MODEL    2
    1    H1   GLY   1           HN       GLY   1 -11.094   0.683  -1.181
    2    HA2  GLY   1           HA2      GLY   1 -11.760   3.197  -0.546
    3    HA3  GLY   1           HA1      GLY   1 -10.231   3.030   0.312
    4    H    SER   2           HN       SER   2  -8.841   4.245  -0.851
    5    HA   SER   2           HA       SER   2  -8.005   3.308  -3.434
    6    HB2  SER   2           HB2      SER   2  -8.378   5.751  -4.369
    7    HB3  SER   2           HB1      SER   2  -9.655   4.542  -4.473
    8    HG   SER   2           HG       SER   2  -9.936   6.827  -3.424
    9    H    ARG   3           HN       ARG   3  -6.132   3.133  -1.995
   10    HA   ARG   3           HA       ARG   3  -4.314   5.287  -2.367
   11    HB2  ARG   3           HB2      ARG   3  -5.755   6.122  -0.436
   12    HB3  ARG   3           HB1      ARG   3  -5.055   4.817   0.521
   13    HG2  ARG   3           HG2      ARG   3  -2.830   5.945  -0.661
   14    HG3  ARG   3           HG1      ARG   3  -3.849   7.350  -0.344
   15    HD2  ARG   3           HD2      ARG   3  -2.404   6.869   1.591
   16    HD3  ARG   3           HD1      ARG   3  -4.101   6.644   2.004
   17    HE   ARG   3           HE       ARG   3  -2.744   4.234   1.120
   18   HH11  ARG   3          HH11      ARG   3  -2.577   2.604   2.688
   19   HH12  ARG   3          HH12      ARG   3  -2.897   2.970   4.350
   20   HH21  ARG   3          HH21      ARG   3  -3.616   6.308   3.749
   21   HH22  ARG   3          HH22      ARG   3  -3.487   5.068   4.951
   22    H    GLY   4           HN       GLY   4  -2.382   4.356  -2.571
   23    HA2  GLY   4           HA2      GLY   4  -1.505   2.269  -0.754
   24    HA3  GLY   4           HA1      GLY   4  -1.745   1.737  -2.419
   25    H    PHE   5           HN       PHE   5   0.712   1.405  -1.617
   26    HA   PHE   5           HA       PHE   5   2.283   3.051  -3.314
   27    HB2  PHE   5           HB2      PHE   5   1.971   4.630  -1.397
   28    HB3  PHE   5           HB1      PHE   5   2.761   3.451  -0.351
   29    HD1  PHE   5           HD1      PHE   5   3.296   5.228  -3.615
   30    HD2  PHE   5           HD2      PHE   5   5.082   3.569  -0.073
   31    HE1  PHE   5           HE1      PHE   5   5.515   6.073  -4.334
   32    HE2  PHE   5           HE2      PHE   5   7.297   4.415  -0.795
   33    HZ   PHE   5           HZ       PHE   5   7.514   5.668  -2.925
   34    H    ARG   6           HN       ARG   6   4.621   2.466  -3.160
   35    HA   ARG   6           HA       ARG   6   4.972  -0.256  -2.048
   36    HB2  ARG   6           HB2      ARG   6   4.966   0.361  -4.723
   37    HB3  ARG   6           HB1      ARG   6   6.673   0.571  -4.337
   38    HG2  ARG   6           HG2      ARG   6   6.861  -1.691  -3.533
   39    HG3  ARG   6           HG1      ARG   6   5.111  -1.924  -3.594
   40    HD2  ARG   6           HD2      ARG   6   6.823  -1.325  -6.017
   41    HD3  ARG   6           HD1      ARG   6   6.334  -2.946  -5.531
   42    HE   ARG   6           HE       ARG   6   4.701  -1.015  -6.875
   43   HH11  ARG   6          HH11      ARG   6   2.533  -1.588  -7.241
   44   HH12  ARG   6          HH12      ARG   6   1.823  -2.887  -6.341
   45   HH21  ARG   6          HH21      ARG   6   4.705  -3.566  -4.536
   46   HH22  ARG   6          HH22      ARG   6   3.052  -4.006  -4.810
   47    H    PHE   7           HN       PHE   7   6.558  -0.461  -0.608
   48    HA   PHE   7           HA       PHE   7   8.788   1.466  -0.669
   49    HB2  PHE   7           HB2      PHE   7   6.727   1.531   1.206
   50    HB3  PHE   7           HB1      PHE   7   8.039   0.725   2.056
   51    HD1  PHE   7           HD1      PHE   7  10.469   1.929   1.020
   52    HD2  PHE   7           HD2      PHE   7   6.668   3.781   1.832
   53    HE1  PHE   7           HE1      PHE   7  11.593   4.116   1.319
   54    HE2  PHE   7           HE2      PHE   7   7.802   5.964   2.128
   55    HZ   PHE   7           HZ       PHE   7  10.262   6.133   1.871
   56    HA   DPR   8           HA       DPR   8  11.733  -1.764  -0.541
   57    HB2  DPR   8           HB2      DPR   8  11.705  -3.054  -2.474
   58    HB3  DPR   8           HB1      DPR   8   9.947  -3.286  -2.410
   59    HG2  DPR   8           HG2      DPR   8  11.513  -0.967  -3.389
   60    HG3  DPR   8           HG1      DPR   8   9.971  -1.617  -3.966
   61    HD2  DPR   8           HD2      DPR   8  10.294   0.609  -2.260
   62    HD3  DPR   8           HD1      DPR   8   8.775  -0.254  -2.580
   63    HA   PRO   9           HA       PRO   9  10.366  -5.243   1.924
   64    HB2  PRO   9           HB2      PRO   9  10.900  -4.328   4.435
   65    HB3  PRO   9           HB1      PRO   9  12.169  -4.832   3.301
   66    HG2  PRO   9           HG2      PRO   9  11.234  -2.092   4.000
   67    HG3  PRO   9           HG1      PRO   9  12.880  -2.689   3.727
   68    HD2  PRO   9           HD2      PRO   9  11.468  -1.297   1.836
   69    HD3  PRO   9           HD1      PRO   9  12.718  -2.497   1.434
   70    H    LYS  10           HN       LYS  10   8.569  -2.613   1.504
   71    HA   LYS  10           HA       LYS  10   6.324  -3.673   2.960
   72    HB2  LYS  10           HB2      LYS  10   6.849  -2.526   4.854
   73    HB3  LYS  10           HB1      LYS  10   7.842  -1.351   4.001
   74    HG2  LYS  10           HG2      LYS  10   5.898  -0.112   3.288
   75    HG3  LYS  10           HG1      LYS  10   4.815  -1.388   3.851
   76    HD2  LYS  10           HD2      LYS  10   6.604  -0.471   5.960
   77    HD3  LYS  10           HD1      LYS  10   5.617   0.840   5.312
   78    HE2  LYS  10           HE2      LYS  10   3.582  -0.409   5.718
   79    HE3  LYS  10           HE1      LYS  10   4.503  -1.839   6.187
   80    HZ1  LYS  10           HZ1      LYS  10   4.207  -1.010   8.237
   81    HZ2  LYS  10           HZ2      LYS  10   3.932   0.574   7.689
   82    HZ3  LYS  10           HZ3      LYS  10   5.519  -0.012   7.838
   83    H    ILE  11           HN       ILE  11   4.347  -2.761   2.336
   84    HA   ILE  11           HA       ILE  11   4.374  -0.678   0.285
   85    HB   ILE  11           HB       ILE  11   3.303  -1.943  -1.399
   86   HG12  ILE  11          HG12      ILE  11   3.027  -4.553  -0.664
   87   HG13  ILE  11          HG11      ILE  11   2.674  -3.756   0.867
   88   HG21  ILE  11          HG21      ILE  11   4.896  -3.703  -1.886
   89   HG22  ILE  11          HG22      ILE  11   5.377  -3.794  -0.194
   90   HG23  ILE  11          HG23      ILE  11   5.754  -2.356  -1.142
   91   HD11  ILE  11          HD11      ILE  11   1.215  -3.569  -1.750
   92   HD12  ILE  11          HD12      ILE  11   1.152  -2.203  -0.638
   93   HD13  ILE  11          HD13      ILE  11   0.563  -3.784  -0.126
   94    H    ILE  12           HN       ILE  12   2.437   0.416   0.073
   95    HA   ILE  12           HA       ILE  12   0.493  -0.111   2.225
   96    HB   ILE  12           HB       ILE  12   0.769   2.391   0.550
   97   HG12  ILE  12          HG12      ILE  12   2.882   2.099   1.682
   98   HG13  ILE  12          HG11      ILE  12   1.963   3.304   2.581
   99   HG21  ILE  12          HG21      ILE  12  -0.960   3.164   1.768
  100   HG22  ILE  12          HG22      ILE  12  -0.204   2.649   3.276
  101   HG23  ILE  12          HG23      ILE  12  -1.188   1.515   2.351
  102   HD11  ILE  12          HD11      ILE  12   2.502   0.429   3.302
  103   HD12  ILE  12          HD12      ILE  12   1.137   1.293   4.007
  104   HD13  ILE  12          HD13      ILE  12   2.779   1.878   4.267
  105    H    ARG  13           HN       ARG  13  -1.572  -0.632   1.788
  106    HA   ARG  13           HA       ARG  13  -3.060   0.059  -0.463
  107    HB2  ARG  13           HB2      ARG  13  -1.791  -1.193  -1.956
  108    HB3  ARG  13           HB1      ARG  13  -1.438  -2.444  -0.766
  109    HG2  ARG  13           HG2      ARG  13  -3.573  -3.418  -0.976
  110    HG3  ARG  13           HG1      ARG  13  -4.262  -1.967  -1.707
  111    HD2  ARG  13           HD2      ARG  13  -2.871  -2.320  -3.715
  112    HD3  ARG  13           HD1      ARG  13  -2.193  -3.775  -2.989
  113    HE   ARG  13           HE       ARG  13  -4.825  -4.321  -2.922
  114   HH11  ARG  13          HH11      ARG  13  -6.030  -5.195  -4.637
  115   HH12  ARG  13          HH12      ARG  13  -5.531  -4.913  -6.272
  116   HH21  ARG  13          HH21      ARG  13  -2.770  -3.015  -5.382
  117   HH22  ARG  13          HH22      ARG  13  -3.686  -3.678  -6.693
  118    H    ASN  14           HN       ASN  14  -5.168  -0.614  -0.270
  119    HA   ASN  14           HA       ASN  14  -5.826  -2.784   1.574
  120    HB2  ASN  14           HB2      ASN  14  -7.533  -0.572   2.215
  121    HB3  ASN  14           HB1      ASN  14  -6.468  -1.487   3.280
  122   HD21  ASN  14          HD21      ASN  14  -6.654   1.397   1.214
  123   HD22  ASN  14          HD22      ASN  14  -5.251   2.130   1.827
  124    H    GLU  15           HN       GLU  15  -7.624  -3.850   0.958
  125    HA   GLU  15           HA       GLU  15  -8.918  -3.048  -1.501
  126    HB2  GLU  15           HB2      GLU  15  -9.109  -5.437   0.317
  127    HB3  GLU  15           HB1      GLU  15 -10.287  -5.185  -0.971
  128    HG2  GLU  15           HG2      GLU  15  -7.445  -4.857  -1.749
  129    HG3  GLU  15           HG1      GLU  15  -7.940  -6.498  -1.337
  130    H    ARG  16           HN       ARG  16  -9.490  -1.025   0.075
  131    HA   ARG  16           HA       ARG  16 -12.326  -1.031   0.244
  132    HB2  ARG  16           HB2      ARG  16 -11.674  -2.344   2.324
  133    HB3  ARG  16           HB1      ARG  16 -10.950  -0.852   2.926
  134    HG2  ARG  16           HG2      ARG  16 -13.090   0.303   2.771
  135    HG3  ARG  16           HG1      ARG  16 -13.837  -1.117   2.037
  136    HD2  ARG  16           HD2      ARG  16 -12.665  -0.963   4.828
  137    HD3  ARG  16           HD1      ARG  16 -14.379  -1.021   4.426
  138    HE   ARG  16           HE       ARG  16 -12.586  -3.254   4.541
  139   HH11  ARG  16          HH11      ARG  16 -13.441  -5.275   3.953
  140   HH12  ARG  16          HH12      ARG  16 -14.918  -5.356   3.052
  141   HH21  ARG  16          HH21      ARG  16 -15.332  -1.915   2.916
  142   HH22  ARG  16          HH22      ARG  16 -15.988  -3.453   2.465
  Start of MODEL    3
    1    H1   GLY   1           HN       GLY   1 -10.207   1.029   0.639
    2    HA2  GLY   1           HA2      GLY   1 -11.353   3.629  -0.137
    3    HA3  GLY   1           HA1      GLY   1  -9.807   3.384   0.672
    4    H    SER   2           HN       SER   2  -8.727   4.658  -0.892
    5    HA   SER   2           HA       SER   2  -8.001   3.158  -3.290
    6    HB2  SER   2           HB2      SER   2  -9.069   5.987  -3.425
    7    HB3  SER   2           HB1      SER   2  -8.357   5.096  -4.767
    8    HG   SER   2           HG       SER   2 -10.717   5.038  -4.585
    9    H    ARG   3           HN       ARG   3  -6.269   3.252  -1.389
   10    HA   ARG   3           HA       ARG   3  -4.296   5.238  -2.266
   11    HB2  ARG   3           HB2      ARG   3  -4.835   4.716   0.663
   12    HB3  ARG   3           HB1      ARG   3  -3.723   5.898  -0.029
   13    HG2  ARG   3           HG2      ARG   3  -5.700   6.999  -1.136
   14    HG3  ARG   3           HG1      ARG   3  -6.746   5.908  -0.227
   15    HD2  ARG   3           HD2      ARG   3  -5.029   6.925   1.707
   16    HD3  ARG   3           HD1      ARG   3  -5.347   8.312   0.670
   17    HE   ARG   3           HE       ARG   3  -7.153   7.245   2.534
   18   HH11  ARG   3          HH11      ARG   3  -9.345   7.831   2.428
   19   HH12  ARG   3          HH12      ARG   3 -10.001   8.442   0.946
   20   HH21  ARG   3          HH21      ARG   3  -7.008   8.205  -0.787
   21   HH22  ARG   3          HH22      ARG   3  -8.679   8.654  -0.874
   22    H    GLY   4           HN       GLY   4  -2.293   4.401  -2.446
   23    HA2  GLY   4           HA2      GLY   4  -1.433   2.122  -0.883
   24    HA3  GLY   4           HA1      GLY   4  -1.703   1.756  -2.586
   25    H    PHE   5           HN       PHE   5   0.801   1.428  -1.560
   26    HA   PHE   5           HA       PHE   5   2.367   3.127  -3.243
   27    HB2  PHE   5           HB2      PHE   5   1.888   4.484  -1.068
   28    HB3  PHE   5           HB1      PHE   5   3.061   3.391  -0.334
   29    HD1  PHE   5           HD1      PHE   5   5.372   3.764  -0.600
   30    HD2  PHE   5           HD2      PHE   5   2.589   5.703  -3.235
   31    HE1  PHE   5           HE1      PHE   5   7.223   5.095  -1.575
   32    HE2  PHE   5           HE2      PHE   5   4.440   7.034  -4.211
   33    HZ   PHE   5           HZ       PHE   5   6.757   6.730  -3.381
   34    H    ARG   6           HN       ARG   6   4.644   2.516  -3.230
   35    HA   ARG   6           HA       ARG   6   5.053  -0.223  -2.180
   36    HB2  ARG   6           HB2      ARG   6   5.244   0.797  -4.829
   37    HB3  ARG   6           HB1      ARG   6   6.883   0.435  -4.290
   38    HG2  ARG   6           HG2      ARG   6   5.975  -1.572  -5.284
   39    HG3  ARG   6           HG1      ARG   6   6.056  -1.829  -3.541
   40    HD2  ARG   6           HD2      ARG   6   3.866  -2.361  -3.635
   41    HD3  ARG   6           HD1      ARG   6   3.557  -0.653  -3.934
   42    HE   ARG   6           HE       ARG   6   4.223  -2.152  -6.318
   43   HH11  ARG   6          HH11      ARG   6   2.547  -2.360  -7.836
   44   HH12  ARG   6          HH12      ARG   6   0.918  -1.990  -7.376
   45   HH21  ARG   6          HH21      ARG   6   1.750  -1.147  -4.116
   46   HH22  ARG   6          HH22      ARG   6   0.467  -1.304  -5.269
   47    H    PHE   7           HN       PHE   7   6.598  -0.430  -0.681
   48    HA   PHE   7           HA       PHE   7   8.860   1.456  -0.714
   49    HB2  PHE   7           HB2      PHE   7   6.769   1.358   1.249
   50    HB3  PHE   7           HB1      PHE   7   8.273   0.864   2.017
   51    HD1  PHE   7           HD1      PHE   7  10.389   2.387   0.888
   52    HD2  PHE   7           HD2      PHE   7   6.316   3.623   1.545
   53    HE1  PHE   7           HE1      PHE   7  11.111   4.753   0.956
   54    HE2  PHE   7           HE2      PHE   7   7.050   5.987   1.607
   55    HZ   PHE   7           HZ       PHE   7   9.446   6.553   1.313
   56    HA   DPR   8           HA       DPR   8  11.723  -1.846  -0.558
   57    HB2  DPR   8           HB2      DPR   8  11.657  -3.158  -2.476
   58    HB3  DPR   8           HB1      DPR   8   9.893  -3.340  -2.407
   59    HG2  DPR   8           HG2      DPR   8  11.521  -1.083  -3.423
   60    HG3  DPR   8           HG1      DPR   8   9.952  -1.688  -3.977
   61    HD2  DPR   8           HD2      DPR   8  10.375   0.544  -2.291
   62    HD3  DPR   8           HD1      DPR   8   8.821  -0.255  -2.609
   63    HA   PRO   9           HA       PRO   9  10.254  -5.247   1.954
   64    HB2  PRO   9           HB2      PRO   9  10.813  -4.317   4.452
   65    HB3  PRO   9           HB1      PRO   9  12.070  -4.863   3.324
   66    HG2  PRO   9           HG2      PRO   9  11.198  -2.094   3.992
   67    HG3  PRO   9           HG1      PRO   9  12.830  -2.732   3.728
   68    HD2  PRO   9           HD2      PRO   9  11.451  -1.330   1.818
   69    HD3  PRO   9           HD1      PRO   9  12.677  -2.561   1.434
   70    H    LYS  10           HN       LYS  10   8.534  -2.560   1.505
   71    HA   LYS  10           HA       LYS  10   6.271  -3.551   2.984
   72    HB2  LYS  10           HB2      LYS  10   7.571  -2.171   4.670
   73    HB3  LYS  10           HB1      LYS  10   7.263  -0.772   3.652
   74    HG2  LYS  10           HG2      LYS  10   4.755  -1.405   3.877
   75    HG3  LYS  10           HG1      LYS  10   5.276  -2.417   5.227
   76    HD2  LYS  10           HD2      LYS  10   6.387  -0.415   6.229
   77    HD3  LYS  10           HD1      LYS  10   5.705   0.567   4.932
   78    HE2  LYS  10           HE2      LYS  10   3.440  -0.570   5.702
   79    HE3  LYS  10           HE1      LYS  10   4.316  -0.785   7.217
   80    HZ1  LYS  10           HZ1      LYS  10   3.943   1.790   5.786
   81    HZ2  LYS  10           HZ2      LYS  10   4.789   1.581   7.244
   82    HZ3  LYS  10           HZ3      LYS  10   3.112   1.308   7.184
   83    H    ILE  11           HN       ILE  11   4.324  -2.667   2.324
   84    HA   ILE  11           HA       ILE  11   4.311  -0.572   0.292
   85    HB   ILE  11           HB       ILE  11   3.292  -1.842  -1.421
   86   HG12  ILE  11          HG12      ILE  11   3.056  -4.463  -0.733
   87   HG13  ILE  11          HG11      ILE  11   2.691  -3.706   0.814
   88   HG21  ILE  11          HG21      ILE  11   5.748  -2.215  -1.154
   89   HG22  ILE  11          HG22      ILE  11   4.919  -3.568  -1.918
   90   HG23  ILE  11          HG23      ILE  11   5.391  -3.669  -0.224
   91   HD11  ILE  11          HD11      ILE  11   1.213  -3.527  -1.785
   92   HD12  ILE  11          HD12      ILE  11   1.147  -2.148  -0.690
   93   HD13  ILE  11          HD13      ILE  11   0.579  -3.727  -0.153
   94    H    ILE  12           HN       ILE  12   2.309   0.442   0.059
   95    HA   ILE  12           HA       ILE  12   0.400  -0.168   2.222
   96    HB   ILE  12           HB       ILE  12   0.520   2.329   0.523
   97   HG12  ILE  12          HG12      ILE  12   2.665   2.163   1.624
   98   HG13  ILE  12          HG11      ILE  12   1.694   3.323   2.529
   99   HG21  ILE  12          HG21      ILE  12  -0.691   3.280   2.487
  100   HG22  ILE  12          HG22      ILE  12  -0.728   1.670   3.206
  101   HG23  ILE  12          HG23      ILE  12  -1.587   1.983   1.697
  102   HD11  ILE  12          HD11      ILE  12   1.003   1.281   3.984
  103   HD12  ILE  12          HD12      ILE  12   2.616   1.955   4.211
  104   HD13  ILE  12          HD13      ILE  12   2.400   0.486   3.261
  105    H    ARG  13           HN       ARG  13  -1.773  -0.464   1.817
  106    HA   ARG  13           HA       ARG  13  -2.929  -0.144  -0.783
  107    HB2  ARG  13           HB2      ARG  13  -3.026  -2.307  -1.570
  108    HB3  ARG  13           HB1      ARG  13  -1.458  -2.351  -0.765
  109    HG2  ARG  13           HG2      ARG  13  -2.776  -3.114   1.331
  110    HG3  ARG  13           HG1      ARG  13  -4.097  -3.446   0.210
  111    HD2  ARG  13           HD2      ARG  13  -1.432  -4.778   0.447
  112    HD3  ARG  13           HD1      ARG  13  -3.020  -5.492   0.185
  113    HE   ARG  13           HE       ARG  13  -2.467  -3.993  -2.088
  114   HH11  ARG  13          HH11      ARG  13  -1.553  -4.961  -3.929
  115   HH12  ARG  13          HH12      ARG  13  -0.653  -6.432  -3.769
  116   HH21  ARG  13          HH21      ARG  13  -1.087  -6.640  -0.336
  117   HH22  ARG  13          HH22      ARG  13  -0.388  -7.382  -1.736
  118    H    ASN  14           HN       ASN  14  -5.194  -0.887  -0.837
  119    HA   ASN  14           HA       ASN  14  -6.369  -1.329   1.827
  120    HB2  ASN  14           HB2      ASN  14  -6.371   1.161   0.651
  121    HB3  ASN  14           HB1      ASN  14  -7.923   0.496   0.141
  122   HD21  ASN  14          HD21      ASN  14  -5.926   0.692   3.150
  123   HD22  ASN  14          HD22      ASN  14  -7.252   0.957   4.177
  124    H    GLU  15           HN       GLU  15  -8.968  -1.402   1.303
  125    HA   GLU  15           HA       GLU  15  -9.365  -3.115  -1.058
  126    HB2  GLU  15           HB2      GLU  15  -8.932  -4.391   1.186
  127    HB3  GLU  15           HB1      GLU  15 -10.588  -3.909   1.563
  128    HG2  GLU  15           HG2      GLU  15 -11.148  -4.831  -0.808
  129    HG3  GLU  15           HG1      GLU  15  -9.602  -5.666  -0.674
  130    H    ARG  16           HN       ARG  16 -10.435  -0.697   1.076
  131    HA   ARG  16           HA       ARG  16 -13.086  -0.651  -0.241
  132    HB2  ARG  16           HB2      ARG  16 -13.048  -1.240   2.257
  133    HB3  ARG  16           HB1      ARG  16 -12.554   0.432   2.523
  134    HG2  ARG  16           HG2      ARG  16 -14.563   1.242   1.387
  135    HG3  ARG  16           HG1      ARG  16 -15.048  -0.414   1.017
  136    HD2  ARG  16           HD2      ARG  16 -14.561   0.474   3.856
  137    HD3  ARG  16           HD1      ARG  16 -16.124   0.713   3.081
  138    HE   ARG  16           HE       ARG  16 -15.093  -1.760   4.076
  139   HH11  ARG  16          HH11      ARG  16 -16.332  -3.623   3.687
  140   HH12  ARG  16          HH12      ARG  16 -17.550  -3.605   2.456
  141   HH21  ARG  16          HH21      ARG  16 -16.956  -0.314   1.542
  142   HH22  ARG  16          HH22      ARG  16 -17.903  -1.732   1.241
  Start of MODEL    4
    1    H1   GLY   1           HN       GLY   1  -9.373   1.656   1.550
    2    HA2  GLY   1           HA2      GLY   1 -10.792   3.608  -0.038
    3    HA3  GLY   1           HA1      GLY   1 -10.631   4.064   1.655
    4    H    SER   2           HN       SER   2  -8.014   2.350   1.478
    5    HA   SER   2           HA       SER   2  -6.180   4.434   1.417
    6    HB2  SER   2           HB2      SER   2  -6.090   1.585   1.614
    7    HB3  SER   2           HB1      SER   2  -4.869   2.098   0.453
    8    HG   SER   2           HG       SER   2  -4.939   3.760   2.575
    9    H    ARG   3           HN       ARG   3  -4.156   3.951  -0.301
   10    HA   ARG   3           HA       ARG   3  -5.297   4.082  -3.014
   11    HB2  ARG   3           HB2      ARG   3  -3.242   6.066  -2.025
   12    HB3  ARG   3           HB1      ARG   3  -4.118   6.087  -3.556
   13    HG2  ARG   3           HG2      ARG   3  -6.240   6.116  -1.973
   14    HG3  ARG   3           HG1      ARG   3  -5.092   6.777  -0.808
   15    HD2  ARG   3           HD2      ARG   3  -6.047   8.652  -1.951
   16    HD3  ARG   3           HD1      ARG   3  -4.419   8.453  -2.592
   17    HE   ARG   3           HE       ARG   3  -5.921   7.000  -4.323
   18   HH11  ARG   3          HH11      ARG   3  -6.949   7.863  -6.155
   19   HH12  ARG   3          HH12      ARG   3  -7.399   9.535  -6.182
   20   HH21  ARG   3          HH21      ARG   3  -6.180  10.188  -3.003
   21   HH22  ARG   3          HH22      ARG   3  -6.964  10.851  -4.397
   22    H    GLY   4           HN       GLY   4  -3.582   2.198  -1.319
   23    HA2  GLY   4           HA2      GLY   4  -1.787   0.788  -1.645
   24    HA3  GLY   4           HA1      GLY   4  -1.960   1.179  -3.359
   25    H    PHE   5           HN       PHE   5   0.541   0.745  -2.066
   26    HA   PHE   5           HA       PHE   5   1.979   3.027  -2.964
   27    HB2  PHE   5           HB2      PHE   5   1.029   3.839  -0.741
   28    HB3  PHE   5           HB1      PHE   5   2.070   2.642   0.029
   29    HD1  PHE   5           HD1      PHE   5   4.207   3.321   0.683
   30    HD2  PHE   5           HD2      PHE   5   2.272   5.325  -2.593
   31    HE1  PHE   5           HE1      PHE   5   6.125   4.880   0.500
   32    HE2  PHE   5           HE2      PHE   5   4.193   6.882  -2.772
   33    HZ   PHE   5           HZ       PHE   5   6.118   6.660  -1.225
   34    H    ARG   6           HN       ARG   6   4.344   2.835  -2.411
   35    HA   ARG   6           HA       ARG   6   5.121   0.022  -1.930
   36    HB2  ARG   6           HB2      ARG   6   5.263   1.175  -4.404
   37    HB3  ARG   6           HB1      ARG   6   6.820   1.665  -3.739
   38    HG2  ARG   6           HG2      ARG   6   7.464  -0.624  -3.331
   39    HG3  ARG   6           HG1      ARG   6   5.842  -1.208  -3.715
   40    HD2  ARG   6           HD2      ARG   6   7.958  -1.011  -5.498
   41    HD3  ARG   6           HD1      ARG   6   6.261  -1.210  -5.925
   42    HE   ARG   6           HE       ARG   6   7.126   1.539  -5.496
   43   HH11  ARG   6          HH11      ARG   6   6.959   2.876  -7.323
   44   HH12  ARG   6          HH12      ARG   6   6.675   2.175  -8.880
   45   HH21  ARG   6          HH21      ARG   6   6.600  -1.083  -7.695
   46   HH22  ARG   6          HH22      ARG   6   6.472  -0.067  -9.091
   47    H    PHE   7           HN       PHE   7   6.507  -0.178  -0.294
   48    HA   PHE   7           HA       PHE   7   8.311   2.069   0.325
   49    HB2  PHE   7           HB2      PHE   7   6.060   1.378   1.841
   50    HB3  PHE   7           HB1      PHE   7   7.416   0.717   2.742
   51    HD1  PHE   7           HD1      PHE   7   9.612   2.543   2.326
   52    HD2  PHE   7           HD2      PHE   7   5.420   3.433   2.741
   53    HE1  PHE   7           HE1      PHE   7  10.170   4.821   3.125
   54    HE2  PHE   7           HE2      PHE   7   5.988   5.709   3.537
   55    HZ   PHE   7           HZ       PHE   7   8.360   6.404   3.729
   56    HA   DPR   8           HA       DPR   8  11.789  -0.581   0.370
   57    HB2  DPR   8           HB2      DPR   8  12.256  -1.455  -1.731
   58    HB3  DPR   8           HB1      DPR   8  10.586  -1.999  -1.983
   59    HG2  DPR   8           HG2      DPR   8  11.765   0.701  -2.308
   60    HG3  DPR   8           HG1      DPR   8  10.466  -0.085  -3.219
   61    HD2  DPR   8           HD2      DPR   8  10.124   1.797  -1.144
   62    HD3  DPR   8           HD1      DPR   8   8.859   0.755  -1.831
   63    HA   PRO   9           HA       PRO   9  10.828  -4.654   1.967
   64    HB2  PRO   9           HB2      PRO   9  10.861  -4.165   4.648
   65    HB3  PRO   9           HB1      PRO   9  12.333  -4.231   3.661
   66    HG2  PRO   9           HG2      PRO   9  10.826  -1.865   4.655
   67    HG3  PRO   9           HG1      PRO   9  12.575  -2.123   4.540
   68    HD2  PRO   9           HD2      PRO   9  11.162  -0.641   2.717
   69    HD3  PRO   9           HD1      PRO   9  12.657  -1.516   2.316
   70    H    LYS  10           HN       LYS  10   8.670  -2.269   1.774
   71    HA   LYS  10           HA       LYS  10   6.487  -3.934   2.714
   72    HB2  LYS  10           HB2      LYS  10   6.511  -2.903   4.742
   73    HB3  LYS  10           HB1      LYS  10   7.376  -1.494   4.140
   74    HG2  LYS  10           HG2      LYS  10   5.354  -0.552   3.221
   75    HG3  LYS  10           HG1      LYS  10   4.462  -2.047   3.514
   76    HD2  LYS  10           HD2      LYS  10   4.058  -1.501   5.663
   77    HD3  LYS  10           HD1      LYS  10   5.734  -1.017   5.932
   78    HE2  LYS  10           HE2      LYS  10   3.765   0.702   4.408
   79    HE3  LYS  10           HE1      LYS  10   4.003   0.843   6.150
   80    HZ1  LYS  10           HZ1      LYS  10   6.069   1.191   4.046
   81    HZ2  LYS  10           HZ2      LYS  10   6.384   1.202   5.716
   82    HZ3  LYS  10           HZ3      LYS  10   5.406   2.408   5.025
   83    H    ILE  11           HN       ILE  11   4.488  -3.357   1.845
   84    HA   ILE  11           HA       ILE  11   4.356  -1.086   0.015
   85    HB   ILE  11           HB       ILE  11   3.832  -2.325  -1.933
   86   HG12  ILE  11          HG12      ILE  11   4.060  -5.003  -1.499
   87   HG13  ILE  11          HG11      ILE  11   3.339  -4.501   0.026
   88   HG21  ILE  11          HG21      ILE  11   6.255  -2.241  -1.333
   89   HG22  ILE  11          HG22      ILE  11   5.831  -3.635  -2.324
   90   HG23  ILE  11          HG23      ILE  11   6.091  -3.833  -0.593
   91   HD11  ILE  11          HD11      ILE  11   2.225  -4.322  -2.751
   92   HD12  ILE  11          HD12      ILE  11   1.721  -3.123  -1.562
   93   HD13  ILE  11          HD13      ILE  11   1.432  -4.836  -1.263
   94    H    ILE  12           HN       ILE  12   2.290  -0.368  -0.382
   95    HA   ILE  12           HA       ILE  12   0.187  -1.631   1.264
   96    HB   ILE  12           HB       ILE  12   0.247   1.186   0.163
   97   HG12  ILE  12          HG12      ILE  12   2.107   0.976   1.696
   98   HG13  ILE  12          HG11      ILE  12   0.807   1.823   2.534
   99   HG21  ILE  12          HG21      ILE  12  -1.482  -0.262   2.177
  100   HG22  ILE  12          HG22      ILE  12  -1.989   0.510   0.675
  101   HG23  ILE  12          HG23      ILE  12  -1.447   1.495   2.034
  102   HD11  ILE  12          HD11      ILE  12   1.484   0.230   4.117
  103   HD12  ILE  12          HD12      ILE  12   1.751  -1.012   2.895
  104   HD13  ILE  12          HD13      ILE  12   0.109  -0.561   3.349
  105    H    ARG  13           HN       ARG  13  -1.993  -1.606   0.410
  106    HA   ARG  13           HA       ARG  13  -2.130  -1.569  -2.540
  107    HB2  ARG  13           HB2      ARG  13  -1.992  -3.905  -1.260
  108    HB3  ARG  13           HB1      ARG  13  -3.715  -3.596  -1.054
  109    HG2  ARG  13           HG2      ARG  13  -3.690  -4.713  -3.103
  110    HG3  ARG  13           HG1      ARG  13  -3.639  -3.027  -3.617
  111    HD2  ARG  13           HD2      ARG  13  -0.998  -3.463  -3.334
  112    HD3  ARG  13           HD1      ARG  13  -1.510  -5.105  -3.713
  113    HE   ARG  13           HE       ARG  13  -2.740  -3.700  -5.649
  114   HH11  ARG  13          HH11      ARG  13  -1.794  -3.055  -7.610
  115   HH12  ARG  13          HH12      ARG  13  -0.083  -2.804  -7.700
  116   HH21  ARG  13          HH21      ARG  13   0.477  -3.610  -4.374
  117   HH22  ARG  13          HH22      ARG  13   1.203  -3.118  -5.868
  118    H    ASN  14           HN       ASN  14  -4.904  -2.599  -2.332
  119    HA   ASN  14           HA       ASN  14  -6.299  -0.473  -0.896
  120    HB2  ASN  14           HB2      ASN  14  -6.387  -0.807  -3.895
  121    HB3  ASN  14           HB1      ASN  14  -7.613   0.076  -2.987
  122   HD21  ASN  14          HD21      ASN  14  -5.799   1.238  -1.013
  123   HD22  ASN  14          HD22      ASN  14  -4.841   2.374  -1.827
  124    H    GLU  15           HN       GLU  15  -8.398  -0.954  -0.385
  125    HA   GLU  15           HA       GLU  15  -9.997  -2.948  -1.541
  126    HB2  GLU  15           HB2      GLU  15  -7.935  -3.986   0.153
  127    HB3  GLU  15           HB1      GLU  15  -9.492  -4.233   0.943
  128    HG2  GLU  15           HG2      GLU  15 -10.376  -5.261  -1.122
  129    HG3  GLU  15           HG1      GLU  15  -8.814  -5.026  -1.904
  130    H    ARG  16           HN       ARG  16  -9.510  -0.379   0.313
  131    HA   ARG  16           HA       ARG  16 -12.162  -0.578   1.549
  132    HB2  ARG  16           HB2      ARG  16 -10.048  -1.083   3.126
  133    HB3  ARG  16           HB1      ARG  16 -10.039   0.679   3.212
  134    HG2  ARG  16           HG2      ARG  16 -11.488   0.169   4.956
  135    HG3  ARG  16           HG1      ARG  16 -12.632   0.366   3.628
  136    HD2  ARG  16           HD2      ARG  16 -12.234  -2.191   3.247
  137    HD3  ARG  16           HD1      ARG  16 -11.633  -2.170   4.901
  138    HE   ARG  16           HE       ARG  16 -13.814  -1.769   5.653
  139   HH11  ARG  16          HH11      ARG  16 -16.058  -1.731   5.313
  140   HH12  ARG  16          HH12      ARG  16 -16.684  -1.612   3.702
  141   HH21  ARG  16          HH21      ARG  16 -13.556  -1.525   2.210
  142   HH22  ARG  16          HH22      ARG  16 -15.267  -1.496   1.946
  Start of MODEL    5
    1    H1   GLY   1           HN       GLY   1  -9.012   6.540  -3.469
    2    HA2  GLY   1           HA2      GLY   1  -6.204   6.956  -3.932
    3    HA3  GLY   1           HA1      GLY   1  -7.377   8.179  -3.449
    4    H    SER   2           HN       SER   2  -7.674   5.582  -1.403
    5    HA   SER   2           HA       SER   2  -6.819   6.930   0.894
    6    HB2  SER   2           HB2      SER   2  -7.025   3.940   0.485
    7    HB3  SER   2           HB1      SER   2  -7.036   4.786   2.030
    8    HG   SER   2           HG       SER   2  -9.100   4.957   1.727
    9    H    ARG   3           HN       ARG   3  -5.353   3.971   1.154
   10    HA   ARG   3           HA       ARG   3  -2.665   5.108   0.637
   11    HB2  ARG   3           HB2      ARG   3  -2.982   2.967   2.681
   12    HB3  ARG   3           HB1      ARG   3  -1.859   4.324   2.636
   13    HG2  ARG   3           HG2      ARG   3  -3.262   5.034   4.330
   14    HG3  ARG   3           HG1      ARG   3  -4.102   5.738   2.949
   15    HD2  ARG   3           HD2      ARG   3  -5.842   4.633   4.040
   16    HD3  ARG   3           HD1      ARG   3  -5.331   3.417   2.872
   17    HE   ARG   3           HE       ARG   3  -4.627   2.102   4.644
   18   HH11  ARG   3          HH11      ARG   3  -4.255   1.669   6.843
   19   HH12  ARG   3          HH12      ARG   3  -4.292   2.965   7.993
   20   HH21  ARG   3          HH21      ARG   3  -4.992   5.400   5.626
   21   HH22  ARG   3          HH22      ARG   3  -4.709   5.077   7.304
   22    H    GLY   4           HN       GLY   4  -1.568   4.059  -0.863
   23    HA2  GLY   4           HA2      GLY   4  -1.384   1.215  -1.017
   24    HA3  GLY   4           HA1      GLY   4  -2.442   1.847  -2.282
   25    H    PHE   5           HN       PHE   5   0.652   0.959  -1.682
   26    HA   PHE   5           HA       PHE   5   1.746   1.691  -4.098
   27    HB2  PHE   5           HB2      PHE   5   1.716   3.991  -3.773
   28    HB3  PHE   5           HB1      PHE   5   1.986   3.852  -2.034
   29    HD1  PHE   5           HD1      PHE   5   3.621   3.324  -5.350
   30    HD2  PHE   5           HD2      PHE   5   4.170   3.997  -1.142
   31    HE1  PHE   5           HE1      PHE   5   6.053   3.634  -5.718
   32    HE2  PHE   5           HE2      PHE   5   6.603   4.308  -1.512
   33    HZ   PHE   5           HZ       PHE   5   7.544   4.127  -3.799
   34    H    ARG   6           HN       ARG   6   3.415   0.338  -4.298
   35    HA   ARG   6           HA       ARG   6   4.500  -1.173  -2.213
   36    HB2  ARG   6           HB2      ARG   6   4.829  -0.976  -5.023
   37    HB3  ARG   6           HB1      ARG   6   6.438  -0.807  -4.324
   38    HG2  ARG   6           HG2      ARG   6   6.120  -3.148  -4.639
   39    HG3  ARG   6           HG1      ARG   6   5.889  -2.877  -2.914
   40    HD2  ARG   6           HD2      ARG   6   3.981  -4.091  -3.301
   41    HD3  ARG   6           HD1      ARG   6   3.353  -2.507  -3.747
   42    HE   ARG   6           HE       ARG   6   4.581  -3.888  -5.959
   43   HH11  ARG   6          HH11      ARG   6   3.170  -4.582  -7.598
   44   HH12  ARG   6          HH12      ARG   6   1.467  -4.649  -7.296
   45   HH21  ARG   6          HH21      ARG   6   1.733  -3.515  -4.030
   46   HH22  ARG   6          HH22      ARG   6   0.652  -4.043  -5.276
   47    H    PHE   7           HN       PHE   7   6.202  -0.886  -0.820
   48    HA   PHE   7           HA       PHE   7   7.882   1.510  -1.177
   49    HB2  PHE   7           HB2      PHE   7   5.800   1.533   0.569
   50    HB3  PHE   7           HB1      PHE   7   7.082   0.933   1.616
   51    HD1  PHE   7           HD1      PHE   7   9.474   2.287   0.474
   52    HD2  PHE   7           HD2      PHE   7   5.502   3.782   1.184
   53    HE1  PHE   7           HE1      PHE   7  10.371   4.588   0.659
   54    HE2  PHE   7           HE2      PHE   7   6.407   6.082   1.368
   55    HZ   PHE   7           HZ       PHE   7   8.839   6.486   1.106
   56    HA   DPR   8           HA       DPR   8  11.501  -0.872  -0.596
   57    HB2  DPR   8           HB2      DPR   8  11.775  -2.515  -2.219
   58    HB3  DPR   8           HB1      DPR   8  10.120  -3.126  -2.017
   59    HG2  DPR   8           HG2      DPR   8  11.096  -0.774  -3.535
   60    HG3  DPR   8           HG1      DPR   8   9.738  -1.859  -3.875
   61    HD2  DPR   8           HD2      DPR   8   9.570   0.697  -2.668
   62    HD3  DPR   8           HD1      DPR   8   8.277  -0.519  -2.748
   63    HA   PRO   9           HA       PRO   9  11.025  -3.943   2.619
   64    HB2  PRO   9           HB2      PRO   9  11.224  -2.379   4.850
   65    HB3  PRO   9           HB1      PRO   9  12.615  -2.798   3.831
   66    HG2  PRO   9           HG2      PRO   9  11.016  -0.289   3.912
   67    HG3  PRO   9           HG1      PRO   9  12.764  -0.510   3.727
   68    HD2  PRO   9           HD2      PRO   9  11.103   0.029   1.618
   69    HD3  PRO   9           HD1      PRO   9  12.615  -0.894   1.455
   70    H    LYS  10           HN       LYS  10   8.648  -1.982   1.696
   71    HA   LYS  10           HA       LYS  10   6.681  -3.250   3.366
   72    HB2  LYS  10           HB2      LYS  10   6.838  -1.648   4.977
   73    HB3  LYS  10           HB1      LYS  10   7.535  -0.459   3.884
   74    HG2  LYS  10           HG2      LYS  10   5.369   0.074   2.963
   75    HG3  LYS  10           HG1      LYS  10   4.622  -1.293   3.795
   76    HD2  LYS  10           HD2      LYS  10   6.072   0.657   5.501
   77    HD3  LYS  10           HD1      LYS  10   4.565   1.217   4.774
   78    HE2  LYS  10           HE2      LYS  10   3.372  -0.715   5.702
   79    HE3  LYS  10           HE1      LYS  10   4.875  -1.334   6.386
   80    HZ1  LYS  10           HZ1      LYS  10   3.455   1.165   7.111
   81    HZ2  LYS  10           HZ2      LYS  10   5.037   0.813   7.621
   82    HZ3  LYS  10           HZ3      LYS  10   3.747  -0.183   8.097
   83    H    ILE  11           HN       ILE  11   4.575  -3.016   2.590
   84    HA   ILE  11           HA       ILE  11   4.226  -1.504   0.096
   85    HB   ILE  11           HB       ILE  11   3.420  -3.341  -1.153
   86   HG12  ILE  11          HG12      ILE  11   3.448  -5.670   0.119
   87   HG13  ILE  11          HG11      ILE  11   3.237  -4.660   1.544
   88   HG21  ILE  11          HG21      ILE  11   5.321  -4.677  -1.370
   89   HG22  ILE  11          HG22      ILE  11   5.646  -4.674   0.362
   90   HG23  ILE  11          HG23      ILE  11   5.959  -3.228  -0.597
   91   HD11  ILE  11          HD11      ILE  11   1.283  -5.433  -0.450
   92   HD12  ILE  11          HD12      ILE  11   1.376  -3.678  -0.352
   93   HD13  ILE  11          HD13      ILE  11   1.027  -4.624   1.092
   94    H    ILE  12           HN       ILE  12   2.345  -0.469   0.023
   95    HA   ILE  12           HA       ILE  12   0.316  -1.146   2.061
   96    HB   ILE  12           HB       ILE  12   0.589   1.438   0.513
   97   HG12  ILE  12          HG12      ILE  12   2.615   1.177   1.807
   98   HG13  ILE  12          HG11      ILE  12   1.577   2.320   2.657
   99   HG21  ILE  12          HG21      ILE  12  -1.611   1.183   1.418
  100   HG22  ILE  12          HG22      ILE  12  -0.748   2.268   2.506
  101   HG23  ILE  12          HG23      ILE  12  -0.982   0.579   2.950
  102   HD11  ILE  12          HD11      ILE  12   0.710   0.212   3.934
  103   HD12  ILE  12          HD12      ILE  12   2.277   0.884   4.377
  104   HD13  ILE  12          HD13      ILE  12   2.189  -0.545   3.348
  105    H    ARG  13           HN       ARG  13  -1.955  -0.852   1.416
  106    HA   ARG  13           HA       ARG  13  -2.644  -0.795  -1.370
  107    HB2  ARG  13           HB2      ARG  13  -2.027  -3.004  -1.608
  108    HB3  ARG  13           HB1      ARG  13  -2.393  -3.391   0.070
  109    HG2  ARG  13           HG2      ARG  13  -4.721  -3.506  -0.338
  110    HG3  ARG  13           HG1      ARG  13  -4.580  -2.634  -1.866
  111    HD2  ARG  13           HD2      ARG  13  -3.499  -5.410  -1.309
  112    HD3  ARG  13           HD1      ARG  13  -4.937  -5.040  -2.256
  113    HE   ARG  13           HE       ARG  13  -3.034  -3.613  -3.538
  114   HH11  ARG  13          HH11      ARG  13  -1.672  -4.436  -5.160
  115   HH12  ARG  13          HH12      ARG  13  -1.291  -6.126  -5.187
  116   HH21  ARG  13          HH21      ARG  13  -3.186  -6.870  -2.380
  117   HH22  ARG  13          HH22      ARG  13  -2.147  -7.504  -3.613
  118    H    ASN  14           HN       ASN  14  -4.812  -0.435  -1.680
  119    HA   ASN  14           HA       ASN  14  -6.643  -0.736   0.587
  120    HB2  ASN  14           HB2      ASN  14  -7.472   1.590   0.278
  121    HB3  ASN  14           HB1      ASN  14  -5.812   1.525   0.869
  122   HD21  ASN  14          HD21      ASN  14  -4.231   1.232  -1.297
  123   HD22  ASN  14          HD22      ASN  14  -4.514   2.439  -2.458
  124    H    GLU  15           HN       GLU  15  -8.001   1.407  -1.466
  125    HA   GLU  15           HA       GLU  15  -8.763  -0.383  -3.606
  126    HB2  GLU  15           HB2      GLU  15 -10.193  -1.209  -1.784
  127    HB3  GLU  15           HB1      GLU  15 -10.813   0.421  -1.526
  128    HG2  GLU  15           HG2      GLU  15 -10.982  -0.569  -4.313
  129    HG3  GLU  15           HG1      GLU  15 -12.007  -1.407  -3.151
  130    H    ARG  16           HN       ARG  16  -8.168   2.616  -2.418
  131    HA   ARG  16           HA       ARG  16  -9.235   3.895  -4.797
  132    HB2  ARG  16           HB2      ARG  16 -10.940   3.889  -2.738
  133    HB3  ARG  16           HB1      ARG  16  -9.965   5.279  -2.266
  134    HG2  ARG  16           HG2      ARG  16 -11.579   6.287  -3.618
  135    HG3  ARG  16           HG1      ARG  16 -10.285   5.994  -4.779
  136    HD2  ARG  16           HD2      ARG  16 -11.561   3.640  -4.986
  137    HD3  ARG  16           HD1      ARG  16 -12.925   4.644  -4.501
  138    HE   ARG  16           HE       ARG  16 -11.841   6.105  -6.493
  139   HH11  ARG  16          HH11      ARG  16 -12.284   5.822  -8.703
  140   HH12  ARG  16          HH12      ARG  16 -12.770   4.266  -9.291
  141   HH21  ARG  16          HH21      ARG  16 -12.623   2.748  -6.177
  142   HH22  ARG  16          HH22      ARG  16 -12.962   2.527  -7.860
  Start of MODEL    6
    1    H1   GLY   1           HN       GLY   1  -8.555   1.923  -1.935
    2    HA2  GLY   1           HA2      GLY   1 -10.947   3.228  -2.524
    3    HA3  GLY   1           HA1      GLY   1 -11.245   2.240  -1.099
    4    H    SER   2           HN       SER   2  -8.127   2.763  -0.741
    5    HA   SER   2           HA       SER   2  -8.356   5.474   0.395
    6    HB2  SER   2           HB2      SER   2  -6.894   3.409   1.972
    7    HB3  SER   2           HB1      SER   2  -7.746   4.849   2.521
    8    HG   SER   2           HG       SER   2  -9.145   2.733   1.300
    9    H    ARG   3           HN       ARG   3  -7.013   4.241  -1.979
   10    HA   ARG   3           HA       ARG   3  -5.029   4.480  -3.110
   11    HB2  ARG   3           HB2      ARG   3  -4.080   6.232  -0.845
   12    HB3  ARG   3           HB1      ARG   3  -3.643   6.313  -2.552
   13    HG2  ARG   3           HG2      ARG   3  -6.124   6.797  -3.001
   14    HG3  ARG   3           HG1      ARG   3  -6.267   7.076  -1.265
   15    HD2  ARG   3           HD2      ARG   3  -5.672   9.208  -1.782
   16    HD3  ARG   3           HD1      ARG   3  -4.041   8.548  -1.854
   17    HE   ARG   3           HE       ARG   3  -4.083   8.962  -4.125
   18   HH11  ARG   3          HH11      ARG   3  -5.074   9.416  -6.118
   19   HH12  ARG   3          HH12      ARG   3  -6.802   9.406  -6.242
   20   HH21  ARG   3          HH21      ARG   3  -7.302   8.598  -2.908
   21   HH22  ARG   3          HH22      ARG   3  -8.063   8.942  -4.425
   22    H    GLY   4           HN       GLY   4  -2.959   3.585  -3.197
   23    HA2  GLY   4           HA2      GLY   4  -1.982   2.266  -0.737
   24    HA3  GLY   4           HA1      GLY   4  -2.146   1.360  -2.242
   25    H    PHE   5           HN       PHE   5   0.306   1.656  -0.857
   26    HA   PHE   5           HA       PHE   5   1.867   2.956  -2.967
   27    HB2  PHE   5           HB2      PHE   5   1.548   4.681  -1.213
   28    HB3  PHE   5           HB1      PHE   5   2.287   3.595  -0.039
   29    HD1  PHE   5           HD1      PHE   5   4.613   3.633   0.269
   30    HD2  PHE   5           HD2      PHE   5   2.936   5.150  -3.386
   31    HE1  PHE   5           HE1      PHE   5   6.860   4.403  -0.445
   32    HE2  PHE   5           HE2      PHE   5   5.184   5.918  -4.098
   33    HZ   PHE   5           HZ       PHE   5   7.145   5.544  -2.628
   34    H    ARG   6           HN       ARG   6   4.109   2.317  -2.964
   35    HA   ARG   6           HA       ARG   6   4.564  -0.261  -1.579
   36    HB2  ARG   6           HB2      ARG   6   4.421   0.094  -4.288
   37    HB3  ARG   6           HB1      ARG   6   6.138   0.386  -4.017
   38    HG2  ARG   6           HG2      ARG   6   6.420  -1.783  -2.976
   39    HG3  ARG   6           HG1      ARG   6   4.676  -2.069  -2.993
   40    HD2  ARG   6           HD2      ARG   6   6.475  -1.788  -5.412
   41    HD3  ARG   6           HD1      ARG   6   5.705  -3.267  -4.847
   42    HE   ARG   6           HE       ARG   6   3.701  -1.340  -5.283
   43   HH11  ARG   6          HH11      ARG   6   2.489  -1.423  -7.202
   44   HH12  ARG   6          HH12      ARG   6   3.116  -2.264  -8.579
   45   HH21  ARG   6          HH21      ARG   6   6.055  -3.207  -6.999
   46   HH22  ARG   6          HH22      ARG   6   5.136  -3.274  -8.465
   47    H    PHE   7           HN       PHE   7   6.452  -0.534  -0.474
   48    HA   PHE   7           HA       PHE   7   8.470   1.607  -0.642
   49    HB2  PHE   7           HB2      PHE   7   6.668   1.299   1.479
   50    HB3  PHE   7           HB1      PHE   7   8.174   0.623   2.083
   51    HD1  PHE   7           HD1      PHE   7  10.282   2.183   0.875
   52    HD2  PHE   7           HD2      PHE   7   6.413   3.491   2.237
   53    HE1  PHE   7           HE1      PHE   7  11.164   4.476   1.193
   54    HE2  PHE   7           HE2      PHE   7   7.305   5.781   2.550
   55    HZ   PHE   7           HZ       PHE   7   9.678   6.274   2.029
   56    HA   DPR   8           HA       DPR   8  11.669  -1.335  -1.138
   57    HB2  DPR   8           HB2      DPR   8  11.509  -2.479  -3.154
   58    HB3  DPR   8           HB1      DPR   8   9.802  -2.890  -2.897
   59    HG2  DPR   8           HG2      DPR   8  11.013  -0.361  -3.862
   60    HG3  DPR   8           HG1      DPR   8   9.479  -1.125  -4.308
   61    HD2  DPR   8           HD2      DPR   8   9.790   1.001  -2.485
   62    HD3  DPR   8           HD1      DPR   8   8.340  -0.006  -2.676
   63    HA   PRO   9           HA       PRO   9  10.846  -5.093   1.174
   64    HB2  PRO   9           HB2      PRO   9  11.732  -4.370   3.640
   65    HB3  PRO   9           HB1      PRO   9  12.834  -4.675   2.282
   66    HG2  PRO   9           HG2      PRO   9  11.861  -2.084   3.385
   67    HG3  PRO   9           HG1      PRO   9  13.479  -2.534   2.816
   68    HD2  PRO   9           HD2      PRO   9  11.702  -1.088   1.299
   69    HD3  PRO   9           HD1      PRO   9  12.961  -2.136   0.606
   70    H    LYS  10           HN       LYS  10   8.913  -2.542   1.226
   71    HA   LYS  10           HA       LYS  10   7.022  -3.776   3.050
   72    HB2  LYS  10           HB2      LYS  10   7.740  -2.457   4.756
   73    HB3  LYS  10           HB1      LYS  10   8.470  -1.272   3.678
   74    HG2  LYS  10           HG2      LYS  10   6.323  -0.250   3.234
   75    HG3  LYS  10           HG1      LYS  10   5.475  -1.555   4.067
   76    HD2  LYS  10           HD2      LYS  10   6.707  -0.903   6.166
   77    HD3  LYS  10           HD1      LYS  10   7.324   0.502   5.295
   78    HE2  LYS  10           HE2      LYS  10   4.374  -0.124   5.567
   79    HE3  LYS  10           HE1      LYS  10   5.244   0.953   6.659
   80    HZ1  LYS  10           HZ1      LYS  10   5.991   2.068   4.462
   81    HZ2  LYS  10           HZ2      LYS  10   4.448   2.405   5.092
   82    HZ3  LYS  10           HZ3      LYS  10   4.624   1.306   3.807
   83    H    ILE  11           HN       ILE  11   4.893  -3.096   2.746
   84    HA   ILE  11           HA       ILE  11   4.328  -1.153   0.640
   85    HB   ILE  11           HB       ILE  11   3.118  -2.618  -0.770
   86   HG12  ILE  11          HG12      ILE  11   3.263  -5.193   0.087
   87   HG13  ILE  11          HG11      ILE  11   3.133  -4.364   1.635
   88   HG21  ILE  11          HG21      ILE  11   5.608  -2.760  -0.954
   89   HG22  ILE  11          HG22      ILE  11   4.783  -4.225  -1.481
   90   HG23  ILE  11          HG23      ILE  11   5.567  -4.175   0.096
   91   HD11  ILE  11          HD11      ILE  11   0.886  -4.620   1.113
   92   HD12  ILE  11          HD12      ILE  11   1.170  -4.490  -0.622
   93   HD13  ILE  11          HD13      ILE  11   1.191  -3.044   0.383
   94    H    ILE  12           HN       ILE  12   2.317  -0.214   0.816
   95    HA   ILE  12           HA       ILE  12   0.554  -1.217   2.943
   96    HB   ILE  12           HB       ILE  12   0.531   1.673   2.816
   97   HG12  ILE  12          HG12      ILE  12   2.757   1.915   3.997
   98   HG13  ILE  12          HG11      ILE  12   3.142   0.278   3.467
   99   HG21  ILE  12          HG21      ILE  12  -0.425   0.201   4.601
  100   HG22  ILE  12          HG22      ILE  12   0.677   1.426   5.231
  101   HG23  ILE  12          HG23      ILE  12   1.219  -0.244   5.061
  102   HD11  ILE  12          HD11      ILE  12   3.264   2.749   1.968
  103   HD12  ILE  12          HD12      ILE  12   2.178   1.604   1.181
  104   HD13  ILE  12          HD13      ILE  12   3.848   1.148   1.515
  105    H    ARG  13           HN       ARG  13  -1.299  -1.714   1.995
  106    HA   ARG  13           HA       ARG  13  -2.657   0.280   0.371
  107    HB2  ARG  13           HB2      ARG  13  -1.497  -0.802  -1.402
  108    HB3  ARG  13           HB1      ARG  13  -1.801  -2.401  -0.721
  109    HG2  ARG  13           HG2      ARG  13  -4.091  -2.341  -1.293
  110    HG3  ARG  13           HG1      ARG  13  -4.079  -0.592  -1.515
  111    HD2  ARG  13           HD2      ARG  13  -2.200  -2.081  -3.242
  112    HD3  ARG  13           HD1      ARG  13  -3.904  -2.389  -3.561
  113    HE   ARG  13           HE       ARG  13  -3.253   0.420  -3.325
  114   HH11  ARG  13          HH11      ARG  13  -3.476   1.634  -5.231
  115   HH12  ARG  13          HH12      ARG  13  -3.626   0.824  -6.755
  116   HH21  ARG  13          HH21      ARG  13  -3.430  -2.355  -5.384
  117   HH22  ARG  13          HH22      ARG  13  -3.601  -1.434  -6.842
  118    H    ASN  14           HN       ASN  14  -4.898  -0.150   0.112
  119    HA   ASN  14           HA       ASN  14  -5.947  -2.172   2.004
  120    HB2  ASN  14           HB2      ASN  14  -7.951  -0.588   2.103
  121    HB3  ASN  14           HB1      ASN  14  -6.474  -0.035   2.889
  122   HD21  ASN  14          HD21      ASN  14  -4.940   0.982   0.855
  123   HD22  ASN  14          HD22      ASN  14  -5.761   2.222   0.036
  124    H    GLU  15           HN       GLU  15  -8.584  -2.125   1.341
  125    HA   GLU  15           HA       GLU  15  -8.631  -3.692  -1.055
  126    HB2  GLU  15           HB2      GLU  15 -10.129  -4.181   0.826
  127    HB3  GLU  15           HB1      GLU  15 -10.908  -2.611   0.624
  128    HG2  GLU  15           HG2      GLU  15 -12.177  -3.354  -1.090
  129    HG3  GLU  15           HG1      GLU  15 -10.795  -4.114  -1.877
  130    H    ARG  16           HN       ARG  16  -7.595  -1.512  -2.036
  131    HA   ARG  16           HA       ARG  16  -7.843   0.340  -3.403
  132    HB2  ARG  16           HB2      ARG  16  -8.226  -1.348  -5.019
  133    HB3  ARG  16           HB1      ARG  16  -9.846  -1.674  -4.407
  134    HG2  ARG  16           HG2      ARG  16 -10.762   0.176  -5.439
  135    HG3  ARG  16           HG1      ARG  16  -9.262   1.101  -5.341
  136    HD2  ARG  16           HD2      ARG  16  -8.359   0.097  -7.237
  137    HD3  ARG  16           HD1      ARG  16  -9.361  -1.343  -7.076
  138    HE   ARG  16           HE       ARG  16 -11.080  -0.231  -8.208
  139   HH11  ARG  16          HH11      ARG  16 -11.835   1.481  -9.495
  140   HH12  ARG  16          HH12      ARG  16 -10.954   2.971  -9.551
  141   HH21  ARG  16          HH21      ARG  16  -8.486   1.900  -7.364
  142   HH22  ARG  16          HH22      ARG  16  -9.058   3.208  -8.344
  Start of MODEL    7
    1    H1   GLY   1           HN       GLY   1  -9.067   1.878  -3.847
    2    HA2  GLY   1           HA2      GLY   1 -10.444   3.866  -3.652
    3    HA3  GLY   1           HA1      GLY   1 -10.841   3.369  -2.010
    4    H    SER   2           HN       SER   2  -8.207   2.632  -1.207
    5    HA   SER   2           HA       SER   2  -7.225   5.122  -0.302
    6    HB2  SER   2           HB2      SER   2  -6.834   2.545   0.450
    7    HB3  SER   2           HB1      SER   2  -5.321   2.859  -0.396
    8    HG   SER   2           HG       SER   2  -6.415   4.092   1.879
    9    H    ARG   3           HN       ARG   3  -4.524   5.136  -0.600
   10    HA   ARG   3           HA       ARG   3  -4.231   5.764  -3.458
   11    HB2  ARG   3           HB2      ARG   3  -3.647   7.722  -2.407
   12    HB3  ARG   3           HB1      ARG   3  -3.115   6.898  -0.944
   13    HG2  ARG   3           HG2      ARG   3  -1.019   6.301  -1.919
   14    HG3  ARG   3           HG1      ARG   3  -1.572   6.712  -3.544
   15    HD2  ARG   3           HD2      ARG   3  -1.361   8.733  -1.304
   16    HD3  ARG   3           HD1      ARG   3  -0.064   8.434  -2.459
   17    HE   ARG   3           HE       ARG   3  -2.173   8.928  -4.079
   18   HH11  ARG   3          HH11      ARG   3  -2.833  10.999  -4.740
   19   HH12  ARG   3          HH12      ARG   3  -2.487  12.371  -3.742
   20   HH21  ARG   3          HH21      ARG   3  -0.884  10.517  -1.289
   21   HH22  ARG   3          HH22      ARG   3  -1.384  12.099  -1.788
   22    H    GLY   4           HN       GLY   4  -3.067   3.773  -0.917
   23    HA2  GLY   4           HA2      GLY   4  -1.494   2.090  -0.817
   24    HA3  GLY   4           HA1      GLY   4  -1.851   1.865  -2.530
   25    H    PHE   5           HN       PHE   5   0.691   1.382  -1.610
   26    HA   PHE   5           HA       PHE   5   2.263   3.061  -3.280
   27    HB2  PHE   5           HB2      PHE   5   1.912   4.572  -1.286
   28    HB3  PHE   5           HB1      PHE   5   2.803   3.393  -0.324
   29    HD1  PHE   5           HD1      PHE   5   5.135   3.553  -0.189
   30    HD2  PHE   5           HD2      PHE   5   3.085   5.359  -3.504
   31    HE1  PHE   5           HE1      PHE   5   7.273   4.527  -0.981
   32    HE2  PHE   5           HE2      PHE   5   5.223   6.334  -4.296
   33    HZ   PHE   5           HZ       PHE   5   7.318   5.917  -3.034
   34    H    ARG   6           HN       ARG   6   4.587   2.494  -3.164
   35    HA   ARG   6           HA       ARG   6   4.976  -0.261  -2.145
   36    HB2  ARG   6           HB2      ARG   6   5.201   0.749  -4.788
   37    HB3  ARG   6           HB1      ARG   6   6.843   0.449  -4.221
   38    HG2  ARG   6           HG2      ARG   6   6.053  -1.598  -5.209
   39    HG3  ARG   6           HG1      ARG   6   6.065  -1.839  -3.462
   40    HD2  ARG   6           HD2      ARG   6   3.903  -2.461  -3.668
   41    HD3  ARG   6           HD1      ARG   6   3.551  -0.757  -3.946
   42    HE   ARG   6           HE       ARG   6   4.359  -2.182  -6.331
   43   HH11  ARG   6          HH11      ARG   6   2.751  -2.408  -7.920
   44   HH12  ARG   6          HH12      ARG   6   1.094  -2.107  -7.516
   45   HH21  ARG   6          HH21      ARG   6   1.767  -1.317  -4.207
   46   HH22  ARG   6          HH22      ARG   6   0.537  -1.489  -5.415
   47    H    PHE   7           HN       PHE   7   6.575  -0.524  -0.691
   48    HA   PHE   7           HA       PHE   7   8.760   1.448  -0.632
   49    HB2  PHE   7           HB2      PHE   7   6.655   1.478   1.183
   50    HB3  PHE   7           HB1      PHE   7   7.933   0.648   2.058
   51    HD1  PHE   7           HD1      PHE   7  10.401   1.859   1.126
   52    HD2  PHE   7           HD2      PHE   7   6.585   3.713   1.857
   53    HE1  PHE   7           HE1      PHE   7  11.524   4.033   1.509
   54    HE2  PHE   7           HE2      PHE   7   7.718   5.883   2.236
   55    HZ   PHE   7           HZ       PHE   7  10.186   6.044   2.062
   56    HA   DPR   8           HA       DPR   8  11.721  -1.764  -0.556
   57    HB2  DPR   8           HB2      DPR   8  11.667  -3.072  -2.478
   58    HB3  DPR   8           HB1      DPR   8   9.913  -3.316  -2.378
   59    HG2  DPR   8           HG2      DPR   8  11.442  -1.003  -3.419
   60    HG3  DPR   8           HG1      DPR   8   9.882  -1.658  -3.941
   61    HD2  DPR   8           HD2      DPR   8  10.275   0.583  -2.253
   62    HD3  DPR   8           HD1      DPR   8   8.737  -0.257  -2.551
   63    HA   PRO   9           HA       PRO   9  10.429  -5.215   1.979
   64    HB2  PRO   9           HB2      PRO   9  10.951  -4.242   4.473
   65    HB3  PRO   9           HB1      PRO   9  12.225  -4.750   3.347
   66    HG2  PRO   9           HG2      PRO   9  11.252  -2.011   3.994
   67    HG3  PRO   9           HG1      PRO   9  12.905  -2.589   3.725
   68    HD2  PRO   9           HD2      PRO   9  11.465  -1.255   1.813
   69    HD3  PRO   9           HD1      PRO   9  12.729  -2.445   1.428
   70    H    LYS  10           HN       LYS  10   8.601  -2.612   1.522
   71    HA   LYS  10           HA       LYS  10   6.353  -3.687   2.943
   72    HB2  LYS  10           HB2      LYS  10   7.593  -2.341   4.706
   73    HB3  LYS  10           HB1      LYS  10   7.260  -0.913   3.736
   74    HG2  LYS  10           HG2      LYS  10   4.765  -1.637   3.898
   75    HG3  LYS  10           HG1      LYS  10   5.305  -2.665   5.228
   76    HD2  LYS  10           HD2      LYS  10   6.290  -0.686   6.339
   77    HD3  LYS  10           HD1      LYS  10   5.701   0.332   5.025
   78    HE2  LYS  10           HE2      LYS  10   3.401  -0.925   5.668
   79    HE3  LYS  10           HE1      LYS  10   4.196  -0.955   7.241
   80    HZ1  LYS  10           HZ1      LYS  10   2.790   1.074   6.641
   81    HZ2  LYS  10           HZ2      LYS  10   4.087   1.522   5.639
   82    HZ3  LYS  10           HZ3      LYS  10   4.323   1.345   7.313
   83    H    ILE  11           HN       ILE  11   4.389  -2.779   2.288
   84    HA   ILE  11           HA       ILE  11   4.427  -0.640   0.299
   85    HB   ILE  11           HB       ILE  11   3.413  -1.872  -1.447
   86   HG12  ILE  11          HG12      ILE  11   3.180  -4.508  -0.803
   87   HG13  ILE  11          HG11      ILE  11   2.793  -3.772   0.751
   88   HG21  ILE  11          HG21      ILE  11   5.507  -3.714  -0.261
   89   HG22  ILE  11          HG22      ILE  11   5.868  -2.238  -1.156
   90   HG23  ILE  11          HG23      ILE  11   5.054  -3.578  -1.959
   91   HD11  ILE  11          HD11      ILE  11   0.694  -3.790  -0.245
   92   HD12  ILE  11          HD12      ILE  11   1.348  -3.558  -1.865
   93   HD13  ILE  11          HD13      ILE  11   1.263  -2.199  -0.746
   94    H    ILE  12           HN       ILE  12   2.480   0.433   0.086
   95    HA   ILE  12           HA       ILE  12   0.520  -0.170   2.196
   96    HB   ILE  12           HB       ILE  12   0.710   2.315   0.483
   97   HG12  ILE  12          HG12      ILE  12   2.813   2.129   1.655
   98   HG13  ILE  12          HG11      ILE  12   1.829   3.309   2.519
   99   HG21  ILE  12          HG21      ILE  12  -0.569   3.300   2.371
  100   HG22  ILE  12          HG22      ILE  12  -0.624   1.713   3.139
  101   HG23  ILE  12          HG23      ILE  12  -1.442   1.976   1.599
  102   HD11  ILE  12          HD11      ILE  12   1.063   1.278   3.960
  103   HD12  ILE  12          HD12      ILE  12   2.668   1.950   4.245
  104   HD13  ILE  12          HD13      ILE  12   2.486   0.474   3.298
  105    H    ARG  13           HN       ARG  13  -1.515  -0.776   1.760
  106    HA   ARG  13           HA       ARG  13  -3.037  -0.206  -0.492
  107    HB2  ARG  13           HB2      ARG  13  -1.713  -1.399  -1.985
  108    HB3  ARG  13           HB1      ARG  13  -1.274  -2.614  -0.784
  109    HG2  ARG  13           HG2      ARG  13  -3.353  -3.714  -0.959
  110    HG3  ARG  13           HG1      ARG  13  -4.129  -2.317  -1.709
  111    HD2  ARG  13           HD2      ARG  13  -3.427  -4.357  -3.203
  112    HD3  ARG  13           HD1      ARG  13  -3.155  -2.718  -3.786
  113    HE   ARG  13           HE       ARG  13  -0.929  -3.860  -2.312
  114   HH11  ARG  13          HH11      ARG  13   0.963  -4.174  -3.530
  115   HH12  ARG  13          HH12      ARG  13   0.900  -4.080  -5.259
  116   HH21  ARG  13          HH21      ARG  13  -2.500  -3.407  -5.362
  117   HH22  ARG  13          HH22      ARG  13  -1.061  -3.646  -6.296
  118    H    ASN  14           HN       ASN  14  -5.105  -1.000  -0.277
  119    HA   ASN  14           HA       ASN  14  -5.712  -3.279   1.377
  120    HB2  ASN  14           HB2      ASN  14  -7.220  -1.596   2.822
  121    HB3  ASN  14           HB1      ASN  14  -5.589  -2.057   3.304
  122   HD21  ASN  14          HD21      ASN  14  -6.181   0.067   0.530
  123   HD22  ASN  14          HD22      ASN  14  -5.547   1.468   1.251
  124    H    GLU  15           HN       GLU  15  -7.524  -4.165   0.614
  125    HA   GLU  15           HA       GLU  15  -9.322  -4.439  -0.822
  126    HB2  GLU  15           HB2      GLU  15 -10.089  -1.992   0.784
  127    HB3  GLU  15           HB1      GLU  15 -11.214  -2.891  -0.235
  128    HG2  GLU  15           HG2      GLU  15 -11.447  -3.732   2.012
  129    HG3  GLU  15           HG1      GLU  15 -10.609  -4.964   1.070
  130    H    ARG  16           HN       ARG  16  -9.901  -1.006  -0.774
  131    HA   ARG  16           HA       ARG  16  -8.506  -0.268  -3.114
  132    HB2  ARG  16           HB2      ARG  16  -9.908  -1.751  -4.350
  133    HB3  ARG  16           HB1      ARG  16 -11.353  -1.196  -3.505
  134    HG2  ARG  16           HG2      ARG  16 -11.337   0.896  -4.602
  135    HG3  ARG  16           HG1      ARG  16  -9.655   0.717  -5.104
  136    HD2  ARG  16           HD2      ARG  16 -11.532  -1.375  -6.058
  137    HD3  ARG  16           HD1      ARG  16 -11.743   0.229  -6.753
  138    HE   ARG  16           HE       ARG  16  -9.491  -1.556  -7.169
  139   HH11  ARG  16          HH11      ARG  16  -7.965  -0.834  -8.688
  140   HH12  ARG  16          HH12      ARG  16  -7.999   0.812  -9.228
  141   HH21  ARG  16          HH21      ARG  16 -10.722   1.676  -7.261
  142   HH22  ARG  16          HH22      ARG  16  -9.561   2.233  -8.420
  Start of MODEL    8
    1    H1   GLY   1           HN       GLY   1  -9.822   1.191   0.506
    2    HA2  GLY   1           HA2      GLY   1 -10.920   3.895   0.380
    3    HA3  GLY   1           HA1      GLY   1  -9.316   3.444   0.950
    4    H    SER   2           HN       SER   2  -8.721   1.796  -1.383
    5    HA   SER   2           HA       SER   2  -7.986   1.960  -3.572
    6    HB2  SER   2           HB2      SER   2  -9.019   3.404  -5.027
    7    HB3  SER   2           HB1      SER   2 -10.176   3.484  -3.701
    8    HG   SER   2           HG       SER   2  -9.681   5.566  -4.134
    9    H    ARG   3           HN       ARG   3  -6.413   2.631  -1.325
   10    HA   ARG   3           HA       ARG   3  -4.544   4.533  -2.579
   11    HB2  ARG   3           HB2      ARG   3  -5.049   4.517   0.395
   12    HB3  ARG   3           HB1      ARG   3  -4.160   5.707  -0.555
   13    HG2  ARG   3           HG2      ARG   3  -6.430   6.026  -1.813
   14    HG3  ARG   3           HG1      ARG   3  -7.131   5.267  -0.383
   15    HD2  ARG   3           HD2      ARG   3  -5.878   6.975   1.007
   16    HD3  ARG   3           HD1      ARG   3  -5.476   7.798  -0.496
   17    HE   ARG   3           HE       ARG   3  -8.281   7.354  -0.343
   18   HH11  ARG   3          HH11      ARG   3  -9.603   9.135   0.144
   19   HH12  ARG   3          HH12      ARG   3  -8.914  10.545   0.876
   20   HH21  ARG   3          HH21      ARG   3  -5.700   9.248   0.973
   21   HH22  ARG   3          HH22      ARG   3  -6.704  10.609   1.347
   22    H    GLY   4           HN       GLY   4  -2.391   4.050  -2.309
   23    HA2  GLY   4           HA2      GLY   4  -1.505   2.024  -0.446
   24    HA3  GLY   4           HA1      GLY   4  -1.496   1.492  -2.127
   25    H    PHE   5           HN       PHE   5   0.889   1.381  -1.215
   26    HA   PHE   5           HA       PHE   5   2.391   3.314  -2.647
   27    HB2  PHE   5           HB2      PHE   5   1.676   4.544  -0.480
   28    HB3  PHE   5           HB1      PHE   5   2.843   3.492   0.321
   29    HD1  PHE   5           HD1      PHE   5   5.236   3.398  -0.682
   30    HD2  PHE   5           HD2      PHE   5   2.397   6.498  -1.566
   31    HE1  PHE   5           HE1      PHE   5   7.081   4.871  -1.440
   32    HE2  PHE   5           HE2      PHE   5   4.243   7.972  -2.324
   33    HZ   PHE   5           HZ       PHE   5   6.585   7.158  -2.261
   34    H    ARG   6           HN       ARG   6   3.988   2.089  -3.407
   35    HA   ARG   6           HA       ARG   6   4.843  -0.288  -1.964
   36    HB2  ARG   6           HB2      ARG   6   4.551   0.191  -4.621
   37    HB3  ARG   6           HB1      ARG   6   6.255   0.601  -4.439
   38    HG2  ARG   6           HG2      ARG   6   6.753  -1.591  -3.515
   39    HG3  ARG   6           HG1      ARG   6   5.038  -2.012  -3.485
   40    HD2  ARG   6           HD2      ARG   6   5.776  -1.129  -6.128
   41    HD3  ARG   6           HD1      ARG   6   6.869  -2.404  -5.603
   42    HE   ARG   6           HE       ARG   6   5.060  -3.901  -5.569
   43   HH11  ARG   6          HH11      ARG   6   2.958  -4.472  -6.199
   44   HH12  ARG   6          HH12      ARG   6   1.830  -3.240  -6.659
   45   HH21  ARG   6          HH21      ARG   6   4.056  -0.634  -6.148
   46   HH22  ARG   6          HH22      ARG   6   2.452  -1.071  -6.630
   47    H    PHE   7           HN       PHE   7   6.518  -0.342  -0.613
   48    HA   PHE   7           HA       PHE   7   8.690   1.621  -0.962
   49    HB2  PHE   7           HB2      PHE   7   6.819   1.462   1.234
   50    HB3  PHE   7           HB1      PHE   7   8.448   1.157   1.827
   51    HD1  PHE   7           HD1      PHE   7  10.255   2.802   0.395
   52    HD2  PHE   7           HD2      PHE   7   6.174   3.689   1.446
   53    HE1  PHE   7           HE1      PHE   7  10.741   5.225   0.258
   54    HE2  PHE   7           HE2      PHE   7   6.671   6.111   1.302
   55    HZ   PHE   7           HZ       PHE   7   8.950   6.880   0.708
   56    HA   DPR   8           HA       DPR   8  11.741  -1.518  -0.912
   57    HB2  DPR   8           HB2      DPR   8  11.600  -2.892  -2.781
   58    HB3  DPR   8           HB1      DPR   8   9.857  -3.160  -2.574
   59    HG2  DPR   8           HG2      DPR   8  11.288  -0.862  -3.778
   60    HG3  DPR   8           HG1      DPR   8   9.711  -1.556  -4.187
   61    HD2  DPR   8           HD2      DPR   8  10.164   0.746  -2.600
   62    HD3  DPR   8           HD1      DPR   8   8.626  -0.122  -2.783
   63    HA   PRO   9           HA       PRO   9  10.663  -4.899   1.811
   64    HB2  PRO   9           HB2      PRO   9  11.301  -3.827   4.236
   65    HB3  PRO   9           HB1      PRO   9  12.521  -4.350   3.059
   66    HG2  PRO   9           HG2      PRO   9  11.528  -1.610   3.664
   67    HG3  PRO   9           HG1      PRO   9  13.175  -2.165   3.322
   68    HD2  PRO   9           HD2      PRO   9  11.604  -0.928   1.450
   69    HD3  PRO   9           HD1      PRO   9  12.869  -2.106   1.036
   70    H    LYS  10           HN       LYS  10   8.744  -2.353   1.374
   71    HA   LYS  10           HA       LYS  10   6.671  -3.413   3.096
   72    HB2  LYS  10           HB2      LYS  10   7.959  -1.718   4.492
   73    HB3  LYS  10           HB1      LYS  10   7.411  -0.494   3.358
   74    HG2  LYS  10           HG2      LYS  10   5.017  -1.357   3.890
   75    HG3  LYS  10           HG1      LYS  10   5.764  -2.126   5.293
   76    HD2  LYS  10           HD2      LYS  10   6.762   0.147   5.848
   77    HD3  LYS  10           HD1      LYS  10   5.695   0.818   4.615
   78    HE2  LYS  10           HE2      LYS  10   3.848  -0.554   5.929
   79    HE3  LYS  10           HE1      LYS  10   5.000  -0.410   7.256
   80    HZ1  LYS  10           HZ1      LYS  10   4.452   2.005   5.722
   81    HZ2  LYS  10           HZ2      LYS  10   4.720   1.812   7.388
   82    HZ3  LYS  10           HZ3      LYS  10   3.201   1.444   6.720
   83    H    ILE  11           HN       ILE  11   4.594  -2.749   2.502
   84    HA   ILE  11           HA       ILE  11   4.286  -0.949   0.226
   85    HB   ILE  11           HB       ILE  11   3.212  -2.504  -1.208
   86   HG12  ILE  11          HG12      ILE  11   3.306  -5.022  -0.186
   87   HG13  ILE  11          HG11      ILE  11   3.009  -4.104   1.287
   88   HG21  ILE  11          HG21      ILE  11   4.955  -4.118  -1.660
   89   HG22  ILE  11          HG22      ILE  11   5.579  -3.972  -0.020
   90   HG23  ILE  11          HG23      ILE  11   5.710  -2.614  -1.137
   91   HD11  ILE  11          HD11      ILE  11   1.287  -4.404  -1.145
   92   HD12  ILE  11          HD12      ILE  11   1.186  -2.901  -0.231
   93   HD13  ILE  11          HD13      ILE  11   0.830  -4.437   0.557
   94    H    ILE  12           HN       ILE  12   2.345   0.079   0.185
   95    HA   ILE  12           HA       ILE  12   0.458  -0.595   2.363
   96    HB   ILE  12           HB       ILE  12   0.746   2.054   0.934
   97   HG12  ILE  12          HG12      ILE  12   2.832   1.640   2.090
   98   HG13  ILE  12          HG11      ILE  12   1.897   2.782   3.052
   99   HG21  ILE  12          HG21      ILE  12  -0.298   2.054   3.646
  100   HG22  ILE  12          HG22      ILE  12  -1.258   1.019   2.590
  101   HG23  ILE  12          HG23      ILE  12  -1.011   2.715   2.175
  102   HD11  ILE  12          HD11      ILE  12   2.624   1.245   4.664
  103   HD12  ILE  12          HD12      ILE  12   2.435  -0.130   3.580
  104   HD13  ILE  12          HD13      ILE  12   1.014   0.643   4.278
  105    H    ARG  13           HN       ARG  13  -1.642  -0.997   1.897
  106    HA   ARG  13           HA       ARG  13  -3.080  -0.135  -0.333
  107    HB2  ARG  13           HB2      ARG  13  -1.824  -1.351  -1.870
  108    HB3  ARG  13           HB1      ARG  13  -1.541  -2.676  -0.742
  109    HG2  ARG  13           HG2      ARG  13  -3.709  -3.553  -1.035
  110    HG3  ARG  13           HG1      ARG  13  -4.326  -2.041  -1.703
  111    HD2  ARG  13           HD2      ARG  13  -2.894  -2.355  -3.699
  112    HD3  ARG  13           HD1      ARG  13  -2.322  -3.883  -3.036
  113    HE   ARG  13           HE       ARG  13  -4.292  -4.848  -3.768
  114   HH11  ARG  13          HH11      ARG  13  -6.388  -4.817  -4.644
  115   HH12  ARG  13          HH12      ARG  13  -7.232  -3.313  -4.804
  116   HH21  ARG  13          HH21      ARG  13  -4.650  -1.418  -3.476
  117   HH22  ARG  13          HH22      ARG  13  -6.248  -1.388  -4.143
  118    H    ASN  14           HN       ASN  14  -5.207  -0.756  -0.216
  119    HA   ASN  14           HA       ASN  14  -5.902  -2.784   1.822
  120    HB2  ASN  14           HB2      ASN  14  -7.442  -0.231   1.332
  121    HB3  ASN  14           HB1      ASN  14  -7.681  -1.400   2.631
  122   HD21  ASN  14          HD21      ASN  14  -7.200   1.290   3.311
  123   HD22  ASN  14          HD22      ASN  14  -5.650   1.429   3.989
  124    H    GLU  15           HN       GLU  15  -8.760  -1.724   1.046
  125    HA   GLU  15           HA       GLU  15  -9.157  -2.609  -1.644
  126    HB2  GLU  15           HB2      GLU  15  -8.711  -4.747  -0.198
  127    HB3  GLU  15           HB1      GLU  15 -10.361  -4.481   0.365
  128    HG2  GLU  15           HG2      GLU  15 -11.149  -4.455  -1.981
  129    HG3  GLU  15           HG1      GLU  15  -9.501  -4.756  -2.530
  130    H    ARG  16           HN       ARG  16  -9.913  -0.310  -0.331
  131    HA   ARG  16           HA       ARG  16 -12.709  -0.240  -0.836
  132    HB2  ARG  16           HB2      ARG  16 -12.605  -1.394   1.435
  133    HB3  ARG  16           HB1      ARG  16 -11.994   0.132   2.074
  134    HG2  ARG  16           HG2      ARG  16 -14.187   0.658   2.350
  135    HG3  ARG  16           HG1      ARG  16 -14.160   0.975   0.614
  136    HD2  ARG  16           HD2      ARG  16 -14.893  -1.658   1.926
  137    HD3  ARG  16           HD1      ARG  16 -16.020  -0.527   1.180
  138    HE   ARG  16           HE       ARG  16 -14.340  -1.030  -0.858
  139   HH11  ARG  16          HH11      ARG  16 -14.468  -2.806  -2.267
  140   HH12  ARG  16          HH12      ARG  16 -15.189  -4.285  -1.725
  141   HH21  ARG  16          HH21      ARG  16 -15.901  -3.084   1.448
  142   HH22  ARG  16          HH22      ARG  16 -16.001  -4.442   0.378
  Start of MODEL    9
    1    H1   GLY   1           HN       GLY   1  -8.438  -0.422  -3.589
    2    HA2  GLY   1           HA2      GLY   1  -8.177   0.661  -5.738
    3    HA3  GLY   1           HA1      GLY   1  -9.906   0.987  -5.734
    4    H    SER   2           HN       SER   2  -8.403   1.418  -2.709
    5    HA   SER   2           HA       SER   2  -8.933   4.245  -2.734
    6    HB2  SER   2           HB2      SER   2  -7.477   2.606  -0.651
    7    HB3  SER   2           HB1      SER   2  -8.179   4.205  -0.430
    8    HG   SER   2           HG       SER   2 -10.169   2.970  -1.284
    9    H    ARG   3           HN       ARG   3  -6.290   4.047  -0.880
   10    HA   ARG   3           HA       ARG   3  -4.445   4.875  -3.046
   11    HB2  ARG   3           HB2      ARG   3  -4.301   5.992  -0.253
   12    HB3  ARG   3           HB1      ARG   3  -3.625   6.647  -1.745
   13    HG2  ARG   3           HG2      ARG   3  -6.287   6.572  -2.369
   14    HG3  ARG   3           HG1      ARG   3  -6.351   6.916  -0.639
   15    HD2  ARG   3           HD2      ARG   3  -4.725   8.778  -0.995
   16    HD3  ARG   3           HD1      ARG   3  -4.804   8.473  -2.728
   17    HE   ARG   3           HE       ARG   3  -6.784   9.829  -1.133
   18   HH11  ARG   3          HH11      ARG   3  -8.617  10.574  -2.251
   19   HH12  ARG   3          HH12      ARG   3  -8.961   9.972  -3.839
   20   HH21  ARG   3          HH21      ARG   3  -6.193   7.883  -3.933
   21   HH22  ARG   3          HH22      ARG   3  -7.587   8.448  -4.790
   22    H    GLY   4           HN       GLY   4  -2.397   4.075  -2.984
   23    HA2  GLY   4           HA2      GLY   4  -1.514   2.584  -0.609
   24    HA3  GLY   4           HA1      GLY   4  -1.609   1.721  -2.144
   25    H    PHE   5           HN       PHE   5   0.751   1.471  -1.524
   26    HA   PHE   5           HA       PHE   5   2.343   3.087  -3.229
   27    HB2  PHE   5           HB2      PHE   5   1.996   4.610  -1.204
   28    HB3  PHE   5           HB1      PHE   5   2.973   3.455  -0.300
   29    HD1  PHE   5           HD1      PHE   5   5.287   3.766  -0.247
   30    HD2  PHE   5           HD2      PHE   5   3.031   5.348  -3.543
   31    HE1  PHE   5           HE1      PHE   5   7.346   4.800  -1.160
   32    HE2  PHE   5           HE2      PHE   5   5.091   6.382  -4.456
   33    HZ   PHE   5           HZ       PHE   5   7.249   6.107  -3.265
   34    H    ARG   6           HN       ARG   6   4.696   2.490  -3.017
   35    HA   ARG   6           HA       ARG   6   5.019  -0.208  -1.850
   36    HB2  ARG   6           HB2      ARG   6   4.902   0.327  -4.568
   37    HB3  ARG   6           HB1      ARG   6   6.633   0.366  -4.247
   38    HG2  ARG   6           HG2      ARG   6   6.619  -1.875  -3.377
   39    HG3  ARG   6           HG1      ARG   6   4.852  -1.918  -3.341
   40    HD2  ARG   6           HD2      ARG   6   6.523  -1.640  -5.851
   41    HD3  ARG   6           HD1      ARG   6   5.790  -3.140  -5.292
   42    HE   ARG   6           HE       ARG   6   4.451  -0.993  -6.645
   43   HH11  ARG   6          HH11      ARG   6   2.210  -1.221  -6.936
   44   HH12  ARG   6          HH12      ARG   6   1.333  -2.383  -5.998
   45   HH21  ARG   6          HH21      ARG   6   4.128  -3.489  -4.270
   46   HH22  ARG   6          HH22      ARG   6   2.419  -3.667  -4.488
   47    H    PHE   7           HN       PHE   7   6.601  -0.277  -0.408
   48    HA   PHE   7           HA       PHE   7   8.899   1.553  -0.731
   49    HB2  PHE   7           HB2      PHE   7   6.998   1.392   1.442
   50    HB3  PHE   7           HB1      PHE   7   8.612   1.015   2.036
   51    HD1  PHE   7           HD1      PHE   7  10.467   2.655   0.623
   52    HD2  PHE   7           HD2      PHE   7   6.435   3.625   1.785
   53    HE1  PHE   7           HE1      PHE   7  11.028   5.067   0.581
   54    HE2  PHE   7           HE2      PHE   7   7.006   6.034   1.733
   55    HZ   PHE   7           HZ       PHE   7   9.299   6.755   1.132
   56    HA   DPR   8           HA       DPR   8  11.839  -1.704  -0.612
   57    HB2  DPR   8           HB2      DPR   8  11.808  -2.944  -2.577
   58    HB3  DPR   8           HB1      DPR   8  10.047  -3.154  -2.532
   59    HG2  DPR   8           HG2      DPR   8  11.653  -0.835  -3.443
   60    HG3  DPR   8           HG1      DPR   8  10.108  -1.451  -4.048
   61    HD2  DPR   8           HD2      DPR   8  10.442   0.733  -2.295
   62    HD3  DPR   8           HD1      DPR   8   8.916  -0.109  -2.639
   63    HA   PRO   9           HA       PRO   9  10.337  -5.218   1.733
   64    HB2  PRO   9           HB2      PRO   9  10.964  -4.450   4.260
   65    HB3  PRO   9           HB1      PRO   9  12.195  -4.927   3.073
   66    HG2  PRO   9           HG2      PRO   9  11.347  -2.201   3.926
   67    HG3  PRO   9           HG1      PRO   9  12.974  -2.829   3.606
   68    HD2  PRO   9           HD2      PRO   9  11.573  -1.313   1.799
   69    HD3  PRO   9           HD1      PRO   9  12.796  -2.516   1.329
   70    H    LYS  10           HN       LYS  10   8.629  -2.528   1.408
   71    HA   LYS  10           HA       LYS  10   6.485  -3.495   3.130
   72    HB2  LYS  10           HB2      LYS  10   7.870  -1.751   4.403
   73    HB3  LYS  10           HB1      LYS  10   7.279  -0.581   3.232
   74    HG2  LYS  10           HG2      LYS  10   4.905  -1.401   3.899
   75    HG3  LYS  10           HG1      LYS  10   5.702  -2.119   5.302
   76    HD2  LYS  10           HD2      LYS  10   6.679   0.112   5.832
   77    HD3  LYS  10           HD1      LYS  10   5.754   0.800   4.496
   78    HE2  LYS  10           HE2      LYS  10   3.701  -0.308   5.668
   79    HE3  LYS  10           HE1      LYS  10   4.749  -0.360   7.085
   80    HZ1  LYS  10           HZ1      LYS  10   3.411   1.673   6.981
   81    HZ2  LYS  10           HZ2      LYS  10   4.145   2.080   5.504
   82    HZ3  LYS  10           HZ3      LYS  10   5.072   2.006   6.926
   83    H    ILE  11           HN       ILE  11   4.418  -2.705   2.552
   84    HA   ILE  11           HA       ILE  11   4.173  -1.067   0.150
   85    HB   ILE  11           HB       ILE  11   2.960  -2.653  -1.137
   86   HG12  ILE  11          HG12      ILE  11   2.912  -5.083   0.077
   87   HG13  ILE  11          HG11      ILE  11   2.732  -4.038   1.482
   88   HG21  ILE  11          HG21      ILE  11   5.448  -2.924  -1.112
   89   HG22  ILE  11          HG22      ILE  11   4.582  -4.408  -1.502
   90   HG23  ILE  11          HG23      ILE  11   5.257  -4.182   0.110
   91   HD11  ILE  11          HD11      ILE  11   0.895  -4.429  -0.840
   92   HD12  ILE  11          HD12      ILE  11   0.945  -2.832  -0.099
   93   HD13  ILE  11          HD13      ILE  11   0.513  -4.239   0.869
   94    H    ILE  12           HN       ILE  12   2.271   0.044   0.032
   95    HA   ILE  12           HA       ILE  12   0.427  -0.300   2.320
   96    HB   ILE  12           HB       ILE  12   0.815   2.171   0.621
   97   HG12  ILE  12          HG12      ILE  12   2.910   1.748   1.759
   98   HG13  ILE  12          HG11      ILE  12   2.074   3.038   2.621
   99   HG21  ILE  12          HG21      ILE  12  -0.506   1.710   3.310
  100   HG22  ILE  12          HG22      ILE  12  -1.343   2.008   1.786
  101   HG23  ILE  12          HG23      ILE  12  -0.343   3.270   2.504
  102   HD11  ILE  12          HD11      ILE  12   2.454   0.166   3.433
  103   HD12  ILE  12          HD12      ILE  12   1.108   1.096   4.086
  104   HD13  ILE  12          HD13      ILE  12   2.765   1.629   4.363
  105    H    ARG  13           HN       ARG  13  -1.639  -0.812   1.939
  106    HA   ARG  13           HA       ARG  13  -3.063  -0.052  -0.406
  107    HB2  ARG  13           HB2      ARG  13  -3.076  -1.950  -1.695
  108    HB3  ARG  13           HB1      ARG  13  -1.455  -2.091  -1.017
  109    HG2  ARG  13           HG2      ARG  13  -2.556  -3.437   0.887
  110    HG3  ARG  13           HG1      ARG  13  -3.966  -3.543  -0.170
  111    HD2  ARG  13           HD2      ARG  13  -1.938  -4.214  -1.888
  112    HD3  ARG  13           HD1      ARG  13  -1.361  -4.901  -0.373
  113    HE   ARG  13           HE       ARG  13  -3.968  -5.712  -0.497
  114   HH11  ARG  13          HH11      ARG  13  -4.620  -7.647  -1.490
  115   HH12  ARG  13          HH12      ARG  13  -3.648  -8.341  -2.745
  116   HH21  ARG  13          HH21      ARG  13  -1.245  -5.844  -2.629
  117   HH22  ARG  13          HH22      ARG  13  -1.738  -7.320  -3.390
  118    H    ASN  14           HN       ASN  14  -5.207  -1.373  -0.515
  119    HA   ASN  14           HA       ASN  14  -6.070  -2.277   2.136
  120    HB2  ASN  14           HB2      ASN  14  -7.268   0.046   0.626
  121    HB3  ASN  14           HB1      ASN  14  -8.121  -0.805   1.913
  122   HD21  ASN  14          HD21      ASN  14  -5.384   1.341   1.229
  123   HD22  ASN  14          HD22      ASN  14  -5.070   1.737   2.850
  124    H    GLU  15           HN       GLU  15  -6.029  -2.578  -1.160
  125    HA   GLU  15           HA       GLU  15  -7.108  -3.953  -2.655
  126    HB2  GLU  15           HB2      GLU  15  -6.639  -5.558  -0.698
  127    HB3  GLU  15           HB1      GLU  15  -8.343  -5.353  -0.290
  128    HG2  GLU  15           HG2      GLU  15  -8.483  -7.178  -1.709
  129    HG3  GLU  15           HG1      GLU  15  -8.680  -5.865  -2.869
  130    H    ARG  16           HN       ARG  16  -8.365  -1.802  -2.873
  131    HA   ARG  16           HA       ARG  16 -11.152  -2.470  -3.088
  132    HB2  ARG  16           HB2      ARG  16 -10.755  -1.705  -0.642
  133    HB3  ARG  16           HB1      ARG  16 -10.580  -0.093  -1.338
  134    HG2  ARG  16           HG2      ARG  16 -12.848  -0.030  -1.074
  135    HG3  ARG  16           HG1      ARG  16 -12.838  -0.912  -2.601
  136    HD2  ARG  16           HD2      ARG  16 -12.936  -2.137   0.169
  137    HD3  ARG  16           HD1      ARG  16 -14.265  -2.070  -0.984
  138    HE   ARG  16           HE       ARG  16 -11.974  -3.864  -1.076
  139   HH11  ARG  16          HH11      ARG  16 -12.095  -5.472  -2.674
  140   HH12  ARG  16          HH12      ARG  16 -13.295  -5.361  -3.919
  141   HH21  ARG  16          HH21      ARG  16 -14.635  -2.392  -2.727
  142   HH22  ARG  16          HH22      ARG  16 -14.733  -3.617  -3.949
  Start of MODEL   10
    1    H1   GLY   1           HN       GLY   1  -4.611   8.221   2.860
    2    HA2  GLY   1           HA2      GLY   1  -6.456  10.301   1.926
    3    HA3  GLY   1           HA1      GLY   1  -4.708  10.289   1.714
    4    H    SER   2           HN       SER   2  -4.739   7.470   0.800
    5    HA   SER   2           HA       SER   2  -6.138   7.702  -1.778
    6    HB2  SER   2           HB2      SER   2  -3.215   6.962  -1.531
    7    HB3  SER   2           HB1      SER   2  -4.149   7.087  -3.019
    8    HG   SER   2           HG       SER   2  -3.870   9.166  -2.971
    9    H    ARG   3           HN       ARG   3  -4.133   5.340  -2.383
   10    HA   ARG   3           HA       ARG   3  -5.383   3.254  -0.747
   11    HB2  ARG   3           HB2      ARG   3  -5.417   3.075  -3.762
   12    HB3  ARG   3           HB1      ARG   3  -6.209   2.007  -2.603
   13    HG2  ARG   3           HG2      ARG   3  -7.583   3.974  -1.838
   14    HG3  ARG   3           HG1      ARG   3  -6.888   4.906  -3.166
   15    HD2  ARG   3           HD2      ARG   3  -8.409   2.306  -3.501
   16    HD3  ARG   3           HD1      ARG   3  -9.100   3.907  -3.747
   17    HE   ARG   3           HE       ARG   3  -6.708   3.365  -5.304
   18   HH11  ARG   3          HH11      ARG   3  -7.021   3.341  -7.554
   19   HH12  ARG   3          HH12      ARG   3  -8.628   3.281  -8.199
   20   HH21  ARG   3          HH21      ARG   3 -10.160   3.244  -5.089
   21   HH22  ARG   3          HH22      ARG   3 -10.405   3.227  -6.803
   22    H    GLY   4           HN       GLY   4  -3.954   1.722  -0.222
   23    HA2  GLY   4           HA2      GLY   4  -1.962   0.576  -0.090
   24    HA3  GLY   4           HA1      GLY   4  -2.041   0.535  -1.852
   25    H    PHE   5           HN       PHE   5   0.420   0.631  -0.812
   26    HA   PHE   5           HA       PHE   5   1.528   3.003  -1.907
   27    HB2  PHE   5           HB2      PHE   5   0.643   3.860   0.310
   28    HB3  PHE   5           HB1      PHE   5   1.813   2.799   1.094
   29    HD1  PHE   5           HD1      PHE   5   4.282   3.057   0.506
   30    HD2  PHE   5           HD2      PHE   5   1.302   5.952  -0.586
   31    HE1  PHE   5           HE1      PHE   5   6.058   4.751   0.151
   32    HE2  PHE   5           HE2      PHE   5   3.079   7.646  -0.941
   33    HZ   PHE   5           HZ       PHE   5   5.456   7.045  -0.573
   34    H    ARG   6           HN       ARG   6   3.402   2.339  -2.729
   35    HA   ARG   6           HA       ARG   6   4.629  -0.116  -1.817
   36    HB2  ARG   6           HB2      ARG   6   4.488   1.012  -4.266
   37    HB3  ARG   6           HB1      ARG   6   6.022   1.704  -3.740
   38    HG2  ARG   6           HG2      ARG   6   6.954  -0.504  -3.333
   39    HG3  ARG   6           HG1      ARG   6   5.396  -1.267  -3.667
   40    HD2  ARG   6           HD2      ARG   6   7.041  -1.317  -5.592
   41    HD3  ARG   6           HD1      ARG   6   5.472  -0.611  -5.971
   42    HE   ARG   6           HE       ARG   6   7.481   1.309  -5.131
   43   HH11  ARG   6          HH11      ARG   6   8.092   2.813  -6.718
   44   HH12  ARG   6          HH12      ARG   6   7.655   2.544  -8.373
   45   HH21  ARG   6          HH21      ARG   6   6.015  -0.443  -7.730
   46   HH22  ARG   6          HH22      ARG   6   6.478   0.701  -8.946
   47    H    PHE   7           HN       PHE   7   6.276  -0.321  -0.433
   48    HA   PHE   7           HA       PHE   7   7.938   2.040   0.161
   49    HB2  PHE   7           HB2      PHE   7   6.071   0.708   1.949
   50    HB3  PHE   7           HB1      PHE   7   7.704   0.655   2.604
   51    HD1  PHE   7           HD1      PHE   7   4.812   2.504   2.724
   52    HD2  PHE   7           HD2      PHE   7   9.020   3.077   2.003
   53    HE1  PHE   7           HE1      PHE   7   4.611   4.880   3.395
   54    HE2  PHE   7           HE2      PHE   7   8.805   5.449   2.677
   55    HZ   PHE   7           HZ       PHE   7   6.605   6.352   3.371
   56    HA   DPR   8           HA       DPR   8  11.599  -0.278  -0.456
   57    HB2  DPR   8           HB2      DPR   8  11.852  -0.935  -2.672
   58    HB3  DPR   8           HB1      DPR   8  10.206  -1.591  -2.767
   59    HG2  DPR   8           HG2      DPR   8  11.139   1.214  -2.977
   60    HG3  DPR   8           HG1      DPR   8   9.790   0.405  -3.789
   61    HD2  DPR   8           HD2      DPR   8   9.600   2.067  -1.511
   62    HD3  DPR   8           HD1      DPR   8   8.327   0.999  -2.140
   63    HA   PRO   9           HA       PRO   9  11.155  -4.536   0.858
   64    HB2  PRO   9           HB2      PRO   9  11.534  -4.287   3.540
   65    HB3  PRO   9           HB1      PRO   9  12.852  -4.112   2.364
   66    HG2  PRO   9           HG2      PRO   9  11.291  -2.009   3.782
   67    HG3  PRO   9           HG1      PRO   9  13.026  -2.082   3.427
   68    HD2  PRO   9           HD2      PRO   9  11.260  -0.589   1.952
   69    HD3  PRO   9           HD1      PRO   9  12.762  -1.273   1.284
   70    H    LYS  10           HN       LYS  10   8.774  -2.397   1.122
   71    HA   LYS  10           HA       LYS  10   6.900  -4.327   2.151
   72    HB2  LYS  10           HB2      LYS  10   7.879  -3.139   4.203
   73    HB3  LYS  10           HB1      LYS  10   7.086  -1.686   3.613
   74    HG2  LYS  10           HG2      LYS  10   4.916  -3.131   3.592
   75    HG3  LYS  10           HG1      LYS  10   5.822  -4.232   4.634
   76    HD2  LYS  10           HD2      LYS  10   5.197  -1.315   5.146
   77    HD3  LYS  10           HD1      LYS  10   4.625  -2.711   6.062
   78    HE2  LYS  10           HE2      LYS  10   7.114  -3.223   6.492
   79    HE3  LYS  10           HE1      LYS  10   7.421  -1.579   5.934
   80    HZ1  LYS  10           HZ1      LYS  10   5.301  -1.466   7.730
   81    HZ2  LYS  10           HZ2      LYS  10   6.874  -0.859   7.936
   82    HZ3  LYS  10           HZ3      LYS  10   6.494  -2.434   8.448
   83    H    ILE  11           HN       ILE  11   4.715  -3.727   1.777
   84    HA   ILE  11           HA       ILE  11   4.201  -1.252   0.314
   85    HB   ILE  11           HB       ILE  11   3.346  -2.271  -1.646
   86   HG12  ILE  11          HG12      ILE  11   3.722  -4.970  -1.600
   87   HG13  ILE  11          HG11      ILE  11   3.281  -4.684   0.081
   88   HG21  ILE  11          HG21      ILE  11   5.838  -2.141  -1.483
   89   HG22  ILE  11          HG22      ILE  11   5.273  -3.419  -2.558
   90   HG23  ILE  11          HG23      ILE  11   5.852  -3.820  -0.944
   91   HD11  ILE  11          HD11      ILE  11   1.361  -3.212  -0.997
   92   HD12  ILE  11          HD12      ILE  11   1.181  -4.961  -0.882
   93   HD13  ILE  11          HD13      ILE  11   1.671  -4.225  -2.406
   94    H    ILE  12           HN       ILE  12   2.078  -0.580   0.403
   95    HA   ILE  12           HA       ILE  12   0.377  -2.094   2.276
   96    HB   ILE  12           HB       ILE  12   0.062   0.788   1.414
   97   HG12  ILE  12          HG12      ILE  12   2.239   0.622   2.447
   98   HG13  ILE  12          HG11      ILE  12   1.135   1.304   3.640
   99   HG21  ILE  12          HG21      ILE  12  -1.148   0.868   3.645
  100   HG22  ILE  12          HG22      ILE  12  -1.057  -0.892   3.667
  101   HG23  ILE  12          HG23      ILE  12  -1.946  -0.070   2.386
  102   HD11  ILE  12          HD11      ILE  12   2.279  -0.344   4.864
  103   HD12  ILE  12          HD12      ILE  12   2.289  -1.475   3.514
  104   HD13  ILE  12          HD13      ILE  12   0.794  -1.170   4.395
  105    H    ARG  13           HN       ARG  13  -1.978  -2.043   1.847
  106    HA   ARG  13           HA       ARG  13  -2.496  -2.315  -1.041
  107    HB2  ARG  13           HB2      ARG  13  -2.884  -4.171   0.877
  108    HB3  ARG  13           HB1      ARG  13  -4.450  -3.361   0.911
  109    HG2  ARG  13           HG2      ARG  13  -4.770  -5.007  -0.729
  110    HG3  ARG  13           HG1      ARG  13  -4.355  -3.586  -1.688
  111    HD2  ARG  13           HD2      ARG  13  -1.874  -4.569  -1.199
  112    HD3  ARG  13           HD1      ARG  13  -2.802  -6.066  -1.211
  113    HE   ARG  13           HE       ARG  13  -3.675  -4.850  -3.457
  114   HH11  ARG  13          HH11      ARG  13  -2.650  -4.969  -5.481
  115   HH12  ARG  13          HH12      ARG  13  -0.943  -5.245  -5.566
  116   HH21  ARG  13          HH21      ARG  13  -0.527  -5.392  -2.127
  117   HH22  ARG  13          HH22      ARG  13   0.259  -5.485  -3.667
  118    H    ASN  14           HN       ASN  14  -3.512  -0.748   1.867
  119    HA   ASN  14           HA       ASN  14  -5.452   0.852   0.311
  120    HB2  ASN  14           HB2      ASN  14  -7.018   0.805   2.043
  121    HB3  ASN  14           HB1      ASN  14  -6.401  -0.847   2.035
  122   HD21  ASN  14          HD21      ASN  14  -6.187   2.271   3.759
  123   HD22  ASN  14          HD22      ASN  14  -5.529   1.621   5.181
  124    H    GLU  15           HN       GLU  15  -6.101   2.707   2.212
  125    HA   GLU  15           HA       GLU  15  -3.933   3.811   3.643
  126    HB2  GLU  15           HB2      GLU  15  -3.756   4.206   0.841
  127    HB3  GLU  15           HB1      GLU  15  -4.214   5.752   1.555
  128    HG2  GLU  15           HG2      GLU  15  -1.902   4.026   2.488
  129    HG3  GLU  15           HG1      GLU  15  -1.747   5.460   1.473
  130    H    ARG  16           HN       ARG  16  -4.371   6.343   3.889
  131    HA   ARG  16           HA       ARG  16  -7.233   6.552   4.541
  132    HB2  ARG  16           HB2      ARG  16  -5.697   6.890   6.408
  133    HB3  ARG  16           HB1      ARG  16  -4.856   8.156   5.512
  134    HG2  ARG  16           HG2      ARG  16  -6.575   9.677   5.770
  135    HG3  ARG  16           HG1      ARG  16  -7.813   8.422   5.860
  136    HD2  ARG  16           HD2      ARG  16  -7.063   7.808   8.108
  137    HD3  ARG  16           HD1      ARG  16  -5.765   8.995   8.021
  138    HE   ARG  16           HE       ARG  16  -8.220  10.305   7.559
  139   HH11  ARG  16          HH11      ARG  16  -9.161  11.486   9.257
  140   HH12  ARG  16          HH12      ARG  16  -8.700  11.157  10.893
  141   HH21  ARG  16          HH21      ARG  16  -6.452   8.659  10.037
  142   HH22  ARG  16          HH22      ARG  16  -7.166   9.557  11.335