*HEADER    ANTIMICROBIAL PROTEIN                   13-JAN-07   2OJO              
*TITLE     SOLUTION STRUCTURE AND CELL SELECTIVITY OF PISCIDIN 1 AND             
*TITLE    2 ITS ANALOGUES                                                        
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PISCIDIN_AA;                                               
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: THIS SEQUENCE OCCURS NATURALLY IN HYBRID              
*SOURCE   4 STRIPED BASS                                                         
*KEYWDS    PISCIDIN 1, ANTIMICROBIAL PEPTIDE, PROLINE, MEMBRANE,                 
*KEYWDS   2 STRUCTURE, ANTIMICROBIAL PROTEIN                                     
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    S.A.LEE, Y.K.KIM, Y.KIM                                               
*REVDAT   1   27-NOV-07 2OJO    0                                                


! S:1.8-2.7(2.5) ; M:1.8-3.5(3.0) ; W:1.8-5.0(4.0)
! add pseudoatom correction(m=1.0,r=1.5,+=0.5,q=2.4)

!H-bond
assign (resid    5 and  name N    )(resid    1 and  name O    ) 3.3 0.8 0.2
assign (resid    6 and  name N    )(resid    2 and  name O    ) 3.3 0.8 0.2
assign (resid    7 and  name N    )(resid    3 and  name O    ) 3.3 0.8 0.2
assign (resid    8 and  name N    )(resid    4 and  name O    ) 3.3 0.8 0.2
assign (resid    9 and  name N    )(resid    5 and  name O    ) 3.3 0.8 0.2
assign (resid    10 and  name N    )(resid   6 and  name O    ) 3.3 0.8 0.2
assign (resid    11 and  name N    )(resid   7 and  name O    ) 3.3 0.8 0.2
assign (resid    12 and  name N    )(resid   8 and  name O    ) 3.3 0.8 0.2
assign (resid    13 and  name N    )(resid   9 and  name O    ) 3.3 0.8 0.2
assign (resid    14 and  name N    )(resid  10 and  name O    ) 3.3 0.8 0.2
assign (resid    15 and  name N    )(resid  11 and  name O    ) 3.3 0.8 0.2
assign (resid    16 and  name N    )(resid  12 and  name O    ) 3.3 0.8 0.2
assign (resid    17 and  name N    )(resid  13 and  name O    ) 3.3 0.8 0.2
assign (resid    18 and  name N    )(resid  14 and  name O    ) 3.3 0.8 0.2
assign (resid    19 and  name N    )(resid  15 and  name O    ) 3.3 0.8 0.2
assign (resid    20 and  name N    )(resid  16 and  name O    ) 3.3 0.8 0.2
assign (resid    21 and  name N    )(resid  17 and  name O    ) 3.3 0.8 0.2
assign (resid    22 and  name N    )(resid  18 and  name O    ) 3.3 0.8 0.2

! NH-NH NOEs
! i-i+1
assign (resid    2 and  name HN   )(resid    3 and  name HN   ) 4.0 2.2 1.0 !W
assign (resid    3 and  name HN   )(resid    4 and  name HN   ) 4.0 2.2 1.5 !W+
assign (resid    4 and  name HN   )(resid    5 and  name HN   ) 4.0 2.2 1.0 !W
assign (resid    5 and  name HN   )(resid    6 and  name HN   ) 4.0 2.2 1.0 !W
assign (resid    6 and  name HN   )(resid    7 and  name HN   ) 4.0 2.2 1.0 !W
assign (resid    7 and  name HN   )(resid    8 and  name HN   ) 3.0 1.2 0.5 !M
assign (resid    8 and  name HN   )(resid    9 and  name HN   ) 4.0 2.2 1.5 !W+
assign (resid    9 and  name HN   )(resid   10 and  name HN   ) 4.0 2.2 1.0 !W
assign (resid   10 and  name HN   )(resid   11 and  name HN   ) 4.0 2.2 1.0 !W
assign (resid   11 and  name HN   )(resid   12 and  name HN   ) 4.0 2.2 1.0 !W
assign (resid   12 and  name HN   )(resid   13 and  name HN   ) 3.0 1.2 0.5 !M
assign (resid   13 and  name HN   )(resid   14 and  name HN   ) 4.0 2.2 1.0 !W
assign (resid   14 and  name HN   )(resid   15 and  name HN   ) 4.0 2.2 1.0 !W
assign (resid   15 and  name HN   )(resid   16 and  name HN   ) 4.0 2.2 1.0 !W
assign (resid   16 and  name HN   )(resid   17 and  name HN   ) 4.0 2.2 1.0 !W
assign (resid   17 and  name HN   )(resid   18 and  name HN   ) 4.0 2.2 1.0 !W
assign (resid   18 and  name HN   )(resid   19 and  name HN   ) 4.0 2.2 1.0 !W
assign (resid   19 and  name HN   )(resid   20 and  name HN   ) 4.0 2.2 1.0 !W
assign (resid   20 and  name HN   )(resid   21 and  name HN   ) 3.0 1.2 0.5 !M
assign (resid   21 and  name HN   )(resid   22 and  name HN   ) 3.0 1.2 0.5 !M

! CaH-NH NOEs
! i-i+1
assign (resid    3 and  name HN   )(resid    2 and  name HA   ) 3.0 1.2 0.5 !M
assign (resid    4 and  name HN   )(resid    3 and  name HA   ) 3.0 1.2 0.5 !M
assign (resid    5 and  name HN   )(resid    4 and  name HA   ) 3.0 1.2 0.5 !M
assign (resid    6 and  name HN   )(resid    5 and  name HA   ) 3.0 1.2 0.5 !M
assign (resid    7 and  name HN   )(resid    6 and  name HA   ) 3.0 1.2 0.5 !M
assign (resid    8 and  name HN   )(resid    7 and  name HA   ) 4.0 2.2 1.0 !W
assign (resid    9 and  name HN   )(resid    8 and  name HA   ) 4.0 2.2 1.0 !W
assign (resid   10 and  name HN   )(resid    9 and  name HA   ) 4.0 2.2 1.0 !W
assign (resid   11 and  name HN   )(resid   10 and  name HA   ) 4.0 2.2 1.0 !W
assign (resid   12 and  name HN   )(resid   11 and  name HA   ) 4.0 2.2 1.0 !W
assign (resid   13 and  name HN   )(resid   12 and  name HA   ) 4.0 2.2 1.0 !W
assign (resid   14 and  name HN   )(resid   13 and  name HA   ) 4.0 2.2 1.0 !W
assign (resid   15 and  name HN   )(resid   14 and  name HA   ) 4.0 2.2 1.0 !W
assign (resid   16 and  name HN   )(resid   15 and  name HA   ) 4.0 2.2 1.0 !W
assign (resid   17 and  name HN   )(resid   16 and  name HA   ) 4.0 2.2 1.0 !W
assign (resid   18 and  name HN   )(resid   17 and  name HA   ) 4.0 2.2 1.0 !W
assign (resid   19 and  name HN   )(resid   18 and  name HA   ) 4.0 2.2 1.0 !W
assign (resid   20 and  name HN   )(resid   19 and  name HA   ) 3.0 1.2 0.5 !M
assign (resid   21 and  name HN   )(resid   20 and  name HA   ) 3.0 1.2 0.5 !M
assign (resid   22 and  name HN   )(resid   21 and  name HA   ) 3.0 1.2 0.5 !M

! i-i+2
!assign (resid    10 and  name NH   )(resid    8 and  name HA   ) 4.0 2.2 1.0 !W
!assign (resid    12 and  name NH   )(resid   10 and  name HA   ) 4.0 2.2 1.0 !W
assign (resid    22 and  name NH   )(resid   20 and  name HA   ) 3.0 1.2 1.0 !M

! i-i+3
assign (resid    5 and  name HN   )(resid    2 and  name HA   ) 3.0 1.2 1.0 !M
assign (resid    6 and  name HN   )(resid    3 and  name HA   ) 4.0 2.2 1.0 !W
assign (resid    7 and  name HN   )(resid    4 and  name HA   ) 4.0 2.2 0.5 !W
assign (resid    8 and  name HN   )(resid    5 and  name HA   ) 4.0 2.2 0.5 !W
assign (resid    9 and  name HN   )(resid    6 and  name HA   ) 4.0 2.2 0.5 !W
assign (resid   10 and  name HN   )(resid    7 and  name HA   ) 4.0 2.2 0.5 !W
assign (resid   11 and  name HN   )(resid    8 and  name HA   ) 4.0 2.2 0.5 !W-
assign (resid   12 and  name HN   )(resid    9 and  name HA   ) 3.0 1.2 1.0 !M+
assign (resid   13 and  name HN   )(resid   10 and  name HA   ) 3.0 1.2 1.0 !M+
assign (resid   14 and  name HN   )(resid   11 and  name HA   ) 4.0 2.2 1.0 !W
assign (resid   15 and  name HN   )(resid   12 and  name HA   ) 4.0 2.2 1.0 !W
assign (resid   16 and  name HN   )(resid   13 and  name HA   ) 4.0 2.2 1.0 !W
assign (resid   17 and  name HN   )(resid   14 and  name HA   ) 4.0 2.2 1.0 !W
assign (resid   19 and  name HN   )(resid   16 and  name HA   ) 4.0 2.2 1.0 !W
assign (resid   20 and  name HN   )(resid   17 and  name HA   ) 3.0 1.2 0.5 !M
assign (resid   21 and  name HN   )(resid   18 and  name HA   ) 3.0 1.2 0.5 !M
assign (resid   22 and  name HN   )(resid   19 and  name HA   ) 3.0 1.2 0.5 !M

! i-i+4
assign (resid    6 and  name HN   )(resid    2 and  name HA   ) 4.0 2.2 1.0 !W
assign (resid    8 and  name HN   )(resid    4 and  name HA   ) 3.0 1.2 1.0 !M
assign (resid    9 and  name HN   )(resid    5 and  name HA   ) 4.0 2.2 0.5 !W-
assign (resid   10 and  name HN   )(resid    6 and  name HA   ) 3.0 1.2 1.0 !M
assign (resid   11 and  name HN   )(resid    7 and  name HA   ) 4.0 2.2 1.0 !W
assign (resid   12 and  name HN   )(resid    8 and  name HA   ) 4.0 2.2 0.5 !W-
assign (resid   14 and  name HN   )(resid   10 and  name HA   ) 3.0 1.2 1.0 !M+
assign (resid   15 and  name HN   )(resid   11 and  name HA   ) 3.0 1.2 0.5 !M
assign (resid   16 and  name HN   )(resid   12 and  name HA   ) 3.0 1.2 1.0 !M+
assign (resid   17 and  name HN   )(resid   13 and  name HA   ) 3.0 1.2 1.0 !M+
assign (resid   18 and  name HN   )(resid   14 and  name HA   ) 4.0 2.2 0.5 !W-
assign (resid   19 and  name HN   )(resid   15 and  name HA   ) 4.0 2.2 0.5 !W-
assign (resid   20 and  name HN   )(resid   16 and  name HA   ) 3.0 1.2 0.5 !M
assign (resid   22 and  name HN   )(resid   18 and  name HA   ) 4.0 2.2 0.5 !W-

! NH-Cb/Cg/CdH(sequential)
assign (resid    3 and  name HN   )(resid    2 and  name HB1  ) 3.0 1.2 1.0 !M+
assign (resid    3 and  name HN   )(resid    2 and  name HB2  ) 3.0 1.2 1.0 !M+
assign (resid    4 and  name HN   )(resid    3 and  name HB1  ) 4.0 2.2 1.0 !W
assign (resid    4 and  name HN   )(resid    3 and  name HB2  ) 4.0 2.2 1.0 !W
assign (resid    5 and  name HN   )(resid    4 and  name HB1  ) 4.0 2.2 1.0 !W
assign (resid    5 and  name HN   )(resid    4 and  name HB2  ) 4.0 2.2 1.0 !W
assign (resid    6 and  name HN   )(resid    5 and  name HB   ) 4.0 2.2 1.0 !W
assign (resid    6 and  name HN   )(resid    5 and  name HG1# ) 3.0 1.2 1.5 !M
assign (resid    6 and  name HN   )(resid    5 and  name HG2# ) 3.0 1.2 1.0 !M+
assign (resid    6 and  name HN   )(resid    5 and  name HD1# ) 3.0 1.2 1.0 !M+
assign (resid    7 and  name HN   )(resid    6 and  name HB1  ) 4.0 2.2 1.0 !W
assign (resid    7 and  name HN   )(resid    6 and  name HB2  ) 4.0 2.2 1.0 !W
assign (resid    8 and  name HN   )(resid    7 and  name HB#  ) 3.0 1.2 1.5 !Mm
assign (resid    8 and  name HN   )(resid    7 and  name HG#  ) 3.0 1.2 1.0 !M+
assign (resid    9 and  name HN   )(resid    8 and  name HB#  ) 4.0 2.2 1.0 !W
assign (resid   10 and  name HN   )(resid    9 and  name HB   ) 4.0 2.2 1.0 !W
assign (resid   10 and  name HN   )(resid    9 and  name HG1# ) 4.0 2.2 1.0 !W
assign (resid   10 and  name HN   )(resid    9 and  name HG2# ) 4.0 2.2 1.0 !W
assign (resid   10 and  name HN   )(resid    9 and  name HD1# ) 4.0 2.2 1.0 !M-W
assign (resid   11 and  name HN   )(resid   10 and  name HB   ) 4.0 2.2 1.0 !W
assign (resid   11 and  name HN   )(resid   10 and  name HG1# ) 3.0 1.2 0.5 !M
assign (resid   12 and  name HN   )(resid   11 and  name HB#  ) 3.0 1.2 0.5 !M
assign (resid   13 and  name HN   )(resid   12 and  name HB   ) 4.0 2.2 1.0 !W
assign (resid   13 and  name HN   )(resid   12 and  name HG1# ) 3.0 1.2 0.5 !M
assign (resid   13 and  name HN   )(resid   12 and  name HG2# ) 3.0 1.2 1.0 !M+
assign (resid   14 and  name HN   )(resid   13 and  name HB#  ) 3.0 1.2 0.5 !M
assign (resid   15 and  name HN   )(resid   14 and  name HB#  ) 3.0 1.2 0.5 !M
assign (resid   15 and  name HN   )(resid   14 and  name HG#  ) 3.0 1.2 0.5 !M
assign (resid   16 and  name HN   )(resid   15 and  name HB   ) 4.0 2.2 1.0 !W
assign (resid   16 and  name HN   )(resid   15 and  name HG2# ) 4.0 2.2 1.0 !W
assign (resid   17 and  name HN   )(resid   16 and  name HB   ) 4.0 2.2 1.0 !W
assign (resid   17 and  name HN   )(resid   16 and  name HG11 ) 4.0 2.2 1.0 !W
assign (resid   17 and  name HN   )(resid   16 and  name HG12 ) 4.0 2.2 1.0 !W
assign (resid   17 and  name HN   )(resid   16 and  name HG2# ) 4.0 2.2 1.0 !W
assign (resid   17 and  name HN   )(resid   16 and  name HD1# ) 4.0 2.2 1.0 !W
assign (resid   18 and  name HN   )(resid   17 and  name HB1  ) 4.0 2.2 1.0 !W
assign (resid   18 and  name HN   )(resid   17 and  name HB2  ) 4.0 2.2 1.0 !W
assign (resid   19 and  name HN   )(resid   18 and  name HB#  ) 4.0 2.2 1.0 !W
assign (resid   19 and  name HN   )(resid   18 and  name HG#  ) 4.0 2.2 1.0 !W
assign (resid   19 and  name HN   )(resid   18 and  name HD#  ) 4.0 2.2 1.0 !W
assign (resid   20 and  name HN   )(resid   19 and  name HB#  ) 4.0 2.2 1.0 !W
assign (resid   20 and  name HN   )(resid   19 and  name HG   ) 4.0 2.2 1.0 !W
assign (resid   21 and  name HN   )(resid   20 and  name HB   ) 3.0 1.2 1.5 !Mm
assign (resid   21 and  name HN   )(resid   20 and  name HG1# ) 3.0 1.2 1.0 !M+
assign (resid   21 and  name HN   )(resid   20 and  name HG2# ) 4.0 2.2 1.0 !W
assign (resid   22 and  name HN   )(resid   21 and  name HB   ) 4.0 2.2 1.0 !W
assign (resid   22 and  name HN   )(resid   21 and  name HG2# ) 4.0 2.2 1.0 !W

! NH-Cb/Cg/CdH(i-i+3)
!assign (resid    6 and  name HN   )(resid    3 and  name HB1  ) 4.0 2.2 1.0 !W
!assign (resid    6 and  name HN   )(resid    3 and  name HB1  ) 4.0 2.2 1.0 !W
assign (resid    7 and  name HN   )(resid    4 and  name HB1  ) 4.0 2.2 1.0 !W
!assign (resid    7 and  name HN   )(resid    4 and  name HB2  ) 4.0 2.2 1.0 !W
!assign (resid    8 and  name HN   )(resid    5 and  name HB   ) 4.0 2.2 1.0 !W
!assign (resid    8 and  name HN   )(resid    5 and  name HG11 ) 4.0 2.2 1.5 !W+
!assign (resid    8 and  name HN   )(resid    5 and  name HG12 ) 4.0 2.2 1.5 !W+
!assign (resid    8 and  name HN   )(resid    5 and  name HG2# ) 4.0 2.2 2.0 !Wm
!assign (resid    8 and  name HN   )(resid    5 and  name HD1# ) 4.0 2.2 1.0 !W
!assign (resid    9 and  name HN   )(resid    6 and  name HB1  ) 4.0 2.2 1.0 !W
!assign (resid    9 and  name HN   )(resid    6 and  name HB2  ) 4.0 2.2 1.5 !W+
!assign (resid   10 and  name HN   )(resid    7 and  name HB#  ) 4.0 2.2 1.5 !W+
!assign (resid   10 and  name HN   )(resid    7 and  name HG#  ) 4.0 2.2 2.0 !Wm
!assign (resid   10 and  name HN   )(resid    7 and  name HD#  ) 4.0 2.2 1.0 !W
!assign (resid   11 and  name HN   )(resid    8 and  name HB#  ) 4.0 2.2 1.0 !W
!assign (resid   14 and  name HN   )(resid   11 and  name HB#  ) 4.0 2.2 1.0 !W
!assign (resid   16 and  name HN   )(resid   13 and  name HB#  ) 4.0 2.2 1.5 !W+
!assign (resid   17 and  name HN   )(resid   14 and  name HB#  ) 4.0 2.2 1.0 !W
!assign (resid   17 and  name HN   )(resid   14 and  name HG#  ) 4.0 2.2 1.5 !W+
!assign (resid   17 and  name HN   )(resid   14 and  name HD1  ) 4.0 2.2 1.0 !W
!assign (resid   17 and  name HN   )(resid   14 and  name HD2  ) 4.0 2.2 1.0 !W
assign (resid   18 and  name HN   )(resid   15 and  name HB   ) 4.0 2.2 0.5 !W-
assign (resid   18 and  name HN   )(resid   15 and  name HG2# ) 4.0 2.2 1.0 !W
!assign (resid   19 and  name HN   )(resid   16 and  name HB   ) 4.0 2.2 1.0 !W
!assign (resid   19 and  name HN   )(resid   16 and  name HG1# ) 4.0 2.2 1.0 !W
!assign (resid   19 and  name HN   )(resid   16 and  name HG2# ) 4.0 2.2 1.0 !W
!assign (resid   20 and  name HN   )(resid   17 and  name HB1  ) 4.0 2.2 1.0 !W
!assign (resid   20 and  name HN   )(resid   17 and  name HB2  ) 4.0 2.2 1.0 !W

! Other inter-residual NOEs
!assign (resid    9 and  name HA   )(resid   12 and  name HB   ) 4.0 2.2 1.0 !W
!assign (resid    9 and  name HA   )(resid    5 and  name HB   ) 4.0 2.2 2.0 !Wm
!assign (resid    9 and  name HA   )(resid    5 and  name HG12 ) 4.0 2.2 2.0 !Wm
!assign (resid   10 and  name HA   )(resid   13 and  name HB#  ) 4.0 2.2 1.0 !W
!assign (resid    8 and  name HA   )(resid    5 and  name HB   ) 4.0 2.2 1.5 !W+
!assign (resid    8 and  name HA   )(resid    9 and  name HB   ) 4.0 2.2 1.5 !W+
!assign (resid   17 and  name HA   )(resid   20 and  name HB#  ) 4.0 2.2 1.0 !W
!assign (resid   21 and  name HA   )(resid   20 and  name HB   ) 4.0 2.2 1.0 !W

! Intra-residual NOEs
assign (resid    2 and  name HN   )(resid    2 and  name HB1  ) 3.0 1.2 1.0 !M+
assign (resid    2 and  name HD#  )(resid    2 and  name HA   ) 2.5 0.7 0.7 !S+
assign (resid    2 and  name HD#  )(resid    2 and  name HB1  ) 2.5 0.7 0.7 !S+
assign (resid    2 and  name HD#  )(resid    2 and  name HB2  ) 2.5 0.7 0.7 !S+
assign (resid    2 and  name HZ   )(resid    2 and  name HB1  ) 4.0 2.2 2.0 !Wm
assign (resid    2 and  name HZ   )(resid    2 and  name HB2  ) 4.0 2.2 2.0 !Wm
assign (resid    3 and  name HN   )(resid    3 and  name HB1  ) 3.0 1.2 0.5 !M
assign (resid    3 and  name HN   )(resid    3 and  name HB2  ) 3.0 1.2 0.5 !M
assign (resid    3 and  name HD2  )(resid    3 and  name HA   ) 4.0 2.2 1.0 !W
assign (resid    3 and  name HD2  )(resid    3 and  name HB1  ) 4.0 2.2 1.0 !W
assign (resid    4 and  name HN   )(resid    4 and  name HB1  ) 3.0 1.2 0.5 !M
assign (resid    4 and  name HN   )(resid    4 and  name HB2  ) 3.0 1.2 0.5 !M
assign (resid    4 and  name HN   )(resid    4 and  name HD2  ) 3.0 1.2 0.5 !M
assign (resid    4 and  name HD2  )(resid    4 and  name HA   ) 3.0 1.2 1.0 !M+
assign (resid    4 and  name HD2  )(resid    4 and  name HB1  ) 4.0 2.2 1.0 !W
assign (resid    4 and  name HD2  )(resid    4 and  name HB2  ) 4.0 2.2 1.0 !W
assign (resid    5 and  name HN   )(resid    5 and  name HB   ) 2.5 0.7 1.2 !Sm
assign (resid    5 and  name HN   )(resid    5 and  name HG11 ) 4.0 2.2 1.0 !W
assign (resid    5 and  name HN   )(resid    5 and  name HG12 ) 3.0 1.2 1.0 !M+
assign (resid    5 and  name HN   )(resid    5 and  name HG2# ) 4.0 2.2 1.0 !W
assign (resid    5 and  name HN   )(resid    5 and  name HD1# ) 4.0 2.2 1.0 !W
assign (resid    6 and  name HN   )(resid    6 and  name HB1  ) 3.0 1.2 0.5 !M
assign (resid    6 and  name HN   )(resid    6 and  name HB2  ) 3.0 1.2 0.5 !M
!assign (resid    6 and  name HN   )(resid    6 and  name HE#  ) 4.0 2.2 1.0 !W
assign (resid    6 and  name HN   )(resid    6 and  name HD#  ) 4.0 2.2 1.0 !W
assign (resid    6 and  name HD#  )(resid    6 and  name HA   ) 3.0 1.2 0.5 !M
assign (resid    6 and  name HD#  )(resid    6 and  name HB1  ) 4.0 2.2 1.0 !W
assign (resid    6 and  name HD#  )(resid    6 and  name HB2  ) 2.5 0.7 0.2 !S
!assign (resid    6 and  name HE#  )(resid    6 and  name HA   ) 4.0 2.2 1.0 !W
assign (resid    6 and  name HE#  )(resid    6 and  name HB1  ) 4.0 2.2 1.0 !W
assign (resid    7 and  name HN   )(resid    7 and  name HB1  ) 2.5 0.7 1.2 !Sm
assign (resid    7 and  name HN   )(resid    7 and  name HB2  ) 3.0 1.2 0.5 !M
assign (resid    7 and  name HN   )(resid    7 and  name HG#  ) 3.0 1.2 1.5 !Mm
assign (resid    7 and  name HH#  )(resid    7 and  name HB1  ) 2.5 0.7 0.2 !S
assign (resid    7 and  name HH#  )(resid    7 and  name HB2  ) 3.0 1.2 0.5 !M
assign (resid    7 and  name HH#  )(resid    7 and  name HG#  ) 4.0 2.2 1.0 !W
assign (resid    7 and  name HH#  )(resid    7 and  name HD#  ) 4.0 2.2 1.0 !W
assign (resid    9 and  name HN   )(resid    9 and  name HB   ) 3.0 1.2 0.5 !M 
assign (resid    9 and  name HN   )(resid    9 and  name HG1# ) 4.0 2.2 1.0 !W
assign (resid    9 and  name HN   )(resid    9 and  name HG2# ) 4.0 2.2 1.0 !W
assign (resid    9 and  name HN   )(resid    9 and  name HD1# ) 4.0 2.2 1.0 !W
assign (resid   10 and  name HN   )(resid   10 and  name HB   ) 3.0 1.2 0.5 !M 
assign (resid   10 and  name HN   )(resid   10 and  name HG#  ) 4.0 2.2 1.0 !W 
assign (resid   11 and  name HN   )(resid   11 and  name HB#  ) 3.0 1.2 0.5 !M
assign (resid   11 and  name HN   )(resid   11 and  name HD2  ) 3.0 1.2 0.5 !M
assign (resid   11 and  name HD2  )(resid   11 and  name HA   ) 3.0 1.2 1.0 !M+
assign (resid   11 and  name HD2  )(resid   11 and  name HB#  ) 3.0 1.2 0.5 !M
assign (resid   12 and  name HN   )(resid   12 and  name HB   ) 3.0 1.2 0.5 !M
assign (resid   12 and  name HN   )(resid   12 and  name HG1# ) 4.0 2.2 1.0 !W
assign (resid   12 and  name HN   )(resid   12 and  name HG2# ) 4.0 2.2 1.0 !W
assign (resid   13 and  name NH   )(resid   13 and  name HA   ) 3.0 1.2 0.5 !M
assign (resid   14 and  name HN   )(resid   14 and  name HB1  ) 3.0 1.2 0.5 !M
assign (resid   14 and  name HN   )(resid   14 and  name HB2  ) 3.0 1.2 0.5 !M
assign (resid   14 and  name HN   )(resid   14 and  name HG#  ) 4.0 2.2 1.0 !W
assign (resid   14 and  name HN   )(resid   14 and  name HD#  ) 4.0 2.2 1.0 !W
assign (resid   15 and  name HN   )(resid   15 and  name HB   ) 2.5 0.7 0.2 !S
assign (resid   15 and  name HN   )(resid   15 and  name HG2# ) 4.0 2.2 1.0 !W
assign (resid   16 and  name HN   )(resid   16 and  name HB   ) 3.0 1.2 0.5 !M
assign (resid   16 and  name HN   )(resid   16 and  name HG1# ) 4.0 2.2 1.0 !W
assign (resid   16 and  name HN   )(resid   16 and  name HG2# ) 4.0 2.2 1.0 !W
assign (resid   16 and  name HN   )(resid   16 and  name HD1# ) 4.0 2.2 1.0 !W
assign (resid   17 and  name HN   )(resid   17 and  name HB1  ) 3.0 1.2 0.5 !M
assign (resid   17 and  name HN   )(resid   17 and  name HB2  ) 2.5 0.7 0.2 !S
assign (resid   18 and  name HN   )(resid   18 and  name HB1  ) 2.5 0.7 0.2 !S
assign (resid   18 and  name HN   )(resid   18 and  name HB2  ) 3.0 1.2 0.5 !M
assign (resid   18 and  name HN   )(resid   18 and  name HG#  ) 4.0 2.2 1.0 !W
assign (resid   18 and  name HH#  )(resid   18 and  name HB1  ) 4.0 2.2 1.0 !W
assign (resid   19 and  name HN   )(resid   19 and  name HB#  ) 4.0 2.2 1.0 !W
assign (resid   19 and  name HN   )(resid   19 and  name HD#  ) 4.0 2.2 1.0 !W
assign (resid   20 and  name HN   )(resid   20 and  name HB   ) 3.0 1.2 0.5 !M
assign (resid   20 and  name HN   )(resid   20 and  name HG1# ) 4.0 2.2 1.0 !W
assign (resid   20 and  name HN   )(resid   20 and  name HG2# ) 4.0 2.2 1.0 !W
assign (resid   21 and  name HN   )(resid   21 and  name HB   ) 2.5 0.7 0.2 !S
assign (resid   21 and  name HN   )(resid   21 and  name HG2# ) 4.0 2.2 1.0 !W

assign (resid    2 and  name HA   )(resid    2 and  name HB1  ) 3.0 1.2 1.0 !M+
assign (resid    2 and  name HA   )(resid    2 and  name HB2  ) 3.0 1.2 1.0 !M+
assign (resid    3 and  name HA   )(resid    3 and  name HB1  ) 3.0 1.2 1.0 !M+
assign (resid    3 and  name HA   )(resid    3 and  name HB2  ) 3.0 1.2 1.0 !M+
assign (resid    4 and  name HA   )(resid    4 and  name HB1  ) 3.0 1.2 0.5 !M 
assign (resid    4 and  name HA   )(resid    4 and  name HB2  ) 3.0 1.2 0.5 !M
assign (resid    5 and  name HA   )(resid    5 and  name HG2# ) 4.0 2.2 1.0 !W
assign (resid    5 and  name HA   )(resid    5 and  name HD1# ) 4.0 2.2 1.0 !W
assign (resid    5 and  name HB   )(resid    5 and  name HG11 ) 2.5 0.7 0.7 !S+
assign (resid    5 and  name HB   )(resid    5 and  name HG12 ) 3.0 1.2 0.5 !M
assign (resid    5 and  name HB   )(resid    5 and  name HG2# ) 4.0 2.2 1.0 !W
assign (resid    5 and  name HB   )(resid    5 and  name HD1# ) 4.0 2.2 1.0 !W
assign (resid    5 and  name HG11 )(resid    5 and  name HD1# ) 4.0 2.2 1.0 !W
assign (resid    5 and  name HG12 )(resid    5 and  name HG2# ) 4.0 2.2 1.0 !W
assign (resid    5 and  name HG12 )(resid    5 and  name HD1# ) 4.0 2.2 1.0 !W
assign (resid    6 and  name HA   )(resid    6 and  name HB1  ) 3.0 1.2 0.5 !M
assign (resid    6 and  name HA   )(resid    6 and  name HB2  ) 3.0 1.2 0.5 !M
assign (resid    7 and  name HA   )(resid    7 and  name HB1  ) 2.5 0.7 0.2 !S
assign (resid    7 and  name HA   )(resid    7 and  name HG#  ) 4.0 2.2 1.0 !W
assign (resid    7 and  name HD#  )(resid    7 and  name HB1  ) 2.5 0.7 0.7 !S
assign (resid    7 and  name HD#  )(resid    7 and  name HB2  ) 3.0 1.2 0.5 !M
assign (resid    7 and  name HD#  )(resid    7 and  name HG#  ) 4.0 2.2 1.0 !W
!assign (resid    8 and  name HA1  )(resid    8 and  name HA2  ) 3.0 1.2 0.5 !M
assign (resid    9 and  name HA   )(resid    9 and  name HG1# ) 4.0 2.2 1.0 !W
assign (resid    9 and  name HA   )(resid    9 and  name HG2# ) 4.0 2.2 1.0 !W
assign (resid    9 and  name HA   )(resid    9 and  name HD1# ) 4.0 2.2 1.0 !W
assign (resid    9 and  name HB   )(resid    9 and  name HG1# ) 4.0 2.2 1.0 !W
assign (resid    9 and  name HB   )(resid    9 and  name HG2# ) 4.0 2.2 1.0 !W
assign (resid    9 and  name HB   )(resid    9 and  name HD1# ) 4.0 2.2 1.0 !W
assign (resid    9 and  name HG1# )(resid    9 and  name HG2# ) 4.0 2.2 1.0 !W
assign (resid    9 and  name HG1# )(resid    9 and  name HD1# ) 4.0 2.2 1.0 !W
assign (resid   10 and  name HA   )(resid   10 and  name HG#  ) 4.0 2.2 1.0 !W
assign (resid   10 and  name HB   )(resid   10 and  name HG#  ) 4.0 2.2 1.0 !W
assign (resid   11 and  name HA   )(resid   11 and  name HB#  ) 3.0 1.2 0.5 !M
assign (resid   12 and  name HA   )(resid   12 and  name HG1# ) 4.0 2.2 1.0 !W
assign (resid   12 and  name HA   )(resid   12 and  name HG2# ) 4.0 2.2 1.0 !W
assign (resid   12 and  name HB   )(resid   12 and  name HG1# ) 4.0 2.2 1.0 !W
assign (resid   12 and  name HB   )(resid   12 and  name HG2# ) 4.0 2.2 1.0 !W
assign (resid   14 and  name HE2  )(resid   14 and  name HB#  ) 3.0 1.2 0.5 !M
assign (resid   14 and  name HE2  )(resid   14 and  name HD#  ) 2.5 0.7 0.2 !S
assign (resid   14 and  name HE2  )(resid   14 and  name HG#  ) 3.0 1.2 0.5 !M
assign (resid   17 and  name HA   )(resid   17 and  name HB1  ) 4.0 2.2 1.0 !W
assign (resid   17 and  name HA   )(resid   17 and  name HB2  ) 3.0 1.2 0.5 !M
assign (resid   18 and  name HD#  )(resid   18 and  name HB1  ) 3.0 1.2 0.5 !M
assign (resid   18 and  name HD#  )(resid   18 and  name HB2  ) 3.0 1.2 0.5 !M
assign (resid   18 and  name HD#  )(resid   18 and  name HG#  ) 3.0 1.2 0.5 !M
assign (resid   20 and  name HA   )(resid   20 and  name HG1# ) 3.0 1.2 0.5 !M
assign (resid   20 and  name HA   )(resid   20 and  name HG2# ) 4.0 2.2 1.0 !W


set message=on echo=on end




  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   PHE   1           1H       PHE   1  -3.476  15.512  -2.218
    2    H2   PHE   1           2H       PHE   1  -3.103  14.917  -0.671
    3    H3   PHE   1           3H       PHE   1  -4.135  14.038  -1.696
    4    HA   PHE   1           HA       PHE   1  -2.441  13.180  -2.926
    5    HB2  PHE   1           1HB      PHE   1  -1.940  15.569  -3.593
    6    HB3  PHE   1           2HB      PHE   1  -0.860  15.666  -2.202
    7    HD1  PHE   1           HD2      PHE   1  -1.555  13.121  -4.880
    8    HD2  PHE   1           HD1      PHE   1   1.383  15.433  -2.764
    9    HE1  PHE   1           HE2      PHE   1   0.247  12.042  -6.200
   10    HE2  PHE   1           HE1      PHE   1   3.184  14.353  -4.083
   11    HZ   PHE   1           HZ       PHE   1   2.616  12.658  -5.802
   12    H    PHE   2           H        PHE   2  -0.709  15.059  -0.417
   13    HA   PHE   2           HA       PHE   2   1.077  13.123   0.457
   14    HB2  PHE   2           1HB      PHE   2  -0.050  15.596   1.360
   15    HB3  PHE   2           2HB      PHE   2   0.042  14.501   2.740
   16    HD1  PHE   2           HD1      PHE   2   2.279  13.212   3.070
   17    HD2  PHE   2           HD2      PHE   2   1.875  16.723   0.628
   18    HE1  PHE   2           HE1      PHE   2   4.725  13.589   3.209
   19    HE2  PHE   2           HE2      PHE   2   4.323  17.100   0.767
   20    HZ   PHE   2           HZ       PHE   2   5.748  15.534   2.058
   21    H    HIS   3           H        HIS   3  -2.380  13.255   1.039
   22    HA   HIS   3           HA       HIS   3  -2.471  11.400   3.249
   23    HB2  HIS   3           1HB      HIS   3  -4.195  13.059   1.815
   24    HB3  HIS   3           2HB      HIS   3  -4.785  11.434   1.467
   25    HD1  HIS   3           HD1      HIS   3  -6.836  11.502   2.998
   26    HD2  HIS   3           HD2      HIS   3  -3.287  12.387   4.999
   27    HE1  HIS   3           HE1      HIS   3  -7.390  11.513   5.469
   28    H    HIS   4           H        HIS   4  -3.061  10.992  -0.249
   29    HA   HIS   4           HA       HIS   4  -3.631   8.263  -0.363
   30    HB2  HIS   4           1HB      HIS   4  -1.965  10.034  -2.174
   31    HB3  HIS   4           2HB      HIS   4  -2.570   8.446  -2.645
   32    HD1  HIS   4           HD1      HIS   4  -3.565  10.875  -4.206
   33    HD2  HIS   4           HD2      HIS   4  -5.511   9.400  -0.827
   34    HE1  HIS   4           HE1      HIS   4  -5.964  11.675  -4.355
   35    H    ILE   5           H        ILE   5  -0.361   9.636  -0.811
   36    HA   ILE   5           HA       ILE   5   1.195   7.360  -0.852
   37    HB   ILE   5           HB       ILE   5   1.723   9.862   0.781
   38   HG12  ILE   5          1HG1      ILE   5   2.913   9.951  -1.804
   39   HG13  ILE   5          2HG1      ILE   5   1.219   9.513  -2.024
   40   HG21  ILE   5          1HG2      ILE   5   3.902   8.628  -0.753
   41   HG22  ILE   5          2HG2      ILE   5   3.266   7.583   0.516
   42   HG23  ILE   5          3HG2      ILE   5   3.882   9.185   0.920
   43   HD11  ILE   5          3HD1      ILE   5   0.740  11.437  -0.338
   44   HD12  ILE   5          1HD1      ILE   5   1.153  11.863  -2.000
   45   HD13  ILE   5          2HD1      ILE   5   2.373  11.975  -0.731
   46    H    PHE   6           H        PHE   6   0.220   9.050   2.136
   47    HA   PHE   6           HA       PHE   6   1.266   7.242   4.025
   48    HB2  PHE   6           1HB      PHE   6   0.136   9.524   4.313
   49    HB3  PHE   6           2HB      PHE   6  -1.400   8.662   4.233
   50    HD1  PHE   6           HD1      PHE   6  -1.835   6.780   5.892
   51    HD2  PHE   6           HD2      PHE   6   1.410   9.561   6.311
   52    HE1  PHE   6           HE1      PHE   6  -1.624   6.171   8.286
   53    HE2  PHE   6           HE2      PHE   6   1.623   8.952   8.706
   54    HZ   PHE   6           HZ       PHE   6   0.106   7.257   9.693
   55    H    ARG   7           H        ARG   7  -1.630   7.001   2.038
   56    HA   ARG   7           HA       ARG   7  -2.767   4.735   3.488
   57    HB2  ARG   7           1HB      ARG   7  -3.308   5.630   0.646
   58    HB3  ARG   7           2HB      ARG   7  -4.423   4.839   1.760
   59    HG2  ARG   7           1HG      ARG   7  -3.598   7.116   3.141
   60    HG3  ARG   7           2HG      ARG   7  -3.794   7.673   1.480
   61    HD2  ARG   7           1HD      ARG   7  -5.978   5.904   2.250
   62    HD3  ARG   7           2HD      ARG   7  -5.859   7.306   3.332
   63    HE   ARG   7           HE       ARG   7  -6.083   8.767   1.400
   64   HH11  ARG   7          1HH1      ARG   7  -5.560   5.563   0.374
   65   HH12  ARG   7          2HH1      ARG   7  -6.574   5.682  -1.025
   66   HH21  ARG   7          1HH2      ARG   7  -7.713   8.866  -0.253
   67   HH22  ARG   7          2HH2      ARG   7  -7.794   7.553  -1.380
   68    H    ALA   8           H        ALA   8  -1.277   5.068   0.238
   69    HA   ALA   8           HA       ALA   8  -1.133   2.312  -0.396
   70    HB1  ALA   8           3HB      ALA   8  -0.017   3.134  -2.218
   71    HB2  ALA   8           1HB      ALA   8   1.130   4.033  -1.225
   72    HB3  ALA   8           2HB      ALA   8  -0.469   4.703  -1.550
   73    H    ILE   9           H        ILE   9   1.265   4.383   1.265
   74    HA   ILE   9           HA       ILE   9   3.370   2.559   1.595
   75    HB   ILE   9           HB       ILE   9   2.211   4.708   3.388
   76   HG12  ILE   9          1HG1      ILE   9   4.580   4.615   1.492
   77   HG13  ILE   9          2HG1      ILE   9   3.060   5.465   1.213
   78   HG21  ILE   9          1HG2      ILE   9   4.421   2.807   3.845
   79   HG22  ILE   9          2HG2      ILE   9   3.524   3.789   5.003
   80   HG23  ILE   9          3HG2      ILE   9   4.853   4.500   4.086
   81   HD11  ILE   9          3HD1      ILE   9   5.331   6.185   2.990
   82   HD12  ILE   9          1HD1      ILE   9   3.714   6.519   3.609
   83   HD13  ILE   9          2HD1      ILE   9   4.238   7.228   2.082
   84    H    VAL  10           H        VAL  10   1.105   3.249   4.275
   85    HA   VAL  10           HA       VAL  10   1.614   1.010   5.853
   86    HB   VAL  10           HB       VAL  10   0.185   2.867   6.520
   87   HG11  VAL  10          1HG1      VAL  10  -1.976   3.270   5.515
   88   HG12  VAL  10          2HG1      VAL  10  -1.844   1.812   4.532
   89   HG13  VAL  10          3HG1      VAL  10  -0.788   3.189   4.214
   90   HG21  VAL  10          3HG2      VAL  10  -1.559   1.646   7.622
   91   HG22  VAL  10          1HG2      VAL  10  -0.204   0.527   7.465
   92   HG23  VAL  10          2HG2      VAL  10  -1.577   0.410   6.363
   93    H    HIS  11           H        HIS  11  -0.490   1.226   2.996
   94    HA   HIS  11           HA       HIS  11  -1.766  -1.306   3.179
   95    HB2  HIS  11           1HB      HIS  11  -1.145   0.754   1.154
   96    HB3  HIS  11           2HB      HIS  11  -1.420  -0.858   0.491
   97    HD1  HIS  11           HD1      HIS  11  -3.813  -1.304  -0.006
   98    HD2  HIS  11           HD2      HIS  11  -3.393   1.348   3.184
   99    HE1  HIS  11           HE1      HIS  11  -6.157  -0.680   0.719
  100    H    VAL  12           H        VAL  12   1.356  -0.389   1.705
  101    HA   VAL  12           HA       VAL  12   2.068  -2.880   0.562
  102    HB   VAL  12           HB       VAL  12   3.902  -0.928   1.985
  103   HG11  VAL  12          1HG1      VAL  12   5.411  -1.553   0.076
  104   HG12  VAL  12          2HG1      VAL  12   4.223  -2.767  -0.400
  105   HG13  VAL  12          3HG1      VAL  12   5.040  -2.894   1.159
  106   HG21  VAL  12          3HG2      VAL  12   3.854  -0.083  -0.591
  107   HG22  VAL  12          1HG2      VAL  12   2.846   0.608   0.680
  108   HG23  VAL  12          2HG2      VAL  12   2.183  -0.615  -0.403
  109    H    ALA  13           H        ALA  13   3.517  -1.673   3.584
  110    HA   ALA  13           HA       ALA  13   4.487  -4.085   4.595
  111    HB1  ALA  13           3HB      ALA  13   3.460  -2.593   6.776
  112    HB2  ALA  13           1HB      ALA  13   3.851  -1.422   5.517
  113    HB3  ALA  13           2HB      ALA  13   5.093  -2.524   6.112
  114    H    LYS  14           H        LYS  14   1.263  -2.662   5.270
  115    HA   LYS  14           HA       LYS  14   0.180  -4.643   6.918
  116    HB2  LYS  14           1HB      LYS  14  -0.812  -2.446   6.129
  117    HB3  LYS  14           2HB      LYS  14  -1.236  -3.258   4.621
  118    HG2  LYS  14           1HG      LYS  14  -3.118  -3.237   6.262
  119    HG3  LYS  14           2HG      LYS  14  -2.611  -4.869   5.825
  120    HD2  LYS  14           1HD      LYS  14  -2.966  -4.491   8.310
  121    HD3  LYS  14           2HD      LYS  14  -1.377  -5.121   7.873
  122    HE2  LYS  14           1HE      LYS  14  -0.468  -2.793   7.933
  123    HE3  LYS  14           2HE      LYS  14  -2.055  -2.221   8.486
  124    HZ1  LYS  14           3HZ      LYS  14  -0.150  -4.004   9.854
  125    HZ2  LYS  14           1HZ      LYS  14  -1.807  -4.130  10.192
  126    HZ3  LYS  14           2HZ      LYS  14  -0.993  -2.665  10.470
  127    H    THR  15           H        THR  15  -0.476  -4.535   3.395
  128    HA   THR  15           HA       THR  15  -1.479  -7.146   3.107
  129    HB   THR  15           HB       THR  15   0.336  -5.847   1.116
  130    HG1  THR  15           HG1      THR  15  -1.247  -4.362   0.669
  131   HG21  THR  15          3HG2      THR  15  -0.825  -7.063  -0.412
  132   HG22  THR  15          1HG2      THR  15  -2.369  -6.758   0.384
  133   HG23  THR  15          2HG2      THR  15  -1.301  -8.027   0.986
  134    H    ILE  16           H        ILE  16   1.907  -6.041   2.618
  135    HA   ILE  16           HA       ILE  16   3.158  -8.444   1.983
  136    HB   ILE  16           HB       ILE  16   3.856  -5.990   3.562
  137   HG12  ILE  16          1HG1      ILE  16   3.951  -5.961   1.119
  138   HG13  ILE  16          2HG1      ILE  16   5.588  -5.847   1.769
  139   HG21  ILE  16          1HG2      ILE  16   6.161  -6.827   3.928
  140   HG22  ILE  16          2HG2      ILE  16   5.669  -8.416   3.342
  141   HG23  ILE  16          3HG2      ILE  16   4.982  -7.774   4.834
  142   HD11  ILE  16          3HD1      ILE  16   4.498  -7.854   0.029
  143   HD12  ILE  16          1HD1      ILE  16   4.972  -8.608   1.551
  144   HD13  ILE  16          2HD1      ILE  16   6.154  -7.691   0.616
  145    H    HIS  17           H        HIS  17   2.864  -7.216   5.324
  146    HA   HIS  17           HA       HIS  17   3.527  -9.627   6.647
  147    HB2  HIS  17           1HB      HIS  17   2.395  -7.026   7.219
  148    HB3  HIS  17           2HB      HIS  17   1.541  -8.260   8.144
  149    HD1  HIS  17           HD1      HIS  17   5.210  -8.373   7.200
  150    HD2  HIS  17           HD2      HIS  17   2.842  -7.928  10.602
  151    HE1  HIS  17           HE1      HIS  17   6.782  -8.460   9.184
  152    H    ARG  18           H        ARG  18   0.640  -8.670   4.929
  153    HA   ARG  18           HA       ARG  18  -1.078 -10.720   6.146
  154    HB2  ARG  18           1HB      ARG  18  -1.676  -8.435   5.052
  155    HB3  ARG  18           2HB      ARG  18  -1.489  -9.284   3.518
  156    HG2  ARG  18           1HG      ARG  18  -3.047 -11.019   5.029
  157    HG3  ARG  18           2HG      ARG  18  -3.670  -9.426   5.459
  158    HD2  ARG  18           1HD      ARG  18  -4.898 -10.169   3.506
  159    HD3  ARG  18           2HD      ARG  18  -3.760  -8.924   2.952
  160    HE   ARG  18           HE       ARG  18  -2.259 -10.746   2.198
  161   HH11  ARG  18          1HH1      ARG  18  -4.687 -12.240   3.939
  162   HH12  ARG  18          2HH1      ARG  18  -5.045 -13.451   2.753
  163   HH21  ARG  18          1HH2      ARG  18  -3.045 -12.024   0.306
  164   HH22  ARG  18          2HH2      ARG  18  -4.115 -13.329   0.696
  165    H    LEU  19           H        LEU  19   0.499 -10.245   2.969
  166    HA   LEU  19           HA       LEU  19  -0.165 -12.888   1.984
  167    HB2  LEU  19           1HB      LEU  19   1.658 -10.613   1.235
  168    HB3  LEU  19           2HB      LEU  19   1.804 -12.154   0.389
  169    HG   LEU  19           HG       LEU  19  -0.931 -10.994   0.728
  170   HD11  LEU  19          1HD1      LEU  19   0.935 -10.115  -1.489
  171   HD12  LEU  19          2HD1      LEU  19   0.632  -9.139  -0.052
  172   HD13  LEU  19          3HD1      LEU  19  -0.692  -9.523  -1.152
  173   HD21  LEU  19          3HD2      LEU  19   0.217 -13.176  -0.592
  174   HD22  LEU  19          1HD2      LEU  19  -0.112 -12.015  -1.879
  175   HD23  LEU  19          2HD2      LEU  19  -1.419 -12.561  -0.827
  176    H    VAL  20           H        VAL  20   2.527 -11.462   3.767
  177    HA   VAL  20           HA       VAL  20   4.286 -13.772   3.509
  178    HB   VAL  20           HB       VAL  20   4.154 -11.266   5.190
  179   HG11  VAL  20          1HG1      VAL  20   6.669 -12.180   5.643
  180   HG12  VAL  20          2HG1      VAL  20   5.789 -13.707   5.601
  181   HG13  VAL  20          3HG1      VAL  20   5.326 -12.454   6.753
  182   HG21  VAL  20          3HG2      VAL  20   6.469 -12.005   3.472
  183   HG22  VAL  20          1HG2      VAL  20   5.695 -10.437   3.702
  184   HG23  VAL  20          2HG2      VAL  20   4.961 -11.637   2.637
  185    H    THR  21           H        THR  21   1.851 -12.669   5.821
  186    HA   THR  21           HA       THR  21   2.499 -14.716   7.816
  187    HB   THR  21           HB       THR  21   0.248 -12.731   7.395
  188    HG1  THR  21           HG1      THR  21   2.367 -12.896   9.273
  189   HG21  THR  21          3HG2      THR  21   0.008 -13.396   9.988
  190   HG22  THR  21          1HG2      THR  21   0.564 -14.946   9.356
  191   HG23  THR  21          2HG2      THR  21  -0.905 -14.209   8.718
  192    H    GLY  22           H        GLY  22   0.274 -14.363   5.111
  193    HA2  GLY  22           1HA      GLY  22  -0.304 -16.708   4.179
  194    HA3  GLY  22           2HA      GLY  22  -0.944 -17.002   5.796
  Start of MODEL    2
    1    H1   PHE   1           1H       PHE   1  -1.279  15.765  -2.175
    2    H2   PHE   1           2H       PHE   1  -1.057  15.569  -0.502
    3    H3   PHE   1           3H       PHE   1  -2.192  14.613  -1.329
    4    HA   PHE   1           HA       PHE   1  -0.510  13.402  -2.461
    5    HB2  PHE   1           1HB      PHE   1   0.890  15.889  -1.789
    6    HB3  PHE   1           2HB      PHE   1   1.893  14.458  -1.549
    7    HD1  PHE   1           HD2      PHE   1  -0.873  14.602  -3.992
    8    HD2  PHE   1           HD1      PHE   1   3.378  14.863  -3.429
    9    HE1  PHE   1           HE2      PHE   1  -0.536  14.423  -6.443
   10    HE2  PHE   1           HE1      PHE   1   3.714  14.684  -5.879
   11    HZ   PHE   1           HZ       PHE   1   1.757  14.465  -7.387
   12    H    PHE   2           H        PHE   2   0.186  14.886   0.725
   13    HA   PHE   2           HA       PHE   2   1.389  12.565   1.899
   14    HB2  PHE   2           1HB      PHE   2   0.182  15.153   2.766
   15    HB3  PHE   2           2HB      PHE   2   0.404  13.919   4.007
   16    HD1  PHE   2           HD1      PHE   2   2.668  12.997   4.473
   17    HD2  PHE   2           HD2      PHE   2   2.061  16.266   1.753
   18    HE1  PHE   2           HE1      PHE   2   5.086  13.536   4.582
   19    HE2  PHE   2           HE2      PHE   2   4.479  16.806   1.861
   20    HZ   PHE   2           HZ       PHE   2   5.992  15.441   3.276
   21    H    HIS   3           H        HIS   3  -1.911  13.342   1.186
   22    HA   HIS   3           HA       HIS   3  -3.165  11.704   3.222
   23    HB2  HIS   3           1HB      HIS   3  -4.293  13.549   2.072
   24    HB3  HIS   3           2HB      HIS   3  -4.079  12.737   0.520
   25    HD1  HIS   3           HD1      HIS   3  -5.305  11.333   3.850
   26    HD2  HIS   3           HD2      HIS   3  -6.604  11.785  -0.084
   27    HE1  HIS   3           HE1      HIS   3  -7.542  10.156   3.695
   28    H    HIS   4           H        HIS   4  -2.322  11.181  -0.200
   29    HA   HIS   4           HA       HIS   4  -3.340   8.457  -0.261
   30    HB2  HIS   4           1HB      HIS   4  -1.794  10.326  -2.005
   31    HB3  HIS   4           2HB      HIS   4  -1.727   8.606  -2.389
   32    HD1  HIS   4           HD1      HIS   4  -3.157   9.135  -4.566
   33    HD2  HIS   4           HD2      HIS   4  -5.120   9.855  -0.960
   34    HE1  HIS   4           HE1      HIS   4  -5.617   9.366  -5.123
   35    H    ILE   5           H        ILE   5  -0.021   9.774  -0.413
   36    HA   ILE   5           HA       ILE   5   1.544   7.540  -0.303
   37    HB   ILE   5           HB       ILE   5   2.135  10.014  -0.208
   38   HG12  ILE   5          1HG1      ILE   5   3.756   8.143  -0.033
   39   HG13  ILE   5          2HG1      ILE   5   4.275   9.587   0.829
   40   HG21  ILE   5          1HG2      ILE   5   0.781  10.516   1.824
   41   HG22  ILE   5          2HG2      ILE   5   2.464  11.008   1.996
   42   HG23  ILE   5          3HG2      ILE   5   1.893   9.533   2.777
   43   HD11  ILE   5          3HD1      ILE   5   2.901   8.319   2.798
   44   HD12  ILE   5          1HD1      ILE   5   4.633   8.110   2.537
   45   HD13  ILE   5          2HD1      ILE   5   3.495   6.931   1.887
   46    H    PHE   6           H        PHE   6  -0.085   8.999   2.487
   47    HA   PHE   6           HA       PHE   6   0.867   7.148   4.456
   48    HB2  PHE   6           1HB      PHE   6  -0.544   9.494   4.384
   49    HB3  PHE   6           2HB      PHE   6  -1.809   8.344   4.817
   50    HD1  PHE   6           HD1      PHE   6  -1.325   6.703   6.746
   51    HD2  PHE   6           HD2      PHE   6   0.990  10.243   6.008
   52    HE1  PHE   6           HE1      PHE   6  -0.472   6.628   9.072
   53    HE2  PHE   6           HE2      PHE   6   1.845  10.170   8.335
   54    HZ   PHE   6           HZ       PHE   6   1.115   8.362   9.867
   55    H    ARG   7           H        ARG   7  -2.043   7.158   2.404
   56    HA   ARG   7           HA       ARG   7  -3.055   4.692   3.643
   57    HB2  ARG   7           1HB      ARG   7  -4.986   5.183   2.424
   58    HB3  ARG   7           2HB      ARG   7  -4.289   6.787   2.621
   59    HG2  ARG   7           1HG      ARG   7  -3.326   6.701   0.392
   60    HG3  ARG   7           2HG      ARG   7  -3.837   5.026   0.194
   61    HD2  ARG   7           1HD      ARG   7  -5.589   7.494   0.354
   62    HD3  ARG   7           2HD      ARG   7  -5.505   6.290  -0.948
   63    HE   ARG   7           HE       ARG   7  -6.329   4.633   0.860
   64   HH11  ARG   7          1HH1      ARG   7  -6.391   7.272   2.646
   65   HH12  ARG   7          2HH1      ARG   7  -8.109   7.457   2.778
   66   HH21  ARG   7          1HH2      ARG   7  -8.814   5.180   0.260
   67   HH22  ARG   7          2HH2      ARG   7  -9.479   6.273   1.427
   68    H    ALA   8           H        ALA   8  -1.333   5.635   0.703
   69    HA   ALA   8           HA       ALA   8  -1.610   3.014  -0.569
   70    HB1  ALA   8           3HB      ALA   8   0.464   4.360  -1.797
   71    HB2  ALA   8           1HB      ALA   8  -0.475   5.678  -1.095
   72    HB3  ALA   8           2HB      ALA   8  -1.240   4.546  -2.211
   73    H    ILE   9           H        ILE   9   0.751   4.633   1.496
   74    HA   ILE   9           HA       ILE   9   2.860   2.660   1.068
   75    HB   ILE   9           HB       ILE   9   3.046   5.120   1.745
   76   HG12  ILE   9          1HG1      ILE   9   4.917   3.466   1.896
   77   HG13  ILE   9          2HG1      ILE   9   5.008   4.716   3.137
   78   HG21  ILE   9          1HG2      ILE   9   1.268   4.941   3.517
   79   HG22  ILE   9          2HG2      ILE   9   2.770   5.665   4.089
   80   HG23  ILE   9          3HG2      ILE   9   2.395   3.986   4.480
   81   HD11  ILE   9          3HD1      ILE   9   3.487   2.856   4.418
   82   HD12  ILE   9          1HD1      ILE   9   5.243   2.941   4.550
   83   HD13  ILE   9          2HD1      ILE   9   4.497   1.814   3.416
   84    H    VAL  10           H        VAL  10   0.424   3.276   3.605
   85    HA   VAL  10           HA       VAL  10   1.307   1.199   5.391
   86    HB   VAL  10           HB       VAL  10  -0.166   3.176   5.899
   87   HG11  VAL  10          1HG1      VAL  10  -2.539   3.036   5.316
   88   HG12  VAL  10          2HG1      VAL  10  -2.269   1.496   4.500
   89   HG13  VAL  10          3HG1      VAL  10  -1.564   2.974   3.847
   90   HG21  VAL  10          3HG2      VAL  10  -1.789   1.844   7.325
   91   HG22  VAL  10          1HG2      VAL  10  -0.095   1.388   7.516
   92   HG23  VAL  10          2HG2      VAL  10  -1.173   0.390   6.540
   93    H    HIS  11           H        HIS  11  -0.464   1.130   2.414
   94    HA   HIS  11           HA       HIS  11  -1.851  -1.397   2.926
   95    HB2  HIS  11           1HB      HIS  11  -1.628   0.676   0.867
   96    HB3  HIS  11           2HB      HIS  11  -1.743  -0.945   0.182
   97    HD1  HIS  11           HD1      HIS  11  -4.041  -1.923   0.065
   98    HD2  HIS  11           HD2      HIS  11  -3.828   1.177   2.844
   99    HE1  HIS  11           HE1      HIS  11  -6.400  -1.554   0.910
  100    H    VAL  12           H        VAL  12   0.685  -0.518   0.541
  101    HA   VAL  12           HA       VAL  12   1.461  -3.032  -0.323
  102    HB   VAL  12           HB       VAL  12   2.403  -0.974  -1.181
  103   HG11  VAL  12          1HG1      VAL  12   3.751   0.514   0.122
  104   HG12  VAL  12          2HG1      VAL  12   3.872  -0.647   1.444
  105   HG13  VAL  12          3HG1      VAL  12   2.336   0.151   1.111
  106   HG21  VAL  12          3HG2      VAL  12   4.814  -1.519  -1.152
  107   HG22  VAL  12          1HG2      VAL  12   3.841  -2.978  -1.346
  108   HG23  VAL  12          2HG2      VAL  12   4.554  -2.595   0.222
  109    H    ALA  13           H        ALA  13   2.624  -1.397   2.646
  110    HA   ALA  13           HA       ALA  13   4.330  -3.582   3.474
  111    HB1  ALA  13           3HB      ALA  13   4.800  -2.152   5.233
  112    HB2  ALA  13           1HB      ALA  13   3.116  -1.661   5.417
  113    HB3  ALA  13           2HB      ALA  13   4.094  -0.991   4.110
  114    H    LYS  14           H        LYS  14   1.270  -2.403   4.936
  115    HA   LYS  14           HA       LYS  14   0.741  -4.463   6.717
  116    HB2  LYS  14           1HB      LYS  14  -0.635  -2.468   6.459
  117    HB3  LYS  14           2HB      LYS  14  -1.128  -2.977   4.844
  118    HG2  LYS  14           1HG      LYS  14  -2.905  -3.527   6.412
  119    HG3  LYS  14           2HG      LYS  14  -2.156  -5.022   5.852
  120    HD2  LYS  14           1HD      LYS  14  -2.420  -5.178   8.253
  121    HD3  LYS  14           2HD      LYS  14  -0.702  -4.976   7.908
  122    HE2  LYS  14           1HE      LYS  14  -0.935  -2.522   8.337
  123    HE3  LYS  14           2HE      LYS  14  -2.626  -2.800   8.801
  124    HZ1  LYS  14           3HZ      LYS  14  -1.684  -3.144  10.818
  125    HZ2  LYS  14           1HZ      LYS  14  -0.175  -3.577  10.177
  126    HZ3  LYS  14           2HZ      LYS  14  -1.444  -4.707  10.198
  127    H    THR  15           H        THR  15  -0.300  -4.417   3.281
  128    HA   THR  15           HA       THR  15  -1.466  -6.984   3.156
  129    HB   THR  15           HB       THR  15   0.242  -5.811   0.994
  130    HG1  THR  15           HG1      THR  15  -0.826  -4.029   1.186
  131   HG21  THR  15          3HG2      THR  15  -2.543  -6.637   0.500
  132   HG22  THR  15          1HG2      THR  15  -1.476  -7.932   1.047
  133   HG23  THR  15          2HG2      THR  15  -1.079  -7.016  -0.408
  134    H    ILE  16           H        ILE  16   1.870  -6.148   2.084
  135    HA   ILE  16           HA       ILE  16   2.858  -8.719   1.637
  136    HB   ILE  16           HB       ILE  16   4.145  -6.292   2.939
  137   HG12  ILE  16          1HG1      ILE  16   4.537  -7.267   0.115
  138   HG13  ILE  16          2HG1      ILE  16   3.129  -6.287   0.527
  139   HG21  ILE  16          1HG2      ILE  16   5.767  -7.837   3.443
  140   HG22  ILE  16          2HG2      ILE  16   6.203  -7.572   1.755
  141   HG23  ILE  16          3HG2      ILE  16   5.224  -8.967   2.205
  142   HD11  ILE  16          3HD1      ILE  16   5.165  -4.899   1.749
  143   HD12  ILE  16          1HD1      ILE  16   4.497  -4.514   0.163
  144   HD13  ILE  16          2HD1      ILE  16   5.955  -5.500   0.291
  145    H    HIS  17           H        HIS  17   2.631  -6.976   4.735
  146    HA   HIS  17           HA       HIS  17   3.687  -9.156   6.325
  147    HB2  HIS  17           1HB      HIS  17   2.095  -6.632   6.837
  148    HB3  HIS  17           2HB      HIS  17   2.521  -7.729   8.151
  149    HD1  HIS  17           HD1      HIS  17   3.918  -5.403   8.826
  150    HD2  HIS  17           HD2      HIS  17   5.398  -7.711   5.686
  151    HE1  HIS  17           HE1      HIS  17   6.338  -4.723   8.516
  152    H    ARG  18           H        ARG  18   0.555  -8.315   4.991
  153    HA   ARG  18           HA       ARG  18  -0.947 -10.139   6.742
  154    HB2  ARG  18           1HB      ARG  18  -1.818  -8.031   5.643
  155    HB3  ARG  18           2HB      ARG  18  -1.698  -8.860   4.091
  156    HG2  ARG  18           1HG      ARG  18  -3.092 -10.460   6.104
  157    HG3  ARG  18           2HG      ARG  18  -3.895  -8.921   5.791
  158    HD2  ARG  18           1HD      ARG  18  -4.776  -9.893   3.936
  159    HD3  ARG  18           2HD      ARG  18  -3.139  -9.869   3.250
  160    HE   ARG  18           HE       ARG  18  -3.136 -12.078   4.936
  161   HH11  ARG  18          1HH1      ARG  18  -3.535 -11.548   1.745
  162   HH12  ARG  18          2HH1      ARG  18  -4.616 -12.864   1.432
  163   HH21  ARG  18          1HH2      ARG  18  -5.192 -13.537   4.785
  164   HH22  ARG  18          2HH2      ARG  18  -5.554 -13.990   3.152
  165    H    LEU  19           H        LEU  19   0.183 -10.114   3.356
  166    HA   LEU  19           HA       LEU  19  -0.755 -12.793   2.767
  167    HB2  LEU  19           1HB      LEU  19   0.473 -10.557   1.470
  168    HB3  LEU  19           2HB      LEU  19   1.463 -11.979   1.139
  169    HG   LEU  19           HG       LEU  19  -1.515 -11.703   0.656
  170   HD11  LEU  19          1HD1      LEU  19   0.337 -12.508  -1.500
  171   HD12  LEU  19          2HD1      LEU  19   0.560 -10.859  -0.914
  172   HD13  LEU  19          3HD1      LEU  19  -1.009 -11.368  -1.539
  173   HD21  LEU  19          3HD2      LEU  19  -0.310 -14.060  -0.481
  174   HD22  LEU  19          1HD2      LEU  19  -1.647 -13.954   0.663
  175   HD23  LEU  19          2HD2      LEU  19   0.014 -14.021   1.252
  176    H    VAL  20           H        VAL  20   2.261 -11.363   3.941
  177    HA   VAL  20           HA       VAL  20   3.895 -13.724   3.751
  178    HB   VAL  20           HB       VAL  20   3.913 -11.173   5.368
  179   HG11  VAL  20          1HG1      VAL  20   4.952 -12.937   6.756
  180   HG12  VAL  20          2HG1      VAL  20   6.160 -11.790   6.177
  181   HG13  VAL  20          3HG1      VAL  20   6.006 -13.371   5.410
  182   HG21  VAL  20          3HG2      VAL  20   5.510 -10.460   3.827
  183   HG22  VAL  20          1HG2      VAL  20   4.503 -11.491   2.809
  184   HG23  VAL  20          2HG2      VAL  20   6.027 -12.103   3.450
  185    H    THR  21           H        THR  21   1.517 -12.613   6.094
  186    HA   THR  21           HA       THR  21   2.311 -14.516   8.174
  187    HB   THR  21           HB       THR  21  -0.002 -12.635   7.678
  188    HG1  THR  21           HG1      THR  21   1.614 -11.491   8.456
  189   HG21  THR  21          3HG2      THR  21  -0.563 -13.212  10.134
  190   HG22  THR  21          1HG2      THR  21   0.371 -14.682   9.859
  191   HG23  THR  21          2HG2      THR  21  -1.068 -14.358   8.891
  192    H    GLY  22           H        GLY  22  -0.046 -14.391   5.549
  193    HA2  GLY  22           1HA      GLY  22  -1.250 -16.955   6.408
  194    HA3  GLY  22           2HA      GLY  22  -1.807 -15.952   5.068
  Start of MODEL    3
    1    H1   PHE   1           1H       PHE   1  -2.006  15.426  -2.079
    2    H2   PHE   1           2H       PHE   1  -3.132  14.674  -1.053
    3    H3   PHE   1           3H       PHE   1  -3.454  14.813  -2.715
    4    HA   PHE   1           HA       PHE   1  -2.772  12.618  -2.566
    5    HB2  PHE   1           1HB      PHE   1  -0.293  14.318  -3.004
    6    HB3  PHE   1           2HB      PHE   1  -0.546  12.684  -3.619
    7    HD1  PHE   1           HD2      PHE   1  -2.826  12.360  -4.970
    8    HD2  PHE   1           HD1      PHE   1  -0.801  16.107  -4.407
    9    HE1  PHE   1           HE2      PHE   1  -3.986  13.287  -6.956
   10    HE2  PHE   1           HE1      PHE   1  -1.962  17.033  -6.393
   11    HZ   PHE   1           HZ       PHE   1  -3.554  15.622  -7.668
   12    H    PHE   2           H        PHE   2  -1.506  14.664  -0.120
   13    HA   PHE   2           HA       PHE   2   0.554  13.215   1.090
   14    HB2  PHE   2           1HB      PHE   2  -1.104  15.361   1.673
   15    HB3  PHE   2           2HB      PHE   2  -1.470  14.214   2.962
   16    HD1  PHE   2           HD1      PHE   2   1.632  15.183   1.072
   17    HD2  PHE   2           HD2      PHE   2  -0.245  14.619   4.895
   18    HE1  PHE   2           HE1      PHE   2   3.759  15.773   2.204
   19    HE2  PHE   2           HE2      PHE   2   1.882  15.209   6.026
   20    HZ   PHE   2           HZ       PHE   2   3.885  15.785   4.680
   21    H    HIS   3           H        HIS   3  -2.940  12.623   1.278
   22    HA   HIS   3           HA       HIS   3  -2.890  10.567   3.260
   23    HB2  HIS   3           1HB      HIS   3  -4.699  11.308   0.959
   24    HB3  HIS   3           2HB      HIS   3  -5.076   9.946   2.015
   25    HD1  HIS   3           HD1      HIS   3  -3.452  12.039   4.262
   26    HD2  HIS   3           HD2      HIS   3  -7.175  12.311   2.406
   27    HE1  HIS   3           HE1      HIS   3  -4.845  13.608   5.678
   28    H    HIS   4           H        HIS   4  -2.848  10.351  -0.300
   29    HA   HIS   4           HA       HIS   4  -2.816   7.626  -0.743
   30    HB2  HIS   4           1HB      HIS   4  -1.973  10.024  -2.044
   31    HB3  HIS   4           2HB      HIS   4  -0.715   8.811  -2.285
   32    HD1  HIS   4           HD1      HIS   4  -1.184   7.974  -4.611
   33    HD2  HIS   4           HD2      HIS   4  -4.633   8.111  -2.273
   34    HE1  HIS   4           HE1      HIS   4  -3.018   6.884  -5.976
   35    H    ILE   5           H        ILE   5   0.206   9.485  -0.336
   36    HA   ILE   5           HA       ILE   5   2.060   7.456  -0.104
   37    HB   ILE   5           HB       ILE   5   1.833   9.900   1.678
   38   HG12  ILE   5          1HG1      ILE   5   3.539  10.233  -0.615
   39   HG13  ILE   5          2HG1      ILE   5   1.945   9.702  -1.156
   40   HG21  ILE   5          1HG2      ILE   5   3.656   7.990   1.972
   41   HG22  ILE   5          2HG2      ILE   5   4.107   9.691   2.086
   42   HG23  ILE   5          3HG2      ILE   5   4.398   8.799   0.592
   43   HD11  ILE   5          3HD1      ILE   5   1.163  11.782  -0.822
   44   HD12  ILE   5          1HD1      ILE   5   2.733  12.293  -0.201
   45   HD13  ILE   5          2HD1      ILE   5   1.526  11.621   0.896
   46    H    PHE   6           H        PHE   6   0.552   8.894   2.795
   47    HA   PHE   6           HA       PHE   6   1.329   7.061   4.725
   48    HB2  PHE   6           1HB      PHE   6  -1.106   8.733   4.227
   49    HB3  PHE   6           2HB      PHE   6  -1.125   7.619   5.594
   50    HD1  PHE   6           HD2      PHE   6   0.635   7.789   7.370
   51    HD2  PHE   6           HD1      PHE   6   0.225  10.723   4.261
   52    HE1  PHE   6           HE2      PHE   6   2.005   9.379   8.690
   53    HE2  PHE   6           HE1      PHE   6   1.595  12.314   5.581
   54    HZ   PHE   6           HZ       PHE   6   2.486  11.641   7.796
   55    H    ARG   7           H        ARG   7  -1.058   6.592   2.186
   56    HA   ARG   7           HA       ARG   7  -2.222   4.176   3.345
   57    HB2  ARG   7           1HB      ARG   7  -2.259   5.130   0.470
   58    HB3  ARG   7           2HB      ARG   7  -3.474   4.154   1.296
   59    HG2  ARG   7           1HG      ARG   7  -3.066   6.572   2.788
   60    HG3  ARG   7           2HG      ARG   7  -3.363   6.988   1.098
   61    HD2  ARG   7           1HD      ARG   7  -5.157   4.866   1.902
   62    HD3  ARG   7           2HD      ARG   7  -5.303   6.244   3.011
   63    HE   ARG   7           HE       ARG   7  -5.777   7.679   1.087
   64   HH11  ARG   7          1HH1      ARG   7  -4.423   5.057  -0.382
   65   HH12  ARG   7          2HH1      ARG   7  -5.677   4.802  -1.548
   66   HH21  ARG   7          1HH2      ARG   7  -7.875   7.037  -0.064
   67   HH22  ARG   7          2HH2      ARG   7  -7.632   5.923  -1.368
   68    H    ALA   8           H        ALA   8  -0.368   4.636   0.309
   69    HA   ALA   8           HA       ALA   8   0.250   2.029  -0.337
   70    HB1  ALA   8           3HB      ALA   8   1.066   3.652  -1.791
   71    HB2  ALA   8           1HB      ALA   8   2.561   3.176  -0.983
   72    HB3  ALA   8           2HB      ALA   8   1.715   4.641  -0.482
   73    H    ILE   9           H        ILE   9   2.497   4.020   1.635
   74    HA   ILE   9           HA       ILE   9   4.267   2.061   2.480
   75    HB   ILE   9           HB       ILE   9   3.065   4.500   3.781
   76   HG12  ILE   9          1HG1      ILE   9   5.598   5.111   3.543
   77   HG13  ILE   9          2HG1      ILE   9   5.653   3.731   2.447
   78   HG21  ILE   9          1HG2      ILE   9   3.624   3.532   5.785
   79   HG22  ILE   9          2HG2      ILE   9   5.238   4.073   5.327
   80   HG23  ILE   9          3HG2      ILE   9   4.754   2.401   5.041
   81   HD11  ILE   9          3HD1      ILE   9   3.562   5.885   2.147
   82   HD12  ILE   9          1HD1      ILE   9   4.106   4.710   0.950
   83   HD13  ILE   9          2HD1      ILE   9   5.157   6.048   1.414
   84    H    VAL  10           H        VAL  10   1.743   3.113   4.772
   85    HA   VAL  10           HA       VAL  10   1.732   0.960   6.498
   86    HB   VAL  10           HB       VAL  10  -0.587   2.549   5.357
   87   HG11  VAL  10          1HG1      VAL  10  -0.410   0.632   7.682
   88   HG12  VAL  10          2HG1      VAL  10  -1.621   0.695   6.401
   89   HG13  VAL  10          3HG1      VAL  10  -1.601   1.932   7.658
   90   HG21  VAL  10          3HG2      VAL  10   1.563   3.070   7.271
   91   HG22  VAL  10          1HG2      VAL  10  -0.033   3.349   7.967
   92   HG23  VAL  10          2HG2      VAL  10   0.452   4.203   6.502
   93    H    HIS  11           H        HIS  11  -0.431   1.166   3.637
   94    HA   HIS  11           HA       HIS  11  -1.633  -1.317   3.678
   95    HB2  HIS  11           1HB      HIS  11  -0.649   0.565   1.600
   96    HB3  HIS  11           2HB      HIS  11  -1.069  -1.052   1.036
   97    HD1  HIS  11           HD1      HIS  11  -3.508  -1.509   0.682
   98    HD2  HIS  11           HD2      HIS  11  -2.893   1.819   3.117
   99    HE1  HIS  11           HE1      HIS  11  -5.792  -0.500   1.106
  100    H    VAL  12           H        VAL  12   1.575  -0.660   2.210
  101    HA   VAL  12           HA       VAL  12   2.229  -3.300   1.448
  102    HB   VAL  12           HB       VAL  12   4.118  -1.228   2.602
  103   HG11  VAL  12          1HG1      VAL  12   4.350  -3.510   0.648
  104   HG12  VAL  12          2HG1      VAL  12   5.332  -3.174   2.074
  105   HG13  VAL  12          3HG1      VAL  12   5.503  -2.175   0.629
  106   HG21  VAL  12          3HG2      VAL  12   3.527   0.187   0.972
  107   HG22  VAL  12          1HG2      VAL  12   2.248  -0.923   0.481
  108   HG23  VAL  12          2HG2      VAL  12   3.853  -1.050  -0.242
  109    H    ALA  13           H        ALA  13   3.705  -1.735   4.283
  110    HA   ALA  13           HA       ALA  13   4.708  -3.902   5.637
  111    HB1  ALA  13           3HB      ALA  13   3.209  -1.477   6.661
  112    HB2  ALA  13           1HB      ALA  13   4.951  -1.649   6.447
  113    HB3  ALA  13           2HB      ALA  13   4.125  -2.552   7.718
  114    H    LYS  14           H        LYS  14   1.286  -2.918   5.581
  115    HA   LYS  14           HA       LYS  14   0.468  -5.008   7.460
  116    HB2  LYS  14           1HB      LYS  14  -0.650  -2.808   7.211
  117    HB3  LYS  14           2HB      LYS  14  -1.095  -3.232   5.557
  118    HG2  LYS  14           1HG      LYS  14  -2.673  -4.783   6.228
  119    HG3  LYS  14           2HG      LYS  14  -1.840  -5.130   7.745
  120    HD2  LYS  14           1HD      LYS  14  -3.658  -3.886   8.505
  121    HD3  LYS  14           2HD      LYS  14  -2.439  -2.626   8.306
  122    HE2  LYS  14           1HE      LYS  14  -3.356  -1.975   6.161
  123    HE3  LYS  14           2HE      LYS  14  -4.462  -3.364   6.162
  124    HZ1  LYS  14           3HZ      LYS  14  -5.280  -2.481   8.363
  125    HZ2  LYS  14           1HZ      LYS  14  -5.712  -1.570   6.999
  126    HZ3  LYS  14           2HZ      LYS  14  -4.448  -1.043   8.006
  127    H    THR  15           H        THR  15  -0.336  -4.433   4.006
  128    HA   THR  15           HA       THR  15  -1.492  -6.978   3.503
  129    HB   THR  15           HB       THR  15   0.104  -5.433   1.505
  130    HG1  THR  15           HG1      THR  15  -2.472  -4.665   2.350
  131   HG21  THR  15          3HG2      THR  15  -2.667  -6.108   0.903
  132   HG22  THR  15          1HG2      THR  15  -1.719  -7.526   1.356
  133   HG23  THR  15          2HG2      THR  15  -1.199  -6.510   0.011
  134    H    ILE  16           H        ILE  16   1.792  -5.870   2.523
  135    HA   ILE  16           HA       ILE  16   2.842  -8.254   1.555
  136    HB   ILE  16           HB       ILE  16   4.219  -6.304   3.438
  137   HG12  ILE  16          1HG1      ILE  16   3.257  -4.925   1.780
  138   HG13  ILE  16          2HG1      ILE  16   4.870  -5.251   1.150
  139   HG21  ILE  16          1HG2      ILE  16   5.249  -8.594   2.460
  140   HG22  ILE  16          2HG2      ILE  16   6.219  -7.139   2.685
  141   HG23  ILE  16          3HG2      ILE  16   5.576  -7.531   1.092
  142   HD11  ILE  16          3HD1      ILE  16   2.381  -6.810   0.404
  143   HD12  ILE  16          1HD1      ILE  16   3.991  -7.028  -0.279
  144   HD13  ILE  16          2HD1      ILE  16   3.100  -5.536  -0.582
  145    H    HIS  17           H        HIS  17   2.607  -7.246   4.955
  146    HA   HIS  17           HA       HIS  17   3.725  -9.733   5.977
  147    HB2  HIS  17           1HB      HIS  17   2.366  -7.277   7.039
  148    HB3  HIS  17           2HB      HIS  17   2.496  -8.683   8.095
  149    HD1  HIS  17           HD1      HIS  17   5.276  -9.710   7.167
  150    HD2  HIS  17           HD2      HIS  17   4.448  -5.728   8.084
  151    HE1  HIS  17           HE1      HIS  17   7.493  -8.634   7.754
  152    H    ARG  18           H        ARG  18   0.561  -8.601   4.994
  153    HA   ARG  18           HA       ARG  18  -0.900 -10.739   6.392
  154    HB2  ARG  18           1HB      ARG  18  -2.025  -8.656   5.968
  155    HB3  ARG  18           2HB      ARG  18  -1.541  -8.668   4.273
  156    HG2  ARG  18           1HG      ARG  18  -2.909 -10.730   3.938
  157    HG3  ARG  18           2HG      ARG  18  -3.468 -10.590   5.606
  158    HD2  ARG  18           1HD      ARG  18  -5.116  -9.232   4.835
  159    HD3  ARG  18           2HD      ARG  18  -3.857  -8.034   4.470
  160    HE   ARG  18           HE       ARG  18  -3.948 -10.069   2.425
  161   HH11  ARG  18          1HH1      ARG  18  -4.657  -6.868   3.249
  162   HH12  ARG  18          2HH1      ARG  18  -5.705  -6.579   1.901
  163   HH21  ARG  18          1HH2      ARG  18  -5.686  -9.879   0.837
  164   HH22  ARG  18          2HH2      ARG  18  -6.287  -8.282   0.536
  165    H    LEU  19           H        LEU  19   0.154 -10.023   3.069
  166    HA   LEU  19           HA       LEU  19  -0.867 -12.478   1.922
  167    HB2  LEU  19           1HB      LEU  19   0.270 -10.048   1.094
  168    HB3  LEU  19           2HB      LEU  19   1.426 -11.279   0.586
  169    HG   LEU  19           HG       LEU  19  -0.230 -10.921  -1.177
  170   HD11  LEU  19          1HD1      LEU  19  -0.768 -13.193  -1.567
  171   HD12  LEU  19          2HD1      LEU  19  -0.940 -13.535   0.155
  172   HD13  LEU  19          3HD1      LEU  19   0.660 -13.261  -0.534
  173   HD21  LEU  19          3HD2      LEU  19  -2.458 -10.702  -0.778
  174   HD22  LEU  19          1HD2      LEU  19  -1.984 -10.478   0.905
  175   HD23  LEU  19          2HD2      LEU  19  -2.481 -12.070   0.334
  176    H    VAL  20           H        VAL  20   2.294 -11.400   3.152
  177    HA   VAL  20           HA       VAL  20   3.735 -13.804   2.495
  178    HB   VAL  20           HB       VAL  20   4.064 -11.526   4.452
  179   HG11  VAL  20          1HG1      VAL  20   5.826 -13.958   4.077
  180   HG12  VAL  20          2HG1      VAL  20   5.125 -13.358   5.580
  181   HG13  VAL  20          3HG1      VAL  20   6.411 -12.452   4.781
  182   HG21  VAL  20          3HG2      VAL  20   5.006 -10.578   2.637
  183   HG22  VAL  20          1HG2      VAL  20   4.738 -12.052   1.705
  184   HG23  VAL  20          2HG2      VAL  20   6.226 -11.852   2.633
  185    H    THR  21           H        THR  21   1.643 -12.905   5.185
  186    HA   THR  21           HA       THR  21   2.453 -15.150   6.881
  187    HB   THR  21           HB       THR  21   0.169 -13.156   6.904
  188    HG1  THR  21           HG1      THR  21   2.365 -12.453   7.286
  189   HG21  THR  21          3HG2      THR  21   0.937 -15.313   8.879
  190   HG22  THR  21          1HG2      THR  21  -0.628 -15.065   8.105
  191   HG23  THR  21          2HG2      THR  21  -0.055 -13.923   9.321
  192    H    GLY  22           H        GLY  22  -0.061 -14.501   4.498
  193    HA2  GLY  22           1HA      GLY  22  -1.197 -16.233   3.268
  194    HA3  GLY  22           2HA      GLY  22  -0.770 -17.379   4.541
  Start of MODEL    4
    1    H1   PHE   1           1H       PHE   1  -2.639  14.330  -1.719
    2    H2   PHE   1           2H       PHE   1  -2.538  12.670  -2.071
    3    H3   PHE   1           3H       PHE   1  -2.458  13.814  -3.325
    4    HA   PHE   1           HA       PHE   1  -0.236  13.202  -3.029
    5    HB2  PHE   1           1HB      PHE   1  -1.216  15.732  -2.543
    6    HB3  PHE   1           2HB      PHE   1  -0.168  15.470  -1.149
    7    HD1  PHE   1           HD2      PHE   1   2.104  14.079  -1.919
    8    HD2  PHE   1           HD1      PHE   1  -0.178  16.818  -4.316
    9    HE1  PHE   1           HE2      PHE   1   4.096  14.500  -3.335
   10    HE2  PHE   1           HE1      PHE   1   1.814  17.238  -5.732
   11    HZ   PHE   1           HZ       PHE   1   3.951  16.078  -5.242
   12    H    PHE   2           H        PHE   2  -1.008  14.498   0.213
   13    HA   PHE   2           HA       PHE   2   0.804  12.550   1.462
   14    HB2  PHE   2           1HB      PHE   2  -0.068  15.128   1.958
   15    HB3  PHE   2           2HB      PHE   2  -0.954  14.189   3.160
   16    HD1  PHE   2           HD1      PHE   2   0.622  12.185   4.199
   17    HD2  PHE   2           HD2      PHE   2   1.968  15.973   2.685
   18    HE1  PHE   2           HE1      PHE   2   2.676  12.007   5.576
   19    HE2  PHE   2           HE2      PHE   2   4.022  15.795   4.063
   20    HZ   PHE   2           HZ       PHE   2   4.375  13.811   5.509
   21    H    HIS   3           H        HIS   3  -2.572  12.767   0.748
   22    HA   HIS   3           HA       HIS   3  -3.539  11.070   2.900
   23    HB2  HIS   3           1HB      HIS   3  -4.511  12.430   0.475
   24    HB3  HIS   3           2HB      HIS   3  -5.363  10.931   0.843
   25    HD1  HIS   3           HD1      HIS   3  -3.928  12.958   3.636
   26    HD2  HIS   3           HD2      HIS   3  -7.636  12.383   1.821
   27    HE1  HIS   3           HE1      HIS   3  -5.646  14.019   5.165
   28    H    HIS   4           H        HIS   4  -3.312  10.465  -0.613
   29    HA   HIS   4           HA       HIS   4  -3.666   7.643  -0.455
   30    HB2  HIS   4           1HB      HIS   4  -2.155   9.294  -2.501
   31    HB3  HIS   4           2HB      HIS   4  -2.899   7.719  -2.774
   32    HD1  HIS   4           HD1      HIS   4  -4.085   9.542  -4.643
   33    HD2  HIS   4           HD2      HIS   4  -5.389   9.562  -0.682
   34    HE1  HIS   4           HE1      HIS   4  -6.371  10.631  -4.647
   35    H    ILE   5           H        ILE   5  -0.656   9.549  -0.790
   36    HA   ILE   5           HA       ILE   5   1.263   7.574  -0.896
   37    HB   ILE   5           HB       ILE   5   1.379  10.156  -0.766
   38   HG12  ILE   5          1HG1      ILE   5   3.363   8.928  -1.151
   39   HG13  ILE   5          2HG1      ILE   5   3.727  10.016   0.185
   40   HG21  ILE   5          1HG2      ILE   5   2.020  11.045   1.439
   41   HG22  ILE   5          2HG2      ILE   5   1.717   9.469   2.166
   42   HG23  ILE   5          3HG2      ILE   5   0.385  10.391   1.470
   43   HD11  ILE   5          3HD1      ILE   5   4.597   7.891   0.835
   44   HD12  ILE   5          1HD1      ILE   5   3.132   7.057   0.316
   45   HD13  ILE   5          2HD1      ILE   5   3.097   8.094   1.742
   46    H    PHE   6           H        PHE   6  -0.265   8.783   2.080
   47    HA   PHE   6           HA       PHE   6   1.096   7.101   3.930
   48    HB2  PHE   6           1HB      PHE   6  -1.010   9.008   3.861
   49    HB3  PHE   6           2HB      PHE   6  -1.644   7.584   4.683
   50    HD1  PHE   6           HD2      PHE   6  -0.183   6.534   6.541
   51    HD2  PHE   6           HD1      PHE   6   0.407  10.500   5.003
   52    HE1  PHE   6           HE2      PHE   6   1.088   7.135   8.581
   53    HE2  PHE   6           HE1      PHE   6   1.679  11.102   7.044
   54    HZ   PHE   6           HZ       PHE   6   2.020   9.420   8.834
   55    H    ARG   7           H        ARG   7  -1.541   6.455   1.717
   56    HA   ARG   7           HA       ARG   7  -2.294   3.921   3.023
   57    HB2  ARG   7           1HB      ARG   7  -3.058   4.970   0.285
   58    HB3  ARG   7           2HB      ARG   7  -3.975   3.870   1.313
   59    HG2  ARG   7           1HG      ARG   7  -4.428   5.614   2.909
   60    HG3  ARG   7           2HG      ARG   7  -3.312   6.713   2.102
   61    HD2  ARG   7           1HD      ARG   7  -5.112   7.476   0.942
   62    HD3  ARG   7           2HD      ARG   7  -5.083   5.927   0.077
   63    HE   ARG   7           HE       ARG   7  -6.682   6.434   2.556
   64   HH11  ARG   7          1HH1      ARG   7  -5.593   4.138   0.309
   65   HH12  ARG   7          2HH1      ARG   7  -7.130   3.364   0.113
   66   HH21  ARG   7          1HH2      ARG   7  -8.838   5.685   2.041
   67   HH22  ARG   7          2HH2      ARG   7  -8.969   4.241   1.094
   68    H    ALA   8           H        ALA   8  -0.866   4.905  -0.103
   69    HA   ALA   8           HA       ALA   8  -0.318   2.422  -1.243
   70    HB1  ALA   8           3HB      ALA   8   0.522   5.149  -1.470
   71    HB2  ALA   8           1HB      ALA   8   0.599   3.884  -2.697
   72    HB3  ALA   8           2HB      ALA   8   1.953   4.126  -1.593
   73    H    ILE   9           H        ILE   9   1.949   4.227   0.889
   74    HA   ILE   9           HA       ILE   9   3.839   2.080   1.119
   75    HB   ILE   9           HB       ILE   9   4.732   3.490   2.924
   76   HG12  ILE   9          1HG1      ILE   9   2.046   4.879   2.695
   77   HG13  ILE   9          2HG1      ILE   9   2.676   4.023   4.102
   78   HG21  ILE   9          1HG2      ILE   9   3.984   5.751   1.357
   79   HG22  ILE   9          2HG2      ILE   9   4.106   4.365   0.272
   80   HG23  ILE   9          3HG2      ILE   9   5.481   4.823   1.276
   81   HD11  ILE   9          3HD1      ILE   9   4.587   5.669   4.146
   82   HD12  ILE   9          1HD1      ILE   9   3.010   6.386   4.479
   83   HD13  ILE   9          2HD1      ILE   9   3.751   6.583   2.890
   84    H    VAL  10           H        VAL  10   1.148   3.130   3.236
   85    HA   VAL  10           HA       VAL  10   1.577   1.207   5.311
   86    HB   VAL  10           HB       VAL  10  -0.763   2.800   4.263
   87   HG11  VAL  10          1HG1      VAL  10  -1.652   0.687   5.211
   88   HG12  VAL  10          2HG1      VAL  10  -2.061   2.074   6.219
   89   HG13  VAL  10          3HG1      VAL  10  -0.755   0.990   6.699
   90   HG21  VAL  10          3HG2      VAL  10   0.824   2.877   6.850
   91   HG22  VAL  10          1HG2      VAL  10  -0.446   4.009   6.384
   92   HG23  VAL  10          2HG2      VAL  10   1.065   3.958   5.477
   93    H    HIS  11           H        HIS  11  -0.669   1.116   2.511
   94    HA   HIS  11           HA       HIS  11  -1.895  -1.341   2.846
   95    HB2  HIS  11           1HB      HIS  11  -0.732   0.032   0.416
   96    HB3  HIS  11           2HB      HIS  11  -1.691  -1.441   0.280
   97    HD1  HIS  11           HD1      HIS  11  -2.585   1.460  -0.741
   98    HD2  HIS  11           HD2      HIS  11  -3.816  -0.417   2.762
   99    HE1  HIS  11           HE1      HIS  11  -4.805   2.506  -0.116
  100    H    VAL  12           H        VAL  12   1.338  -0.826   1.391
  101    HA   VAL  12           HA       VAL  12   1.950  -3.542   0.847
  102    HB   VAL  12           HB       VAL  12   3.895  -1.408   1.760
  103   HG11  VAL  12          1HG1      VAL  12   5.312  -2.497   0.010
  104   HG12  VAL  12          2HG1      VAL  12   4.047  -3.706  -0.205
  105   HG13  VAL  12          3HG1      VAL  12   4.892  -3.578   1.338
  106   HG21  VAL  12          3HG2      VAL  12   3.620  -1.357  -1.047
  107   HG22  VAL  12          1HG2      VAL  12   3.156  -0.098   0.098
  108   HG23  VAL  12          2HG2      VAL  12   1.982  -1.317  -0.393
  109    H    ALA  13           H        ALA  13   3.558  -1.761   3.481
  110    HA   ALA  13           HA       ALA  13   4.468  -3.862   5.014
  111    HB1  ALA  13           3HB      ALA  13   4.530  -1.275   5.319
  112    HB2  ALA  13           1HB      ALA  13   4.579  -2.281   6.766
  113    HB3  ALA  13           2HB      ALA  13   3.070  -1.507   6.280
  114    H    LYS  14           H        LYS  14   1.129  -2.741   4.769
  115    HA   LYS  14           HA       LYS  14   0.158  -4.392   6.978
  116    HB2  LYS  14           1HB      LYS  14  -0.936  -2.314   6.384
  117    HB3  LYS  14           2HB      LYS  14  -1.148  -2.850   4.717
  118    HG2  LYS  14           1HG      LYS  14  -2.357  -4.893   6.051
  119    HG3  LYS  14           2HG      LYS  14  -2.707  -3.547   7.135
  120    HD2  LYS  14           1HD      LYS  14  -3.159  -3.328   4.158
  121    HD3  LYS  14           2HD      LYS  14  -4.392  -3.989   5.233
  122    HE2  LYS  14           1HE      LYS  14  -4.229  -1.878   6.608
  123    HE3  LYS  14           2HE      LYS  14  -3.171  -1.211   5.348
  124    HZ1  LYS  14           3HZ      LYS  14  -5.964  -2.167   5.047
  125    HZ2  LYS  14           1HZ      LYS  14  -4.943  -1.879   3.724
  126    HZ3  LYS  14           2HZ      LYS  14  -5.368  -0.602   4.761
  127    H    THR  15           H        THR  15  -0.530  -4.482   3.454
  128    HA   THR  15           HA       THR  15  -1.640  -7.148   3.536
  129    HB   THR  15           HB       THR  15  -0.430  -5.896   1.117
  130    HG1  THR  15           HG1      THR  15  -1.908  -4.317   1.093
  131   HG21  THR  15          3HG2      THR  15  -2.015  -7.098   0.000
  132   HG22  THR  15          1HG2      THR  15  -3.247  -6.796   1.226
  133   HG23  THR  15          2HG2      THR  15  -2.034  -8.050   1.485
  134    H    ILE  16           H        ILE  16   1.400  -5.973   2.002
  135    HA   ILE  16           HA       ILE  16   2.539  -8.409   1.290
  136    HB   ILE  16           HB       ILE  16   3.592  -5.784   2.315
  137   HG12  ILE  16          1HG1      ILE  16   4.350  -5.532   0.063
  138   HG13  ILE  16          2HG1      ILE  16   4.166  -7.254  -0.263
  139   HG21  ILE  16          1HG2      ILE  16   5.200  -8.300   1.865
  140   HG22  ILE  16          2HG2      ILE  16   5.273  -7.183   3.227
  141   HG23  ILE  16          3HG2      ILE  16   5.915  -6.702   1.657
  142   HD11  ILE  16          3HD1      ILE  16   1.898  -5.332   0.333
  143   HD12  ILE  16          1HD1      ILE  16   1.724  -7.053  -0.011
  144   HD13  ILE  16          2HD1      ILE  16   2.314  -5.958  -1.261
  145    H    HIS  17           H        HIS  17   2.588  -6.863   4.496
  146    HA   HIS  17           HA       HIS  17   4.051  -9.024   5.766
  147    HB2  HIS  17           1HB      HIS  17   3.814  -6.581   6.490
  148    HB3  HIS  17           2HB      HIS  17   2.182  -6.989   7.020
  149    HD1  HIS  17           HD1      HIS  17   3.677  -9.999   7.720
  150    HD2  HIS  17           HD2      HIS  17   4.171  -6.238   9.448
  151    HE1  HIS  17           HE1      HIS  17   4.639 -10.394  10.030
  152    H    ARG  18           H        ARG  18   0.692  -8.379   4.979
  153    HA   ARG  18           HA       ARG  18  -0.367 -10.430   6.806
  154    HB2  ARG  18           1HB      ARG  18  -1.473  -8.269   5.862
  155    HB3  ARG  18           2HB      ARG  18  -1.739  -9.219   4.401
  156    HG2  ARG  18           1HG      ARG  18  -2.576 -10.940   6.389
  157    HG3  ARG  18           2HG      ARG  18  -3.099  -9.370   6.999
  158    HD2  ARG  18           1HD      ARG  18  -4.882  -9.559   5.603
  159    HD3  ARG  18           2HD      ARG  18  -3.744  -9.320   4.262
  160    HE   ARG  18           HE       ARG  18  -3.384 -11.961   4.774
  161   HH11  ARG  18          1HH1      ARG  18  -5.607 -10.226   3.074
  162   HH12  ARG  18          2HH1      ARG  18  -6.865 -11.417   3.101
  163   HH21  ARG  18          1HH2      ARG  18  -5.270 -13.431   5.431
  164   HH22  ARG  18          2HH2      ARG  18  -6.674 -13.232   4.436
  165    H    LEU  19           H        LEU  19   0.239 -10.099   3.308
  166    HA   LEU  19           HA       LEU  19  -0.614 -12.796   2.658
  167    HB2  LEU  19           1HB      LEU  19   0.016 -10.422   1.339
  168    HB3  LEU  19           2HB      LEU  19   1.319 -11.514   0.869
  169    HG   LEU  19           HG       LEU  19  -1.060 -13.037   0.753
  170   HD11  LEU  19          1HD1      LEU  19  -2.585 -11.784  -0.535
  171   HD12  LEU  19          2HD1      LEU  19  -1.391 -10.539  -0.902
  172   HD13  LEU  19          3HD1      LEU  19  -2.081 -10.648   0.717
  173   HD21  LEU  19          3HD2      LEU  19  -0.536 -12.756  -1.792
  174   HD22  LEU  19          1HD2      LEU  19   0.674 -13.523  -0.762
  175   HD23  LEU  19          2HD2      LEU  19   0.860 -11.834  -1.234
  176    H    VAL  20           H        VAL  20   2.458 -11.229   3.467
  177    HA   VAL  20           HA       VAL  20   4.131 -13.519   2.849
  178    HB   VAL  20           HB       VAL  20   4.414 -11.000   4.501
  179   HG11  VAL  20          1HG1      VAL  20   6.836 -11.538   4.619
  180   HG12  VAL  20          2HG1      VAL  20   6.503 -13.117   3.905
  181   HG13  VAL  20          3HG1      VAL  20   5.855 -12.714   5.495
  182   HG21  VAL  20          3HG2      VAL  20   5.565 -10.147   2.647
  183   HG22  VAL  20          1HG2      VAL  20   4.320 -11.131   1.877
  184   HG23  VAL  20          2HG2      VAL  20   5.964 -11.751   2.033
  185    H    THR  21           H        THR  21   2.338 -12.434   5.687
  186    HA   THR  21           HA       THR  21   3.599 -14.308   7.535
  187    HB   THR  21           HB       THR  21   1.152 -12.529   7.541
  188    HG1  THR  21           HG1      THR  21   2.562 -11.663   9.316
  189   HG21  THR  21          3HG2      THR  21   1.649 -14.816   9.204
  190   HG22  THR  21          1HG2      THR  21   0.311 -13.670   9.282
  191   HG23  THR  21          2HG2      THR  21   1.797 -13.354  10.179
  192    H    GLY  22           H        GLY  22   0.958 -14.434   5.255
  193    HA2  GLY  22           1HA      GLY  22  -0.268 -16.322   4.540
  194    HA3  GLY  22           2HA      GLY  22   0.639 -17.297   5.698
  Start of MODEL    5
    1    H1   PHE   1           1H       PHE   1  -3.014  15.013  -2.523
    2    H2   PHE   1           2H       PHE   1  -1.624  15.689  -1.817
    3    H3   PHE   1           3H       PHE   1  -2.706  14.783  -0.871
    4    HA   PHE   1           HA       PHE   1  -2.170  12.852  -2.459
    5    HB2  PHE   1           1HB      PHE   1  -0.840  14.998  -3.642
    6    HB3  PHE   1           2HB      PHE   1   0.455  14.075  -2.879
    7    HD1  PHE   1           HD1      PHE   1  -2.472  13.778  -5.170
    8    HD2  PHE   1           HD2      PHE   1   1.191  12.011  -3.786
    9    HE1  PHE   1           HE1      PHE   1  -2.599  12.093  -6.986
   10    HE2  PHE   1           HE2      PHE   1   1.064  10.326  -5.601
   11    HZ   PHE   1           HZ       PHE   1  -0.832  10.367  -7.201
   12    H    PHE   2           H        PHE   2  -0.966  14.920   0.011
   13    HA   PHE   2           HA       PHE   2   1.199  13.371   1.048
   14    HB2  PHE   2           1HB      PHE   2  -0.832  15.136   2.452
   15    HB3  PHE   2           2HB      PHE   2   0.760  14.701   3.076
   16    HD1  PHE   2           HD2      PHE   2   2.712  15.078   1.194
   17    HD2  PHE   2           HD1      PHE   2  -0.986  17.244   1.487
   18    HE1  PHE   2           HE2      PHE   2   3.720  16.967  -0.058
   19    HE2  PHE   2           HE1      PHE   2   0.021  19.134   0.235
   20    HZ   PHE   2           HZ       PHE   2   2.374  18.996  -0.537
   21    H    HIS   3           H        HIS   3  -1.937  13.656   2.706
   22    HA   HIS   3           HA       HIS   3  -1.868  11.464   4.351
   23    HB2  HIS   3           1HB      HIS   3  -4.320  11.478   4.150
   24    HB3  HIS   3           2HB      HIS   3  -3.701  13.128   4.120
   25    HD1  HIS   3           HD1      HIS   3  -4.393  14.525   2.166
   26    HD2  HIS   3           HD2      HIS   3  -4.820  10.454   1.379
   27    HE1  HIS   3           HE1      HIS   3  -5.487  14.346  -0.111
   28    H    HIS   4           H        HIS   4  -2.240  11.411   0.854
   29    HA   HIS   4           HA       HIS   4  -3.181   8.733   0.531
   30    HB2  HIS   4           1HB      HIS   4  -2.168  10.934  -1.030
   31    HB3  HIS   4           2HB      HIS   4  -1.440   9.427  -1.593
   32    HD1  HIS   4           HD1      HIS   4  -2.807   8.771  -3.591
   33    HD2  HIS   4           HD2      HIS   4  -5.201   9.959  -0.393
   34    HE1  HIS   4           HE1      HIS   4  -5.202   8.331  -4.288
   35    H    ILE   5           H        ILE   5   0.139  10.047   0.618
   36    HA   ILE   5           HA       ILE   5   1.537   7.625   0.145
   37    HB   ILE   5           HB       ILE   5   3.426   8.790   0.957
   38   HG12  ILE   5          1HG1      ILE   5   1.561  10.367   2.756
   39   HG13  ILE   5          2HG1      ILE   5   2.604   9.046   3.275
   40   HG21  ILE   5          1HG2      ILE   5   3.284  10.904  -0.024
   41   HG22  ILE   5          2HG2      ILE   5   1.637  11.167   0.550
   42   HG23  ILE   5          3HG2      ILE   5   1.939  10.054  -0.786
   43   HD11  ILE   5          3HD1      ILE   5   3.706  11.466   1.863
   44   HD12  ILE   5          1HD1      ILE   5   4.567  10.284   2.849
   45   HD13  ILE   5          2HD1      ILE   5   3.472  11.439   3.610
   46    H    PHE   6           H        PHE   6   0.412   9.044   3.201
   47    HA   PHE   6           HA       PHE   6   1.323   7.156   5.050
   48    HB2  PHE   6           1HB      PHE   6  -0.309   9.325   5.059
   49    HB3  PHE   6           2HB      PHE   6  -1.503   8.048   5.290
   50    HD1  PHE   6           HD1      PHE   6  -1.300   6.475   7.219
   51    HD2  PHE   6           HD2      PHE   6   1.271   9.888   6.778
   52    HE1  PHE   6           HE1      PHE   6  -0.638   6.284   9.601
   53    HE2  PHE   6           HE2      PHE   6   1.933   9.697   9.160
   54    HZ   PHE   6           HZ       PHE   6   0.979   7.895  10.572
   55    H    ARG   7           H        ARG   7  -1.352   6.886   2.755
   56    HA   ARG   7           HA       ARG   7  -2.248   4.299   3.849
   57    HB2  ARG   7           1HB      ARG   7  -2.997   5.639   1.238
   58    HB3  ARG   7           2HB      ARG   7  -3.967   4.515   2.191
   59    HG2  ARG   7           1HG      ARG   7  -3.900   6.246   4.064
   60    HG3  ARG   7           2HG      ARG   7  -3.240   7.369   2.875
   61    HD2  ARG   7           1HD      ARG   7  -5.685   7.635   2.989
   62    HD3  ARG   7           2HD      ARG   7  -5.246   6.928   1.421
   63    HE   ARG   7           HE       ARG   7  -5.926   5.106   3.680
   64   HH11  ARG   7          1HH1      ARG   7  -5.466   4.390   0.708
   65   HH12  ARG   7          2HH1      ARG   7  -7.096   4.098   0.202
   66   HH21  ARG   7          1HH2      ARG   7  -8.511   5.619   2.978
   67   HH22  ARG   7          2HH2      ARG   7  -8.820   4.794   1.486
   68    H    ALA   8           H        ALA   8  -0.920   5.418   0.712
   69    HA   ALA   8           HA       ALA   8  -0.537   2.969  -0.567
   70    HB1  ALA   8           3HB      ALA   8   0.499   5.684  -0.653
   71    HB2  ALA   8           1HB      ALA   8   0.211   4.565  -1.985
   72    HB3  ALA   8           2HB      ALA   8   1.742   4.522  -1.112
   73    H    ILE   9           H        ILE   9   1.619   4.516   1.827
   74    HA   ILE   9           HA       ILE   9   3.643   2.441   1.704
   75    HB   ILE   9           HB       ILE   9   2.952   4.572   3.754
   76   HG12  ILE   9          1HG1      ILE   9   5.149   4.574   1.672
   77   HG13  ILE   9          2HG1      ILE   9   3.549   5.246   1.354
   78   HG21  ILE   9          1HG2      ILE   9   4.475   2.489   4.365
   79   HG22  ILE   9          2HG2      ILE   9   4.950   4.117   4.850
   80   HG23  ILE   9          3HG2      ILE   9   5.680   3.372   3.427
   81   HD11  ILE   9          3HD1      ILE   9   4.785   7.108   2.108
   82   HD12  ILE   9          1HD1      ILE   9   5.611   6.168   3.351
   83   HD13  ILE   9          2HD1      ILE   9   3.908   6.586   3.546
   84    H    VAL  10           H        VAL  10   1.179   3.245   4.193
   85    HA   VAL  10           HA       VAL  10   1.592   1.096   5.946
   86    HB   VAL  10           HB       VAL  10  -0.819   2.662   5.028
   87   HG11  VAL  10          1HG1      VAL  10  -0.799   0.644   7.291
   88   HG12  VAL  10          2HG1      VAL  10  -1.548   0.360   5.719
   89   HG13  VAL  10          3HG1      VAL  10  -2.161   1.637   6.771
   90   HG21  VAL  10          3HG2      VAL  10   0.426   2.530   7.775
   91   HG22  VAL  10          1HG2      VAL  10  -0.538   3.826   7.067
   92   HG23  VAL  10          2HG2      VAL  10   1.114   3.554   6.513
   93    H    HIS  11           H        HIS  11  -0.415   1.177   2.997
   94    HA   HIS  11           HA       HIS  11  -1.515  -1.427   3.129
   95    HB2  HIS  11           1HB      HIS  11  -1.133   0.741   1.240
   96    HB3  HIS  11           2HB      HIS  11  -0.978  -0.819   0.431
   97    HD1  HIS  11           HD1      HIS  11  -3.146  -1.780  -0.313
   98    HD2  HIS  11           HD2      HIS  11  -3.639   0.691   3.008
   99    HE1  HIS  11           HE1      HIS  11  -5.629  -1.733   0.183
  100    H    VAL  12           H        VAL  12   1.140  -0.576   0.881
  101    HA   VAL  12           HA       VAL  12   2.046  -3.073   0.183
  102    HB   VAL  12           HB       VAL  12   3.029  -1.070  -0.701
  103   HG11  VAL  12          1HG1      VAL  12   4.374   0.453   0.698
  104   HG12  VAL  12          2HG1      VAL  12   4.033  -0.545   2.113
  105   HG13  VAL  12          3HG1      VAL  12   2.726   0.325   1.312
  106   HG21  VAL  12          3HG2      VAL  12   5.004  -2.116  -0.996
  107   HG22  VAL  12          1HG2      VAL  12   4.590  -3.200   0.331
  108   HG23  VAL  12          2HG2      VAL  12   5.493  -1.719   0.652
  109    H    ALA  13           H        ALA  13   2.809  -1.403   3.244
  110    HA   ALA  13           HA       ALA  13   4.581  -3.502   4.205
  111    HB1  ALA  13           3HB      ALA  13   3.214  -1.755   6.152
  112    HB2  ALA  13           1HB      ALA  13   3.996  -0.885   4.832
  113    HB3  ALA  13           2HB      ALA  13   4.939  -1.967   5.857
  114    H    LYS  14           H        LYS  14   1.150  -2.680   4.687
  115    HA   LYS  14           HA       LYS  14   0.648  -4.752   6.651
  116    HB2  LYS  14           1HB      LYS  14  -0.745  -2.771   6.461
  117    HB3  LYS  14           2HB      LYS  14  -1.104  -3.136   4.772
  118    HG2  LYS  14           1HG      LYS  14  -3.002  -3.871   6.037
  119    HG3  LYS  14           2HG      LYS  14  -2.113  -5.324   5.582
  120    HD2  LYS  14           1HD      LYS  14  -2.355  -5.778   7.822
  121    HD3  LYS  14           2HD      LYS  14  -0.886  -4.805   7.917
  122    HE2  LYS  14           1HE      LYS  14  -2.295  -2.774   8.319
  123    HE3  LYS  14           2HE      LYS  14  -3.730  -3.818   8.345
  124    HZ1  LYS  14           3HZ      LYS  14  -2.051  -5.156   9.952
  125    HZ2  LYS  14           1HZ      LYS  14  -3.219  -4.060  10.509
  126    HZ3  LYS  14           2HZ      LYS  14  -1.610  -3.553  10.303
  127    H    THR  15           H        THR  15  -0.129  -4.478   3.160
  128    HA   THR  15           HA       THR  15  -1.251  -7.053   2.789
  129    HB   THR  15           HB       THR  15   0.534  -5.682   0.812
  130    HG1  THR  15           HG1      THR  15  -1.348  -4.341   0.398
  131   HG21  THR  15          3HG2      THR  15  -2.185  -6.509   0.073
  132   HG22  THR  15          1HG2      THR  15  -1.167  -7.833   0.641
  133   HG23  THR  15          2HG2      THR  15  -0.650  -6.846  -0.728
  134    H    ILE  16           H        ILE  16   2.113  -6.061   1.971
  135    HA   ILE  16           HA       ILE  16   3.196  -8.566   1.393
  136    HB   ILE  16           HB       ILE  16   4.196  -6.043   2.695
  137   HG12  ILE  16          1HG1      ILE  16   5.395  -5.793   0.643
  138   HG13  ILE  16          2HG1      ILE  16   5.169  -7.490   0.223
  139   HG21  ILE  16          1HG2      ILE  16   5.496  -7.732   3.851
  140   HG22  ILE  16          2HG2      ILE  16   6.519  -7.014   2.606
  141   HG23  ILE  16          3HG2      ILE  16   5.791  -8.599   2.343
  142   HD11  ILE  16          3HD1      ILE  16   3.011  -5.366   0.370
  143   HD12  ILE  16          1HD1      ILE  16   2.702  -7.081   0.099
  144   HD13  ILE  16          2HD1      ILE  16   3.617  -6.152  -1.088
  145    H    HIS  17           H        HIS  17   2.754  -7.068   4.599
  146    HA   HIS  17           HA       HIS  17   3.752  -9.373   6.058
  147    HB2  HIS  17           1HB      HIS  17   3.349  -6.786   6.646
  148    HB3  HIS  17           2HB      HIS  17   1.809  -7.418   7.228
  149    HD1  HIS  17           HD1      HIS  17   5.530  -7.713   7.800
  150    HD2  HIS  17           HD2      HIS  17   1.975  -8.966   9.580
  151    HE1  HIS  17           HE1      HIS  17   6.161  -8.687  10.050
  152    H    ARG  18           H        ARG  18   0.698  -8.432   4.636
  153    HA   ARG  18           HA       ARG  18  -0.906 -10.357   6.173
  154    HB2  ARG  18           1HB      ARG  18  -1.531  -8.101   4.963
  155    HB3  ARG  18           2HB      ARG  18  -1.652  -9.119   3.529
  156    HG2  ARG  18           1HG      ARG  18  -3.240 -10.600   4.743
  157    HG3  ARG  18           2HG      ARG  18  -3.162  -9.511   6.129
  158    HD2  ARG  18           1HD      ARG  18  -4.427  -7.882   5.090
  159    HD3  ARG  18           2HD      ARG  18  -3.808  -8.290   3.477
  160    HE   ARG  18           HE       ARG  18  -5.516 -10.309   4.823
  161   HH11  ARG  18          1HH1      ARG  18  -4.698 -10.030   1.838
  162   HH12  ARG  18          2HH1      ARG  18  -6.215  -9.555   1.151
  163   HH21  ARG  18          1HH2      ARG  18  -7.650  -8.758   4.205
  164   HH22  ARG  18          2HH2      ARG  18  -7.887  -8.836   2.491
  165    H    LEU  19           H        LEU  19   0.410 -10.117   2.864
  166    HA   LEU  19           HA       LEU  19  -0.483 -12.743   2.036
  167    HB2  LEU  19           1HB      LEU  19   0.660 -10.447   0.917
  168    HB3  LEU  19           2HB      LEU  19   1.904 -11.682   0.725
  169    HG   LEU  19           HG       LEU  19  -0.985 -11.903  -0.163
  170   HD11  LEU  19          1HD1      LEU  19   1.551 -11.123  -1.469
  171   HD12  LEU  19          2HD1      LEU  19  -0.110 -10.744  -1.922
  172   HD13  LEU  19          3HD1      LEU  19   0.590 -12.304  -2.359
  173   HD21  LEU  19          3HD2      LEU  19   1.170 -13.883   0.257
  174   HD22  LEU  19          1HD2      LEU  19   0.379 -13.980  -1.317
  175   HD23  LEU  19          2HD2      LEU  19  -0.574 -14.124   0.159
  176    H    VAL  20           H        VAL  20   2.496 -11.411   3.422
  177    HA   VAL  20           HA       VAL  20   4.107 -13.776   3.222
  178    HB   VAL  20           HB       VAL  20   4.039 -11.321   4.980
  179   HG11  VAL  20          1HG1      VAL  20   6.086 -13.560   5.034
  180   HG12  VAL  20          2HG1      VAL  20   4.983 -13.137   6.343
  181   HG13  VAL  20          3HG1      VAL  20   6.251 -12.012   5.861
  182   HG21  VAL  20          3HG2      VAL  20   6.057 -12.296   2.935
  183   HG22  VAL  20          1HG2      VAL  20   5.994 -10.700   3.684
  184   HG23  VAL  20          2HG2      VAL  20   4.729 -11.197   2.559
  185    H    THR  21           H        THR  21   1.594 -12.775   5.465
  186    HA   THR  21           HA       THR  21   2.229 -14.731   7.527
  187    HB   THR  21           HB       THR  21  -0.139 -12.977   6.844
  188    HG1  THR  21           HG1      THR  21   1.492 -12.879   9.131
  189   HG21  THR  21          3HG2      THR  21  -0.726 -13.611   9.334
  190   HG22  THR  21          1HG2      THR  21   0.188 -15.073   8.964
  191   HG23  THR  21          2HG2      THR  21  -1.238 -14.660   8.012
  192    H    GLY  22           H        GLY  22  -0.179 -14.533   4.912
  193    HA2  GLY  22           1HA      GLY  22  -0.323 -16.956   3.847
  194    HA3  GLY  22           2HA      GLY  22  -0.969 -17.346   5.442
  Start of MODEL    6
    1    H1   PHE   1           1H       PHE   1   0.924  16.559  -0.329
    2    H2   PHE   1           2H       PHE   1   2.045  15.375  -0.809
    3    H3   PHE   1           3H       PHE   1   1.573  15.492   0.819
    4    HA   PHE   1           HA       PHE   1  -0.814  15.129  -0.314
    5    HB2  PHE   1           1HB      PHE   1   1.288  13.699  -1.974
    6    HB3  PHE   1           2HB      PHE   1  -0.455  13.486  -2.137
    7    HD1  PHE   1           HD1      PHE   1  -1.877  15.574  -2.648
    8    HD2  PHE   1           HD2      PHE   1   2.392  15.447  -3.111
    9    HE1  PHE   1           HE1      PHE   1  -1.980  17.549  -4.143
   10    HE2  PHE   1           HE2      PHE   1   2.288  17.422  -4.606
   11    HZ   PHE   1           HZ       PHE   1   0.102  18.474  -5.122
   12    H    PHE   2           H        PHE   2   0.513  14.624   2.101
   13    HA   PHE   2           HA       PHE   2   1.488  12.092   2.698
   14    HB2  PHE   2           1HB      PHE   2  -0.219  14.125   4.062
   15    HB3  PHE   2           2HB      PHE   2  -0.068  12.550   4.840
   16    HD1  PHE   2           HD2      PHE   2   2.577  13.983   2.705
   17    HD2  PHE   2           HD1      PHE   2   1.234  13.351   6.736
   18    HE1  PHE   2           HE2      PHE   2   4.821  14.616   3.552
   19    HE2  PHE   2           HE1      PHE   2   3.478  13.985   7.582
   20    HZ   PHE   2           HZ       PHE   2   5.271  14.617   5.990
   21    H    HIS   3           H        HIS   3  -1.849  13.001   1.975
   22    HA   HIS   3           HA       HIS   3  -3.252  10.721   2.824
   23    HB2  HIS   3           1HB      HIS   3  -3.746  13.012   1.387
   24    HB3  HIS   3           2HB      HIS   3  -3.974  11.763   0.161
   25    HD1  HIS   3           HD1      HIS   3  -6.445  11.403   0.040
   26    HD2  HIS   3           HD2      HIS   3  -5.107  11.620   3.981
   27    HE1  HIS   3           HE1      HIS   3  -8.446  10.889   1.504
   28    H    HIS   4           H        HIS   4  -2.385  11.177  -0.598
   29    HA   HIS   4           HA       HIS   4  -2.680   8.632  -1.577
   30    HB2  HIS   4           1HB      HIS   4  -0.624  10.781  -2.047
   31    HB3  HIS   4           2HB      HIS   4  -0.594   9.293  -2.991
   32    HD1  HIS   4           HD1      HIS   4  -1.333  10.503  -5.173
   33    HD2  HIS   4           HD2      HIS   4  -4.063  10.863  -2.044
   34    HE1  HIS   4           HE1      HIS   4  -3.466  11.418  -6.186
   35    H    ILE   5           H        ILE   5   0.514   9.758  -0.431
   36    HA   ILE   5           HA       ILE   5   1.908   7.373  -0.395
   37    HB   ILE   5           HB       ILE   5   1.869   9.506   1.762
   38   HG12  ILE   5          1HG1      ILE   5   3.992   9.789  -0.140
   39   HG13  ILE   5          2HG1      ILE   5   2.474   9.652  -1.027
   40   HG21  ILE   5          1HG2      ILE   5   3.211   7.179   1.900
   41   HG22  ILE   5          2HG2      ILE   5   3.889   8.692   2.503
   42   HG23  ILE   5          3HG2      ILE   5   4.349   8.091   0.909
   43   HD11  ILE   5          3HD1      ILE   5   1.760  11.329   1.020
   44   HD12  ILE   5          1HD1      ILE   5   2.256  11.869  -0.584
   45   HD13  ILE   5          2HD1      ILE   5   3.430  11.815   0.732
   46    H    PHE   6           H        PHE   6   0.267   8.595   2.527
   47    HA   PHE   6           HA       PHE   6   0.391   6.324   4.128
   48    HB2  PHE   6           1HB      PHE   6  -0.939   8.799   4.048
   49    HB3  PHE   6           2HB      PHE   6  -2.212   7.600   4.280
   50    HD1  PHE   6           HD2      PHE   6  -1.871   5.827   6.113
   51    HD2  PHE   6           HD1      PHE   6   0.448   9.432   5.849
   52    HE1  PHE   6           HE2      PHE   6  -1.214   5.578   8.490
   53    HE2  PHE   6           HE1      PHE   6   1.106   9.184   8.227
   54    HZ   PHE   6           HZ       PHE   6   0.274   7.257   9.548
   55    H    ARG   7           H        ARG   7  -1.519   6.749   1.230
   56    HA   ARG   7           HA       ARG   7  -3.370   4.548   1.858
   57    HB2  ARG   7           1HB      ARG   7  -2.858   5.919  -0.791
   58    HB3  ARG   7           2HB      ARG   7  -4.344   5.139  -0.249
   59    HG2  ARG   7           1HG      ARG   7  -3.632   7.132   1.674
   60    HG3  ARG   7           2HG      ARG   7  -3.576   7.865   0.071
   61    HD2  ARG   7           1HD      ARG   7  -5.898   6.161   0.245
   62    HD3  ARG   7           2HD      ARG   7  -5.895   7.311   1.598
   63    HE   ARG   7           HE       ARG   7  -5.839   9.135   0.007
   64   HH11  ARG   7          1HH1      ARG   7  -5.030   6.260  -1.613
   65   HH12  ARG   7          2HH1      ARG   7  -5.812   6.691  -3.098
   66   HH21  ARG   7          1HH2      ARG   7  -7.217   9.593  -1.822
   67   HH22  ARG   7          2HH2      ARG   7  -7.050   8.579  -3.216
   68    H    ALA   8           H        ALA   8  -0.984   5.081  -0.769
   69    HA   ALA   8           HA       ALA   8  -0.967   2.319  -1.591
   70    HB1  ALA   8           3HB      ALA   8  -0.257   4.651  -2.686
   71    HB2  ALA   8           1HB      ALA   8   0.447   3.128  -3.230
   72    HB3  ALA   8           2HB      ALA   8   1.333   4.155  -2.103
   73    H    ILE   9           H        ILE   9   0.962   4.131   0.753
   74    HA   ILE   9           HA       ILE   9   3.013   2.055   0.965
   75    HB   ILE   9           HB       ILE   9   2.477   4.770   1.866
   76   HG12  ILE   9          1HG1      ILE   9   4.332   4.192   0.430
   77   HG13  ILE   9          2HG1      ILE   9   4.990   4.762   1.966
   78   HG21  ILE   9          1HG2      ILE   9   3.747   2.896   3.889
   79   HG22  ILE   9          2HG2      ILE   9   2.209   3.736   4.092
   80   HG23  ILE   9          3HG2      ILE   9   3.711   4.656   4.005
   81   HD11  ILE   9          3HD1      ILE   9   6.023   2.791   2.293
   82   HD12  ILE   9          1HD1      ILE   9   5.453   2.259   0.710
   83   HD13  ILE   9          2HD1      ILE   9   4.484   1.940   2.151
   84    H    VAL  10           H        VAL  10   0.235   3.095   2.938
   85    HA   VAL  10           HA       VAL  10   0.645   1.266   5.103
   86    HB   VAL  10           HB       VAL  10  -1.752   2.693   3.932
   87   HG11  VAL  10          1HG1      VAL  10  -1.586   1.120   6.522
   88   HG12  VAL  10          2HG1      VAL  10  -2.521   0.654   5.100
   89   HG13  VAL  10          3HG1      VAL  10  -2.953   2.105   6.005
   90   HG21  VAL  10          3HG2      VAL  10  -0.135   4.175   4.928
   91   HG22  VAL  10          1HG2      VAL  10   0.055   3.120   6.328
   92   HG23  VAL  10          2HG2      VAL  10  -1.453   4.003   6.087
   93    H    HIS  11           H        HIS  11  -1.529   1.017   2.256
   94    HA   HIS  11           HA       HIS  11  -2.520  -1.593   2.819
   95    HB2  HIS  11           1HB      HIS  11  -2.480   0.373   0.670
   96    HB3  HIS  11           2HB      HIS  11  -2.432  -1.274   0.038
   97    HD1  HIS  11           HD1      HIS  11  -4.527  -2.709   0.300
   98    HD2  HIS  11           HD2      HIS  11  -4.819   0.943   2.288
   99    HE1  HIS  11           HE1      HIS  11  -6.935  -2.493   1.052
  100    H    VAL  12           H        VAL  12   0.094  -0.655   0.533
  101    HA   VAL  12           HA       VAL  12   0.912  -3.232  -0.240
  102    HB   VAL  12           HB       VAL  12   1.703  -1.104  -1.200
  103   HG11  VAL  12          1HG1      VAL  12   1.853   0.061   1.029
  104   HG12  VAL  12          2HG1      VAL  12   3.258   0.315  -0.007
  105   HG13  VAL  12          3HG1      VAL  12   3.344  -0.829   1.334
  106   HG21  VAL  12          3HG2      VAL  12   4.087  -1.691  -1.408
  107   HG22  VAL  12          1HG2      VAL  12   3.088  -3.142  -1.480
  108   HG23  VAL  12          2HG2      VAL  12   3.958  -2.742   0.002
  109    H    ALA  13           H        ALA  13   1.971  -1.333   2.598
  110    HA   ALA  13           HA       ALA  13   3.881  -3.239   3.573
  111    HB1  ALA  13           3HB      ALA  13   3.478  -1.919   5.718
  112    HB2  ALA  13           1HB      ALA  13   2.218  -1.049   4.843
  113    HB3  ALA  13           2HB      ALA  13   3.894  -0.949   4.305
  114    H    LYS  14           H        LYS  14   0.723  -2.474   5.083
  115    HA   LYS  14           HA       LYS  14   0.470  -4.643   6.789
  116    HB2  LYS  14           1HB      LYS  14  -1.076  -2.694   6.496
  117    HB3  LYS  14           2HB      LYS  14  -1.706  -3.458   5.035
  118    HG2  LYS  14           1HG      LYS  14  -3.088  -3.896   7.101
  119    HG3  LYS  14           2HG      LYS  14  -2.516  -5.356   6.293
  120    HD2  LYS  14           1HD      LYS  14  -2.214  -5.411   8.785
  121    HD3  LYS  14           2HD      LYS  14  -0.706  -5.599   7.890
  122    HE2  LYS  14           1HE      LYS  14  -0.096  -3.292   8.281
  123    HE3  LYS  14           2HE      LYS  14  -1.693  -2.937   8.970
  124    HZ1  LYS  14           3HZ      LYS  14   0.237  -4.930  10.037
  125    HZ2  LYS  14           1HZ      LYS  14  -1.289  -4.579  10.690
  126    HZ3  LYS  14           2HZ      LYS  14  -0.065  -3.400  10.712
  127    H    THR  15           H        THR  15  -1.193  -4.649   3.621
  128    HA   THR  15           HA       THR  15  -1.920  -7.288   3.379
  129    HB   THR  15           HB       THR  15  -0.507  -5.753   1.218
  130    HG1  THR  15           HG1      THR  15  -2.862  -5.239   2.594
  131   HG21  THR  15          3HG2      THR  15  -1.545  -7.153  -0.232
  132   HG22  THR  15          1HG2      THR  15  -3.054  -7.118   0.682
  133   HG23  THR  15          2HG2      THR  15  -1.748  -8.196   1.177
  134    H    ILE  16           H        ILE  16   1.182  -6.143   1.969
  135    HA   ILE  16           HA       ILE  16   2.357  -8.613   1.433
  136    HB   ILE  16           HB       ILE  16   3.358  -5.916   2.319
  137   HG12  ILE  16          1HG1      ILE  16   4.115  -5.756   0.068
  138   HG13  ILE  16          2HG1      ILE  16   4.013  -7.500  -0.171
  139   HG21  ILE  16          1HG2      ILE  16   5.699  -6.784   1.809
  140   HG22  ILE  16          2HG2      ILE  16   5.031  -8.410   1.942
  141   HG23  ILE  16          3HG2      ILE  16   5.004  -7.330   3.335
  142   HD11  ILE  16          3HD1      ILE  16   1.529  -7.341   0.121
  143   HD12  ILE  16          1HD1      ILE  16   2.121  -6.454  -1.282
  144   HD13  ILE  16          2HD1      ILE  16   1.688  -5.587   0.189
  145    H    HIS  17           H        HIS  17   2.380  -6.819   4.516
  146    HA   HIS  17           HA       HIS  17   3.824  -8.824   6.002
  147    HB2  HIS  17           1HB      HIS  17   2.634  -6.251   6.368
  148    HB3  HIS  17           2HB      HIS  17   1.996  -7.312   7.625
  149    HD1  HIS  17           HD1      HIS  17   3.426  -6.266   9.511
  150    HD2  HIS  17           HD2      HIS  17   5.691  -7.784   6.357
  151    HE1  HIS  17           HE1      HIS  17   5.829  -6.304  10.308
  152    H    ARG  18           H        ARG  18   0.476  -8.401   5.029
  153    HA   ARG  18           HA       ARG  18  -0.566 -10.400   6.921
  154    HB2  ARG  18           1HB      ARG  18  -1.898  -8.488   6.074
  155    HB3  ARG  18           2HB      ARG  18  -1.715  -9.096   4.435
  156    HG2  ARG  18           1HG      ARG  18  -3.906  -9.678   5.644
  157    HG3  ARG  18           2HG      ARG  18  -3.047 -11.005   4.862
  158    HD2  ARG  18           1HD      ARG  18  -2.005 -11.609   7.011
  159    HD3  ARG  18           2HD      ARG  18  -2.874 -10.282   7.802
  160    HE   ARG  18           HE       ARG  18  -4.067 -12.800   6.884
  161   HH11  ARG  18          1HH1      ARG  18  -4.575  -9.427   7.384
  162   HH12  ARG  18          2HH1      ARG  18  -6.237  -9.611   7.835
  163   HH21  ARG  18          1HH2      ARG  18  -6.206 -13.067   7.573
  164   HH22  ARG  18          2HH2      ARG  18  -7.159 -11.669   7.942
  165    H    LEU  19           H        LEU  19   0.198 -10.241   3.439
  166    HA   LEU  19           HA       LEU  19  -0.491 -13.020   2.927
  167    HB2  LEU  19           1HB      LEU  19  -0.468 -11.114   1.274
  168    HB3  LEU  19           2HB      LEU  19   1.292 -11.108   1.384
  169    HG   LEU  19           HG       LEU  19   0.336 -12.440  -0.559
  170   HD11  LEU  19          1HD1      LEU  19   2.241 -13.657  -0.489
  171   HD12  LEU  19          2HD1      LEU  19   1.743 -14.493   0.981
  172   HD13  LEU  19          3HD1      LEU  19   2.522 -12.915   1.085
  173   HD21  LEU  19          3HD2      LEU  19  -0.316 -14.500   1.550
  174   HD22  LEU  19          1HD2      LEU  19  -0.776 -14.491  -0.152
  175   HD23  LEU  19          2HD2      LEU  19  -1.535 -13.365   0.972
  176    H    VAL  20           H        VAL  20   2.422 -11.233   3.813
  177    HA   VAL  20           HA       VAL  20   4.266 -13.443   3.379
  178    HB   VAL  20           HB       VAL  20   4.322 -10.798   4.846
  179   HG11  VAL  20          1HG1      VAL  20   6.744 -11.155   5.161
  180   HG12  VAL  20          2HG1      VAL  20   6.587 -12.786   4.507
  181   HG13  VAL  20          3HG1      VAL  20   5.805 -12.369   6.032
  182   HG21  VAL  20          3HG2      VAL  20   5.724 -11.835   2.360
  183   HG22  VAL  20          1HG2      VAL  20   5.879 -10.207   3.019
  184   HG23  VAL  20          2HG2      VAL  20   4.331 -10.753   2.373
  185    H    THR  21           H        THR  21   2.285 -12.291   6.055
  186    HA   THR  21           HA       THR  21   3.574 -13.937   8.090
  187    HB   THR  21           HB       THR  21   1.003 -12.356   7.858
  188    HG1  THR  21           HG1      THR  21   3.326 -12.011   9.444
  189   HG21  THR  21          3HG2      THR  21   0.774 -12.710  10.318
  190   HG22  THR  21          1HG2      THR  21   2.077 -13.895  10.236
  191   HG23  THR  21          2HG2      THR  21   0.559 -14.193   9.390
  192    H    GLY  22           H        GLY  22   1.005 -14.368   5.748
  193    HA2  GLY  22           1HA      GLY  22   0.913 -17.218   6.201
  194    HA3  GLY  22           2HA      GLY  22  -0.517 -16.431   6.871
  Start of MODEL    7
    1    H1   PHE   1           1H       PHE   1  -2.895  15.279   0.210
    2    H2   PHE   1           2H       PHE   1  -3.589  15.469  -1.329
    3    H3   PHE   1           3H       PHE   1  -2.077  16.163  -0.985
    4    HA   PHE   1           HA       PHE   1  -2.744  13.400  -1.656
    5    HB2  PHE   1           1HB      PHE   1  -1.350  15.541  -2.709
    6    HB3  PHE   1           2HB      PHE   1  -0.062  14.557  -2.014
    7    HD1  PHE   1           HD2      PHE   1  -3.253  14.022  -3.929
    8    HD2  PHE   1           HD1      PHE   1   0.876  12.958  -3.412
    9    HE1  PHE   1           HE2      PHE   1  -3.418  12.453  -5.843
   10    HE2  PHE   1           HE1      PHE   1   0.713  11.389  -5.325
   11    HZ   PHE   1           HZ       PHE   1  -1.434  11.136  -6.540
   12    H    PHE   2           H        PHE   2  -1.141  15.190   0.869
   13    HA   PHE   2           HA       PHE   2   0.898  13.486   1.732
   14    HB2  PHE   2           1HB      PHE   2  -0.542  15.685   2.672
   15    HB3  PHE   2           2HB      PHE   2  -0.787  14.454   3.912
   16    HD1  PHE   2           HD1      PHE   2   1.847  16.176   1.904
   17    HD2  PHE   2           HD2      PHE   2   0.938  13.894   5.429
   18    HE1  PHE   2           HE1      PHE   2   4.146  16.565   2.749
   19    HE2  PHE   2           HE2      PHE   2   3.238  14.284   6.274
   20    HZ   PHE   2           HZ       PHE   2   4.841  15.619   4.934
   21    H    HIS   3           H        HIS   3  -2.596  13.172   2.284
   22    HA   HIS   3           HA       HIS   3  -2.516  10.943   4.062
   23    HB2  HIS   3           1HB      HIS   3  -4.879  10.655   3.196
   24    HB3  HIS   3           2HB      HIS   3  -4.499  12.288   3.742
   25    HD1  HIS   3           HD1      HIS   3  -5.158  10.275   0.644
   26    HD2  HIS   3           HD2      HIS   3  -4.331  14.231   1.661
   27    HE1  HIS   3           HE1      HIS   3  -5.599  11.656  -1.433
   28    H    HIS   4           H        HIS   4  -2.826  11.078   0.511
   29    HA   HIS   4           HA       HIS   4  -3.133   8.414  -0.170
   30    HB2  HIS   4           1HB      HIS   4  -1.817  10.802  -1.297
   31    HB3  HIS   4           2HB      HIS   4  -1.239   9.275  -1.963
   32    HD1  HIS   4           HD1      HIS   4  -2.533  10.247  -4.180
   33    HD2  HIS   4           HD2      HIS   4  -4.935   8.997  -1.011
   34    HE1  HIS   4           HE1      HIS   4  -4.857   9.917  -5.130
   35    H    ILE   5           H        ILE   5   0.082   9.942   0.124
   36    HA   ILE   5           HA       ILE   5   1.741   7.741  -0.013
   37    HB   ILE   5           HB       ILE   5   1.917   9.977   2.029
   38   HG12  ILE   5          1HG1      ILE   5   3.412  10.483  -0.360
   39   HG13  ILE   5          2HG1      ILE   5   1.754  10.096  -0.821
   40   HG21  ILE   5          1HG2      ILE   5   3.570   7.977   2.039
   41   HG22  ILE   5          2HG2      ILE   5   4.248   9.606   2.025
   42   HG23  ILE   5          3HG2      ILE   5   4.187   8.664   0.535
   43   HD11  ILE   5          3HD1      ILE   5   1.613  12.395  -0.422
   44   HD12  ILE   5          1HD1      ILE   5   2.758  12.331   0.918
   45   HD13  ILE   5          2HD1      ILE   5   1.115  11.725   1.132
   46    H    PHE   6           H        PHE   6   0.240   8.934   2.999
   47    HA   PHE   6           HA       PHE   6   1.120   6.991   4.799
   48    HB2  PHE   6           1HB      PHE   6  -0.194   8.945   5.417
   49    HB3  PHE   6           2HB      PHE   6  -1.582   8.339   4.514
   50    HD1  PHE   6           HD2      PHE   6  -2.914   6.462   5.345
   51    HD2  PHE   6           HD1      PHE   6   0.466   7.941   7.545
   52    HE1  PHE   6           HE2      PHE   6  -3.654   5.188   7.340
   53    HE2  PHE   6           HE1      PHE   6  -0.276   6.668   9.541
   54    HZ   PHE   6           HZ       PHE   6  -2.335   5.291   9.438
   55    H    ARG   7           H        ARG   7  -1.411   6.705   2.347
   56    HA   ARG   7           HA       ARG   7  -2.259   4.050   3.303
   57    HB2  ARG   7           1HB      ARG   7  -2.915   5.421   0.686
   58    HB3  ARG   7           2HB      ARG   7  -3.899   4.261   1.579
   59    HG2  ARG   7           1HG      ARG   7  -4.040   5.941   3.453
   60    HG3  ARG   7           2HG      ARG   7  -3.246   7.103   2.391
   61    HD2  ARG   7           1HD      ARG   7  -5.733   7.332   2.321
   62    HD3  ARG   7           2HD      ARG   7  -5.079   6.854   0.741
   63    HE   ARG   7           HE       ARG   7  -6.124   4.825   2.681
   64   HH11  ARG   7          1HH1      ARG   7  -4.722   4.400  -0.099
   65   HH12  ARG   7          2HH1      ARG   7  -6.102   3.958  -1.048
   66   HH21  ARG   7          1HH2      ARG   7  -8.402   5.040   1.310
   67   HH22  ARG   7          2HH2      ARG   7  -8.185   4.321  -0.252
   68    H    ALA   8           H        ALA   8  -0.593   5.376   0.426
   69    HA   ALA   8           HA       ALA   8  -0.116   2.923  -0.922
   70    HB1  ALA   8           3HB      ALA   8   1.174   5.637  -0.792
   71    HB2  ALA   8           1HB      ALA   8   0.281   4.895  -2.120
   72    HB3  ALA   8           2HB      ALA   8   1.924   4.366  -1.758
   73    H    ILE   9           H        ILE   9   1.834   4.596   1.564
   74    HA   ILE   9           HA       ILE   9   4.007   2.678   1.492
   75    HB   ILE   9           HB       ILE   9   4.106   5.062   2.263
   76   HG12  ILE   9          1HG1      ILE   9   4.906   2.898   4.231
   77   HG13  ILE   9          2HG1      ILE   9   5.896   3.582   2.940
   78   HG21  ILE   9          1HG2      ILE   9   2.773   4.048   4.781
   79   HG22  ILE   9          2HG2      ILE   9   1.878   4.868   3.502
   80   HG23  ILE   9          3HG2      ILE   9   3.166   5.714   4.359
   81   HD11  ILE   9          3HD1      ILE   9   5.299   5.857   4.222
   82   HD12  ILE   9          1HD1      ILE   9   6.677   4.861   4.689
   83   HD13  ILE   9          2HD1      ILE   9   5.162   4.746   5.586
   84    H    VAL  10           H        VAL  10   1.200   3.140   3.668
   85    HA   VAL  10           HA       VAL  10   1.858   0.865   5.350
   86    HB   VAL  10           HB       VAL  10   0.487   2.900   5.946
   87   HG11  VAL  10          1HG1      VAL  10  -1.832   2.996   5.201
   88   HG12  VAL  10          2HG1      VAL  10  -1.638   1.493   4.299
   89   HG13  VAL  10          3HG1      VAL  10  -0.778   2.946   3.787
   90   HG21  VAL  10          3HG2      VAL  10   0.267   0.315   6.840
   91   HG22  VAL  10          1HG2      VAL  10  -1.403   0.674   6.399
   92   HG23  VAL  10          2HG2      VAL  10  -0.562   1.690   7.569
   93    H    HIS  11           H        HIS  11   0.525   1.153   2.217
   94    HA   HIS  11           HA       HIS  11  -1.227  -1.189   2.328
   95    HB2  HIS  11           1HB      HIS  11  -0.441   0.948   0.497
   96    HB3  HIS  11           2HB      HIS  11  -0.594  -0.602  -0.327
   97    HD1  HIS  11           HD1      HIS  11  -2.915  -1.224  -0.985
   98    HD2  HIS  11           HD2      HIS  11  -2.898   1.479   2.189
   99    HE1  HIS  11           HE1      HIS  11  -5.339  -0.673  -0.500
  100    H    VAL  12           H        VAL  12   1.791  -0.522   0.497
  101    HA   VAL  12           HA       VAL  12   2.315  -3.154  -0.357
  102    HB   VAL  12           HB       VAL  12   3.478  -1.136  -1.131
  103   HG11  VAL  12          1HG1      VAL  12   4.833  -1.134   1.582
  104   HG12  VAL  12          2HG1      VAL  12   3.517  -0.047   1.138
  105   HG13  VAL  12          3HG1      VAL  12   5.058   0.039   0.284
  106   HG21  VAL  12          3HG2      VAL  12   5.621  -2.094  -1.376
  107   HG22  VAL  12          1HG2      VAL  12   4.587  -3.491  -1.070
  108   HG23  VAL  12          2HG2      VAL  12   5.577  -2.824   0.229
  109    H    ALA  13           H        ALA  13   3.337  -1.549   2.670
  110    HA   ALA  13           HA       ALA  13   4.836  -3.796   3.683
  111    HB1  ALA  13           3HB      ALA  13   4.389  -1.129   4.301
  112    HB2  ALA  13           1HB      ALA  13   5.326  -2.257   5.280
  113    HB3  ALA  13           2HB      ALA  13   3.622  -1.979   5.642
  114    H    LYS  14           H        LYS  14   1.820  -2.470   5.084
  115    HA   LYS  14           HA       LYS  14   1.063  -4.602   6.680
  116    HB2  LYS  14           1HB      LYS  14  -0.106  -2.464   6.561
  117    HB3  LYS  14           2HB      LYS  14  -0.637  -2.815   4.916
  118    HG2  LYS  14           1HG      LYS  14  -2.512  -3.405   6.200
  119    HG3  LYS  14           2HG      LYS  14  -1.697  -4.950   5.962
  120    HD2  LYS  14           1HD      LYS  14  -1.711  -5.163   8.211
  121    HD3  LYS  14           2HD      LYS  14  -0.479  -3.901   8.239
  122    HE2  LYS  14           1HE      LYS  14  -2.320  -2.184   8.304
  123    HE3  LYS  14           2HE      LYS  14  -3.483  -3.514   8.472
  124    HZ1  LYS  14           3HZ      LYS  14  -1.858  -4.294  10.309
  125    HZ2  LYS  14           1HZ      LYS  14  -2.967  -3.061  10.661
  126    HZ3  LYS  14           2HZ      LYS  14  -1.348  -2.674  10.321
  127    H    THR  15           H        THR  15   0.032  -4.199   3.269
  128    HA   THR  15           HA       THR  15  -1.414  -6.554   2.889
  129    HB   THR  15           HB       THR  15   0.602  -5.275   1.055
  130    HG1  THR  15           HG1      THR  15  -0.806  -3.717   1.671
  131   HG21  THR  15          3HG2      THR  15  -1.919  -6.481   0.054
  132   HG22  THR  15          1HG2      THR  15  -0.673  -7.599   0.613
  133   HG23  THR  15          2HG2      THR  15  -0.315  -6.453  -0.681
  134    H    ILE  16           H        ILE  16   1.971  -6.325   1.728
  135    HA   ILE  16           HA       ILE  16   2.488  -9.034   1.375
  136    HB   ILE  16           HB       ILE  16   4.195  -6.742   2.378
  137   HG12  ILE  16          1HG1      ILE  16   4.310  -8.185  -0.274
  138   HG13  ILE  16          2HG1      ILE  16   3.169  -6.869   0.006
  139   HG21  ILE  16          1HG2      ILE  16   5.562  -8.441   3.123
  140   HG22  ILE  16          2HG2      ILE  16   6.034  -8.449   1.424
  141   HG23  ILE  16          3HG2      ILE  16   4.863  -9.626   2.019
  142   HD11  ILE  16          3HD1      ILE  16   6.171  -6.784  -0.067
  143   HD12  ILE  16          1HD1      ILE  16   5.287  -5.585   0.876
  144   HD13  ILE  16          2HD1      ILE  16   5.008  -5.721  -0.860
  145    H    HIS  17           H        HIS  17   3.051  -7.185   4.391
  146    HA   HIS  17           HA       HIS  17   3.766  -9.437   5.997
  147    HB2  HIS  17           1HB      HIS  17   2.536  -6.720   6.542
  148    HB3  HIS  17           2HB      HIS  17   2.981  -7.823   7.844
  149    HD1  HIS  17           HD1      HIS  17   4.629  -6.262   4.769
  150    HD2  HIS  17           HD2      HIS  17   5.619  -7.556   8.607
  151    HE1  HIS  17           HE1      HIS  17   7.072  -5.689   5.111
  152    H    ARG  18           H        ARG  18   0.710  -8.218   4.809
  153    HA   ARG  18           HA       ARG  18  -0.927  -9.741   6.724
  154    HB2  ARG  18           1HB      ARG  18  -1.521  -7.560   5.545
  155    HB3  ARG  18           2HB      ARG  18  -1.678  -8.499   4.060
  156    HG2  ARG  18           1HG      ARG  18  -3.118  -9.751   6.254
  157    HG3  ARG  18           2HG      ARG  18  -3.669  -8.097   5.987
  158    HD2  ARG  18           1HD      ARG  18  -3.560  -8.899   3.419
  159    HD3  ARG  18           2HD      ARG  18  -3.875 -10.467   4.189
  160    HE   ARG  18           HE       ARG  18  -6.035  -9.681   4.713
  161   HH11  ARG  18          1HH1      ARG  18  -3.939  -7.107   3.816
  162   HH12  ARG  18          2HH1      ARG  18  -5.085  -5.862   4.181
  163   HH21  ARG  18          1HH2      ARG  18  -7.497  -8.059   5.356
  164   HH22  ARG  18          2HH2      ARG  18  -7.101  -6.401   5.053
  165    H    LEU  19           H        LEU  19  -0.081  -9.994   3.261
  166    HA   LEU  19           HA       LEU  19  -1.408 -12.546   2.892
  167    HB2  LEU  19           1HB      LEU  19  -0.969 -10.953   1.070
  168    HB3  LEU  19           2HB      LEU  19   0.767 -11.085   1.353
  169    HG   LEU  19           HG       LEU  19   0.582 -13.551   0.876
  170   HD11  LEU  19          1HD1      LEU  19  -1.857 -13.711   1.365
  171   HD12  LEU  19          2HD1      LEU  19  -1.447 -14.364  -0.220
  172   HD13  LEU  19          3HD1      LEU  19  -2.184 -12.768  -0.089
  173   HD21  LEU  19          3HD2      LEU  19   1.390 -12.646  -1.048
  174   HD22  LEU  19          1HD2      LEU  19   0.218 -11.328  -1.025
  175   HD23  LEU  19          2HD2      LEU  19  -0.240 -12.904  -1.670
  176    H    VAL  20           H        VAL  20   1.819 -11.490   3.843
  177    HA   VAL  20           HA       VAL  20   3.097 -14.081   3.555
  178    HB   VAL  20           HB       VAL  20   3.691 -11.488   4.989
  179   HG11  VAL  20          1HG1      VAL  20   4.669 -13.329   6.309
  180   HG12  VAL  20          2HG1      VAL  20   5.930 -12.405   5.489
  181   HG13  VAL  20          3HG1      VAL  20   5.429 -13.972   4.852
  182   HG21  VAL  20          3HG2      VAL  20   5.363 -12.763   2.851
  183   HG22  VAL  20          1HG2      VAL  20   5.106 -11.053   3.196
  184   HG23  VAL  20          2HG2      VAL  20   3.848 -11.989   2.389
  185    H    THR  21           H        THR  21   1.263 -12.469   6.098
  186    HA   THR  21           HA       THR  21   2.032 -14.368   8.190
  187    HB   THR  21           HB       THR  21  -0.033 -12.175   7.880
  188    HG1  THR  21           HG1      THR  21   2.187 -12.398   9.617
  189   HG21  THR  21          3HG2      THR  21  -1.175 -13.118   9.578
  190   HG22  THR  21          1HG2      THR  21   0.220 -12.762  10.597
  191   HG23  THR  21          2HG2      THR  21   0.073 -14.340   9.824
  192    H    GLY  22           H        GLY  22  -0.496 -14.112   5.773
  193    HA2  GLY  22           1HA      GLY  22  -2.183 -16.150   7.048
  194    HA3  GLY  22           2HA      GLY  22  -2.473 -15.400   5.478
  Start of MODEL    8
    1    H1   PHE   1           1H       PHE   1  -0.876  15.013  -2.946
    2    H2   PHE   1           2H       PHE   1  -0.852  13.319  -2.804
    3    H3   PHE   1           3H       PHE   1   0.366  14.254  -2.074
    4    HA   PHE   1           HA       PHE   1  -1.524  15.332  -0.740
    5    HB2  PHE   1           1HB      PHE   1  -2.808  13.398  -2.474
    6    HB3  PHE   1           2HB      PHE   1  -3.161  13.032  -0.785
    7    HD1  PHE   1           HD2      PHE   1  -3.252  15.584   0.544
    8    HD2  PHE   1           HD1      PHE   1  -4.623  14.551  -3.394
    9    HE1  PHE   1           HE2      PHE   1  -4.870  17.461   0.615
   10    HE2  PHE   1           HE1      PHE   1  -6.241  16.429  -3.322
   11    HZ   PHE   1           HZ       PHE   1  -6.365  17.884  -1.318
   12    H    PHE   2           H        PHE   2  -1.028  14.857   1.382
   13    HA   PHE   2           HA       PHE   2   0.908  13.054   2.219
   14    HB2  PHE   2           1HB      PHE   2  -0.437  14.947   3.418
   15    HB3  PHE   2           2HB      PHE   2  -1.525  13.644   3.893
   16    HD1  PHE   2           HD1      PHE   2   1.992  14.837   4.062
   17    HD2  PHE   2           HD2      PHE   2  -0.916  12.065   5.581
   18    HE1  PHE   2           HE1      PHE   2   3.553  14.194   5.879
   19    HE2  PHE   2           HE2      PHE   2   0.645  11.422   7.398
   20    HZ   PHE   2           HZ       PHE   2   2.879  12.487   7.547
   21    H    HIS   3           H        HIS   3  -2.612  12.479   2.180
   22    HA   HIS   3           HA       HIS   3  -2.655   9.859   3.219
   23    HB2  HIS   3           1HB      HIS   3  -4.607  11.313   2.742
   24    HB3  HIS   3           2HB      HIS   3  -4.334  11.094   1.013
   25    HD1  HIS   3           HD1      HIS   3  -4.424   8.590   3.901
   26    HD2  HIS   3           HD2      HIS   3  -6.187   9.231   0.179
   27    HE1  HIS   3           HE1      HIS   3  -5.938   6.606   3.475
   28    H    HIS   4           H        HIS   4  -2.293  10.899  -0.172
   29    HA   HIS   4           HA       HIS   4  -2.203   8.431  -1.480
   30    HB2  HIS   4           1HB      HIS   4  -1.292  11.165  -1.867
   31    HB3  HIS   4           2HB      HIS   4  -0.185  10.017  -2.619
   32    HD1  HIS   4           HD1      HIS   4  -0.836   9.952  -5.033
   33    HD2  HIS   4           HD2      HIS   4  -4.169   9.828  -2.533
   34    HE1  HIS   4           HE1      HIS   4  -2.847   9.611  -6.536
   35    H    ILE   5           H        ILE   5   0.766  10.183  -0.566
   36    HA   ILE   5           HA       ILE   5   2.604   8.104  -0.853
   37    HB   ILE   5           HB       ILE   5   2.562  10.189   1.348
   38   HG12  ILE   5          1HG1      ILE   5   4.036  11.093  -0.887
   39   HG13  ILE   5          2HG1      ILE   5   2.510  10.481  -1.529
   40   HG21  ILE   5          1HG2      ILE   5   4.471   8.913   1.726
   41   HG22  ILE   5          2HG2      ILE   5   5.095  10.119   0.600
   42   HG23  ILE   5          3HG2      ILE   5   4.664   8.511   0.018
   43   HD11  ILE   5          3HD1      ILE   5   1.671  11.851   0.701
   44   HD12  ILE   5          1HD1      ILE   5   1.675  12.507  -0.936
   45   HD13  ILE   5          2HD1      ILE   5   3.022  12.843   0.152
   46    H    PHE   6           H        PHE   6   0.945   8.993   2.184
   47    HA   PHE   6           HA       PHE   6   1.913   6.802   3.733
   48    HB2  PHE   6           1HB      PHE   6   0.027   8.983   3.904
   49    HB3  PHE   6           2HB      PHE   6  -0.678   7.532   4.616
   50    HD1  PHE   6           HD2      PHE   6   0.821   6.175   6.249
   51    HD2  PHE   6           HD1      PHE   6   1.578  10.252   5.131
   52    HE1  PHE   6           HE2      PHE   6   2.238   6.463   8.261
   53    HE2  PHE   6           HE1      PHE   6   2.997  10.540   7.144
   54    HZ   PHE   6           HZ       PHE   6   3.327   8.645   8.710
   55    H    ARG   7           H        ARG   7  -0.318   6.843   1.136
   56    HA   ARG   7           HA       ARG   7  -1.882   4.515   2.023
   57    HB2  ARG   7           1HB      ARG   7  -2.045   6.619   0.103
   58    HB3  ARG   7           2HB      ARG   7  -2.141   5.082  -0.752
   59    HG2  ARG   7           1HG      ARG   7  -3.846   4.335   0.911
   60    HG3  ARG   7           2HG      ARG   7  -3.868   5.979   1.547
   61    HD2  ARG   7           1HD      ARG   7  -4.725   5.018  -1.193
   62    HD3  ARG   7           2HD      ARG   7  -5.649   5.981  -0.024
   63    HE   ARG   7           HE       ARG   7  -3.810   7.764  -0.416
   64   HH11  ARG   7          1HH1      ARG   7  -5.864   7.876  -2.534
   65   HH12  ARG   7          2HH1      ARG   7  -4.931   7.735  -3.987
   66   HH21  ARG   7          1HH2      ARG   7  -2.116   6.509  -2.376
   67   HH22  ARG   7          2HH2      ARG   7  -2.810   6.960  -3.897
   68    H    ALA   8           H        ALA   8  -0.471   4.824  -1.173
   69    HA   ALA   8           HA       ALA   8   0.033   2.202  -1.785
   70    HB1  ALA   8           3HB      ALA   8   1.743   3.060  -3.287
   71    HB2  ALA   8           1HB      ALA   8   1.962   4.491  -2.279
   72    HB3  ALA   8           2HB      ALA   8   0.456   4.259  -3.167
   73    H    ILE   9           H        ILE   9   1.945   4.178   0.446
   74    HA   ILE   9           HA       ILE   9   4.091   2.201   0.685
   75    HB   ILE   9           HB       ILE   9   3.288   4.802   1.971
   76   HG12  ILE   9          1HG1      ILE   9   5.849   5.081   1.239
   77   HG13  ILE   9          2HG1      ILE   9   5.421   3.752   0.162
   78   HG21  ILE   9          1HG2      ILE   9   5.576   4.480   3.226
   79   HG22  ILE   9          2HG2      ILE   9   5.233   2.763   3.021
   80   HG23  ILE   9          3HG2      ILE   9   4.107   3.786   3.912
   81   HD11  ILE   9          3HD1      ILE   9   3.340   5.187  -0.430
   82   HD12  ILE   9          1HD1      ILE   9   4.897   5.669  -1.105
   83   HD13  ILE   9          2HD1      ILE   9   4.238   6.521   0.292
   84    H    VAL  10           H        VAL  10   1.244   3.151   2.608
   85    HA   VAL  10           HA       VAL  10   1.836   1.285   4.772
   86    HB   VAL  10           HB       VAL  10  -0.509   2.990   3.922
   87   HG11  VAL  10          1HG1      VAL  10  -0.293   1.140   6.314
   88   HG12  VAL  10          2HG1      VAL  10  -1.459   1.021   4.996
   89   HG13  VAL  10          3HG1      VAL  10  -1.534   2.377   6.121
   90   HG21  VAL  10          3HG2      VAL  10   1.305   3.067   6.354
   91   HG22  VAL  10          1HG2      VAL  10   0.093   4.271   5.910
   92   HG23  VAL  10          2HG2      VAL  10   1.530   4.055   4.910
   93    H    HIS  11           H        HIS  11  -0.565   1.353   2.111
   94    HA   HIS  11           HA       HIS  11  -1.818  -1.132   2.642
   95    HB2  HIS  11           1HB      HIS  11  -1.462   0.760   0.397
   96    HB3  HIS  11           2HB      HIS  11  -1.887  -0.882  -0.083
   97    HD1  HIS  11           HD1      HIS  11  -4.143  -1.862   0.908
   98    HD2  HIS  11           HD2      HIS  11  -3.540   2.200   1.626
   99    HE1  HIS  11           HE1      HIS  11  -6.376  -0.926   1.652
  100    H    VAL  12           H        VAL  12   1.035  -0.416   0.599
  101    HA   VAL  12           HA       VAL  12   1.473  -3.077  -0.340
  102    HB   VAL  12           HB       VAL  12   2.497  -1.037  -1.268
  103   HG11  VAL  12          1HG1      VAL  12   4.130  -0.992   1.288
  104   HG12  VAL  12          2HG1      VAL  12   2.794   0.106   0.938
  105   HG13  VAL  12          3HG1      VAL  12   4.251   0.144  -0.054
  106   HG21  VAL  12          3HG2      VAL  12   4.758  -1.898  -1.564
  107   HG22  VAL  12          1HG2      VAL  12   3.632  -3.256  -1.534
  108   HG23  VAL  12          2HG2      VAL  12   4.606  -2.885  -0.110
  109    H    ALA  13           H        ALA  13   2.767  -1.368   2.521
  110    HA   ALA  13           HA       ALA  13   4.344  -3.637   3.427
  111    HB1  ALA  13           3HB      ALA  13   5.212  -1.920   4.606
  112    HB2  ALA  13           1HB      ALA  13   3.709  -1.791   5.520
  113    HB3  ALA  13           2HB      ALA  13   3.915  -0.873   4.028
  114    H    LYS  14           H        LYS  14   1.516  -2.044   4.958
  115    HA   LYS  14           HA       LYS  14   0.874  -3.882   6.914
  116    HB2  LYS  14           1HB      LYS  14  -0.337  -1.811   6.561
  117    HB3  LYS  14           2HB      LYS  14  -0.924  -2.372   4.994
  118    HG2  LYS  14           1HG      LYS  14  -2.620  -2.580   6.840
  119    HG3  LYS  14           2HG      LYS  14  -2.248  -4.109   6.042
  120    HD2  LYS  14           1HD      LYS  14  -2.252  -4.473   8.444
  121    HD3  LYS  14           2HD      LYS  14  -0.591  -4.591   7.861
  122    HE2  LYS  14           1HE      LYS  14  -0.023  -2.439   8.709
  123    HE3  LYS  14           2HE      LYS  14  -1.727  -1.994   8.935
  124    HZ1  LYS  14           3HZ      LYS  14  -1.306  -2.725  11.025
  125    HZ2  LYS  14           1HZ      LYS  14  -0.040  -3.747  10.545
  126    HZ3  LYS  14           2HZ      LYS  14  -1.654  -4.235  10.329
  127    H    THR  15           H        THR  15  -0.645  -4.010   3.662
  128    HA   THR  15           HA       THR  15  -1.846  -6.548   3.898
  129    HB   THR  15           HB       THR  15  -0.525  -5.551   1.406
  130    HG1  THR  15           HG1      THR  15  -1.428  -3.706   1.981
  131   HG21  THR  15          3HG2      THR  15  -2.263  -7.616   1.924
  132   HG22  THR  15          1HG2      THR  15  -2.036  -6.860   0.346
  133   HG23  THR  15          2HG2      THR  15  -3.352  -6.333   1.396
  134    H    ILE  16           H        ILE  16   1.339  -5.796   2.402
  135    HA   ILE  16           HA       ILE  16   2.221  -8.349   1.753
  136    HB   ILE  16           HB       ILE  16   3.480  -5.829   2.780
  137   HG12  ILE  16          1HG1      ILE  16   2.898  -6.057   0.415
  138   HG13  ILE  16          2HG1      ILE  16   4.654  -6.026   0.586
  139   HG21  ILE  16          1HG2      ILE  16   5.094  -7.079   3.832
  140   HG22  ILE  16          2HG2      ILE  16   5.714  -7.231   2.187
  141   HG23  ILE  16          3HG2      ILE  16   4.738  -8.525   2.884
  142   HD11  ILE  16          3HD1      ILE  16   3.011  -8.089  -0.549
  143   HD12  ILE  16          1HD1      ILE  16   3.831  -8.730   0.876
  144   HD13  ILE  16          2HD1      ILE  16   4.771  -8.024  -0.439
  145    H    HIS  17           H        HIS  17   2.979  -6.794   4.880
  146    HA   HIS  17           HA       HIS  17   3.828  -9.113   6.243
  147    HB2  HIS  17           1HB      HIS  17   4.038  -6.776   7.047
  148    HB3  HIS  17           2HB      HIS  17   2.290  -6.696   7.262
  149    HD1  HIS  17           HD1      HIS  17   1.376  -7.529   9.450
  150    HD2  HIS  17           HD2      HIS  17   5.295  -8.799   8.812
  151    HE1  HIS  17           HE1      HIS  17   2.114  -8.675  11.584
  152    H    ARG  18           H        ARG  18   0.625  -8.076   5.281
  153    HA   ARG  18           HA       ARG  18  -0.779  -9.885   7.129
  154    HB2  ARG  18           1HB      ARG  18  -1.500  -7.635   5.946
  155    HB3  ARG  18           2HB      ARG  18  -1.918  -8.702   4.605
  156    HG2  ARG  18           1HG      ARG  18  -2.869  -9.757   7.147
  157    HG3  ARG  18           2HG      ARG  18  -3.515  -8.147   6.829
  158    HD2  ARG  18           1HD      ARG  18  -4.841  -8.904   5.143
  159    HD3  ARG  18           2HD      ARG  18  -3.537  -9.896   4.461
  160    HE   ARG  18           HE       ARG  18  -4.199 -11.177   6.839
  161   HH11  ARG  18          1HH1      ARG  18  -5.547 -10.471   3.764
  162   HH12  ARG  18          2HH1      ARG  18  -6.861 -11.589   3.926
  163   HH21  ARG  18          1HH2      ARG  18  -6.034 -12.496   7.171
  164   HH22  ARG  18          2HH2      ARG  18  -7.137 -12.735   5.856
  165    H    LEU  19           H        LEU  19  -0.103  -9.787   3.619
  166    HA   LEU  19           HA       LEU  19  -1.183 -12.416   3.084
  167    HB2  LEU  19           1HB      LEU  19  -0.914 -10.622   1.402
  168    HB3  LEU  19           2HB      LEU  19   0.836 -10.686   1.614
  169    HG   LEU  19           HG       LEU  19  -0.527 -13.256   0.987
  170   HD11  LEU  19          1HD1      LEU  19  -1.157 -12.758  -1.150
  171   HD12  LEU  19          2HD1      LEU  19   0.168 -11.616  -1.378
  172   HD13  LEU  19          3HD1      LEU  19  -1.288 -11.116  -0.518
  173   HD21  LEU  19          3HD2      LEU  19   1.982 -12.841   1.336
  174   HD22  LEU  19          1HD2      LEU  19   1.951 -11.998  -0.213
  175   HD23  LEU  19          2HD2      LEU  19   1.533 -13.710  -0.131
  176    H    VAL  20           H        VAL  20   1.990 -11.129   3.958
  177    HA   VAL  20           HA       VAL  20   3.522 -13.515   3.475
  178    HB   VAL  20           HB       VAL  20   3.787 -11.062   5.219
  179   HG11  VAL  20          1HG1      VAL  20   5.380 -13.569   5.246
  180   HG12  VAL  20          2HG1      VAL  20   5.155 -12.365   6.514
  181   HG13  VAL  20          3HG1      VAL  20   6.301 -12.064   5.208
  182   HG21  VAL  20          3HG2      VAL  20   4.196 -10.488   2.985
  183   HG22  VAL  20          1HG2      VAL  20   4.911 -12.056   2.611
  184   HG23  VAL  20          2HG2      VAL  20   5.817 -10.877   3.558
  185    H    THR  21           H        THR  21   1.544 -12.401   6.178
  186    HA   THR  21           HA       THR  21   2.441 -14.506   8.007
  187    HB   THR  21           HB       THR  21   0.179 -12.487   7.987
  188    HG1  THR  21           HG1      THR  21   2.022 -11.433   8.337
  189   HG21  THR  21          3HG2      THR  21  -0.169 -13.059  10.341
  190   HG22  THR  21          1HG2      THR  21   1.090 -14.290  10.246
  191   HG23  THR  21          2HG2      THR  21  -0.408 -14.489   9.337
  192    H    GLY  22           H        GLY  22  -0.133 -14.065   5.657
  193    HA2  GLY  22           1HA      GLY  22  -0.726 -16.810   5.393
  194    HA3  GLY  22           2HA      GLY  22  -1.869 -16.157   6.567
  Start of MODEL    9
    1    H1   PHE   1           1H       PHE   1  -2.975  11.768  -2.392
    2    H2   PHE   1           2H       PHE   1  -1.496  11.317  -3.095
    3    H3   PHE   1           3H       PHE   1  -2.510  12.431  -3.883
    4    HA   PHE   1           HA       PHE   1  -0.721  13.651  -2.871
    5    HB2  PHE   1           1HB      PHE   1  -3.545  13.834  -2.271
    6    HB3  PHE   1           2HB      PHE   1  -2.604  14.503  -0.937
    7    HD1  PHE   1           HD1      PHE   1  -0.240  15.599  -2.246
    8    HD2  PHE   1           HD2      PHE   1  -4.340  15.652  -3.527
    9    HE1  PHE   1           HE1      PHE   1   0.204  17.642  -3.581
   10    HE2  PHE   1           HE2      PHE   1  -3.896  17.694  -4.863
   11    HZ   PHE   1           HZ       PHE   1  -1.625  18.690  -4.889
   12    H    PHE   2           H        PHE   2  -0.912  14.544  -0.137
   13    HA   PHE   2           HA       PHE   2   0.933  12.907   1.197
   14    HB2  PHE   2           1HB      PHE   2  -0.847  15.139   1.753
   15    HB3  PHE   2           2HB      PHE   2  -0.655  14.106   3.170
   16    HD1  PHE   2           HD1      PHE   2   1.674  13.536   3.979
   17    HD2  PHE   2           HD2      PHE   2   0.924  16.542   1.004
   18    HE1  PHE   2           HE1      PHE   2   3.933  14.484   4.368
   19    HE2  PHE   2           HE2      PHE   2   3.182  17.491   1.394
   20    HZ   PHE   2           HZ       PHE   2   4.686  16.462   3.076
   21    H    HIS   3           H        HIS   3  -2.524  13.100   2.069
   22    HA   HIS   3           HA       HIS   3  -2.720  10.961   3.815
   23    HB2  HIS   3           1HB      HIS   3  -5.080  10.770   2.781
   24    HB3  HIS   3           2HB      HIS   3  -4.605  12.348   3.404
   25    HD1  HIS   3           HD1      HIS   3  -4.446  10.476   0.075
   26    HD2  HIS   3           HD2      HIS   3  -4.943  14.348   1.535
   27    HE1  HIS   3           HE1      HIS   3  -4.853  11.954  -1.941
   28    H    HIS   4           H        HIS   4  -2.301  10.818   0.326
   29    HA   HIS   4           HA       HIS   4  -3.008   8.005   0.061
   30    HB2  HIS   4           1HB      HIS   4  -2.059  10.259  -1.569
   31    HB3  HIS   4           2HB      HIS   4  -1.433   8.696  -2.096
   32    HD1  HIS   4           HD1      HIS   4  -2.978   8.679  -4.201
   33    HD2  HIS   4           HD2      HIS   4  -5.046   8.831  -0.586
   34    HE1  HIS   4           HE1      HIS   4  -5.400   8.175  -4.741
   35    H    ILE   5           H        ILE   5  -0.063   9.782   0.799
   36    HA   ILE   5           HA       ILE   5   1.798   7.645   0.204
   37    HB   ILE   5           HB       ILE   5   3.386   9.091   1.176
   38   HG12  ILE   5          1HG1      ILE   5   2.507  10.930   2.831
   39   HG13  ILE   5          2HG1      ILE   5   1.137   9.841   3.029
   40   HG21  ILE   5          1HG2      ILE   5   2.923  11.199   0.275
   41   HG22  ILE   5          2HG2      ILE   5   1.222  11.123   0.734
   42   HG23  ILE   5          3HG2      ILE   5   1.813  10.157  -0.616
   43   HD11  ILE   5          3HD1      ILE   5   2.342   8.418   4.298
   44   HD12  ILE   5          1HD1      ILE   5   3.587   9.667   4.359
   45   HD13  ILE   5          2HD1      ILE   5   3.666   8.402   3.132
   46    H    PHE   6           H        PHE   6  -0.163   8.533   2.967
   47    HA   PHE   6           HA       PHE   6   1.062   6.705   4.861
   48    HB2  PHE   6           1HB      PHE   6  -1.496   8.289   4.648
   49    HB3  PHE   6           2HB      PHE   6  -1.234   7.187   6.000
   50    HD1  PHE   6           HD1      PHE   6   1.047   7.417   7.256
   51    HD2  PHE   6           HD2      PHE   6  -0.652  10.471   4.761
   52    HE1  PHE   6           HE1      PHE   6   2.452   9.119   8.382
   53    HE2  PHE   6           HE2      PHE   6   0.756  12.174   5.886
   54    HZ   PHE   6           HZ       PHE   6   2.309  11.498   7.698
   55    H    ARG   7           H        ARG   7  -1.424   6.428   2.397
   56    HA   ARG   7           HA       ARG   7  -2.442   3.861   3.420
   57    HB2  ARG   7           1HB      ARG   7  -2.893   5.129   0.710
   58    HB3  ARG   7           2HB      ARG   7  -3.981   4.070   1.608
   59    HG2  ARG   7           1HG      ARG   7  -3.468   6.228   3.333
   60    HG3  ARG   7           2HG      ARG   7  -3.720   6.953   1.745
   61    HD2  ARG   7           1HD      ARG   7  -5.627   4.792   2.424
   62    HD3  ARG   7           2HD      ARG   7  -5.770   6.262   3.409
   63    HE   ARG   7           HE       ARG   7  -5.924   7.548   1.268
   64   HH11  ARG   7          1HH1      ARG   7  -5.038   4.812  -0.112
   65   HH12  ARG   7          2HH1      ARG   7  -6.484   4.496  -1.010
   66   HH21  ARG   7          1HH2      ARG   7  -8.371   6.859   0.685
   67   HH22  ARG   7          2HH2      ARG   7  -8.371   5.653  -0.560
   68    H    ALA   8           H        ALA   8  -0.586   4.970   0.565
   69    HA   ALA   8           HA       ALA   8  -0.135   2.457  -0.650
   70    HB1  ALA   8           3HB      ALA   8   0.965   5.172  -0.660
   71    HB2  ALA   8           1HB      ALA   8   0.705   4.069  -2.010
   72    HB3  ALA   8           2HB      ALA   8   2.178   3.952  -1.047
   73    H    ILE   9           H        ILE   9   2.026   4.187   1.639
   74    HA   ILE   9           HA       ILE   9   3.966   2.141   1.934
   75    HB   ILE   9           HB       ILE   9   2.914   4.243   3.853
   76   HG12  ILE   9          1HG1      ILE   9   5.416   4.304   2.154
   77   HG13  ILE   9          2HG1      ILE   9   3.870   4.919   1.568
   78   HG21  ILE   9          1HG2      ILE   9   4.147   2.668   5.169
   79   HG22  ILE   9          2HG2      ILE   9   5.253   4.003   4.843
   80   HG23  ILE   9          3HG2      ILE   9   5.388   2.503   3.927
   81   HD11  ILE   9          3HD1      ILE   9   3.748   6.441   3.518
   82   HD12  ILE   9          1HD1      ILE   9   5.193   6.741   2.553
   83   HD13  ILE   9          2HD1      ILE   9   5.314   5.846   4.068
   84    H    VAL  10           H        VAL  10   1.073   2.804   3.943
   85    HA   VAL  10           HA       VAL  10   1.355   0.669   5.779
   86    HB   VAL  10           HB       VAL  10  -0.953   2.198   4.578
   87   HG11  VAL  10          1HG1      VAL  10  -2.428   1.141   6.268
   88   HG12  VAL  10          2HG1      VAL  10  -1.117   0.049   6.715
   89   HG13  VAL  10          3HG1      VAL  10  -1.827  -0.038   5.102
   90   HG21  VAL  10          3HG2      VAL  10   0.167   2.043   7.394
   91   HG22  VAL  10          1HG2      VAL  10  -1.038   3.187   6.805
   92   HG23  VAL  10          2HG2      VAL  10   0.620   3.268   6.209
   93    H    HIS  11           H        HIS  11  -0.266   0.729   2.597
   94    HA   HIS  11           HA       HIS  11  -1.276  -1.932   2.615
   95    HB2  HIS  11           1HB      HIS  11  -0.918   0.296   0.819
   96    HB3  HIS  11           2HB      HIS  11  -0.514  -1.202  -0.019
   97    HD1  HIS  11           HD1      HIS  11  -2.453  -2.530  -0.870
   98    HD2  HIS  11           HD2      HIS  11  -3.595   0.093   2.163
   99    HE1  HIS  11           HE1      HIS  11  -4.971  -2.718  -0.670
  100    H    VAL  12           H        VAL  12   1.565  -0.839   0.713
  101    HA   VAL  12           HA       VAL  12   2.657  -3.279   0.019
  102    HB   VAL  12           HB       VAL  12   3.564  -1.121  -0.660
  103   HG11  VAL  12          1HG1      VAL  12   3.150   0.053   1.482
  104   HG12  VAL  12          2HG1      VAL  12   4.804   0.291   0.922
  105   HG13  VAL  12          3HG1      VAL  12   4.471  -0.851   2.223
  106   HG21  VAL  12          3HG2      VAL  12   5.057  -3.279  -0.262
  107   HG22  VAL  12          1HG2      VAL  12   5.811  -2.260   0.964
  108   HG23  VAL  12          2HG2      VAL  12   5.799  -1.748  -0.724
  109    H    ALA  13           H        ALA  13   3.056  -1.626   3.159
  110    HA   ALA  13           HA       ALA  13   4.769  -3.707   4.268
  111    HB1  ALA  13           3HB      ALA  13   3.420  -2.116   6.246
  112    HB2  ALA  13           1HB      ALA  13   3.849  -1.081   4.884
  113    HB3  ALA  13           2HB      ALA  13   5.098  -2.006   5.717
  114    H    LYS  14           H        LYS  14   1.466  -2.651   5.204
  115    HA   LYS  14           HA       LYS  14   0.811  -4.870   6.819
  116    HB2  LYS  14           1HB      LYS  14  -0.502  -2.825   6.709
  117    HB3  LYS  14           2HB      LYS  14  -0.868  -3.106   5.007
  118    HG2  LYS  14           1HG      LYS  14  -2.712  -4.216   5.668
  119    HG3  LYS  14           2HG      LYS  14  -1.648  -5.462   6.321
  120    HD2  LYS  14           1HD      LYS  14  -3.138  -4.689   8.089
  121    HD3  LYS  14           2HD      LYS  14  -1.495  -4.158   8.448
  122    HE2  LYS  14           1HE      LYS  14  -2.064  -1.945   7.346
  123    HE3  LYS  14           2HE      LYS  14  -3.753  -2.489   7.299
  124    HZ1  LYS  14           3HZ      LYS  14  -2.201  -2.720   9.791
  125    HZ2  LYS  14           1HZ      LYS  14  -3.880  -2.600   9.585
  126    HZ3  LYS  14           2HZ      LYS  14  -2.900  -1.228   9.376
  127    H    THR  15           H        THR  15  -0.046  -4.388   3.369
  128    HA   THR  15           HA       THR  15  -1.255  -6.843   2.807
  129    HB   THR  15           HB       THR  15   0.770  -5.502   1.040
  130    HG1  THR  15           HG1      THR  15  -0.669  -3.910   0.669
  131   HG21  THR  15          3HG2      THR  15  -0.264  -6.588  -0.662
  132   HG22  THR  15          1HG2      THR  15  -1.869  -6.300   0.013
  133   HG23  THR  15          2HG2      THR  15  -0.887  -7.637   0.614
  134    H    ILE  16           H        ILE  16   2.216  -6.174   2.117
  135    HA   ILE  16           HA       ILE  16   3.062  -8.773   1.559
  136    HB   ILE  16           HB       ILE  16   4.389  -6.545   3.141
  137   HG12  ILE  16          1HG1      ILE  16   4.742  -7.404   0.254
  138   HG13  ILE  16          2HG1      ILE  16   3.663  -6.103   0.763
  139   HG21  ILE  16          1HG2      ILE  16   5.250  -9.174   3.023
  140   HG22  ILE  16          2HG2      ILE  16   6.282  -7.776   3.326
  141   HG23  ILE  16          3HG2      ILE  16   6.122  -8.416   1.691
  142   HD11  ILE  16          3HD1      ILE  16   6.670  -6.227   0.952
  143   HD12  ILE  16          1HD1      ILE  16   5.735  -5.126   1.965
  144   HD13  ILE  16          2HD1      ILE  16   5.666  -4.983   0.207
  145    H    HIS  17           H        HIS  17   2.926  -7.225   4.778
  146    HA   HIS  17           HA       HIS  17   3.609  -9.562   6.280
  147    HB2  HIS  17           1HB      HIS  17   2.422  -6.878   6.698
  148    HB3  HIS  17           2HB      HIS  17   1.990  -8.075   7.920
  149    HD1  HIS  17           HD1      HIS  17   5.113  -6.698   6.221
  150    HD2  HIS  17           HD2      HIS  17   3.976  -8.495   9.806
  151    HE1  HIS  17           HE1      HIS  17   7.159  -6.680   7.711
  152    H    ARG  18           H        ARG  18   0.653  -8.476   4.731
  153    HA   ARG  18           HA       ARG  18  -1.078 -10.364   6.180
  154    HB2  ARG  18           1HB      ARG  18  -1.555  -8.054   4.984
  155    HB3  ARG  18           2HB      ARG  18  -1.707  -9.058   3.542
  156    HG2  ARG  18           1HG      ARG  18  -3.291 -10.522   4.979
  157    HG3  ARG  18           2HG      ARG  18  -3.361  -9.131   6.061
  158    HD2  ARG  18           1HD      ARG  18  -3.738  -7.978   3.564
  159    HD3  ARG  18           2HD      ARG  18  -4.643  -9.501   3.452
  160    HE   ARG  18           HE       ARG  18  -5.492  -7.285   4.992
  161   HH11  ARG  18          1HH1      ARG  18  -5.176 -10.703   5.036
  162   HH12  ARG  18          2HH1      ARG  18  -6.177 -10.919   6.432
  163   HH21  ARG  18          1HH2      ARG  18  -6.654  -7.521   6.940
  164   HH22  ARG  18          2HH2      ARG  18  -7.014  -9.116   7.511
  165    H    LEU  19           H        LEU  19   0.338 -10.115   2.911
  166    HA   LEU  19           HA       LEU  19  -0.643 -12.687   2.013
  167    HB2  LEU  19           1HB      LEU  19   1.434 -10.674   1.156
  168    HB3  LEU  19           2HB      LEU  19   1.298 -12.220   0.316
  169    HG   LEU  19           HG       LEU  19  -1.094 -10.433   0.781
  170   HD11  LEU  19          1HD1      LEU  19   0.011 -10.471  -1.931
  171   HD12  LEU  19          2HD1      LEU  19   1.103  -9.726  -0.763
  172   HD13  LEU  19          3HD1      LEU  19  -0.535  -9.102  -0.962
  173   HD21  LEU  19          3HD2      LEU  19  -2.062 -12.339   0.010
  174   HD22  LEU  19          1HD2      LEU  19  -0.522 -12.996  -0.545
  175   HD23  LEU  19          2HD2      LEU  19  -1.414 -11.863  -1.560
  176    H    VAL  20           H        VAL  20   2.264 -11.532   3.653
  177    HA   VAL  20           HA       VAL  20   3.846 -13.918   3.372
  178    HB   VAL  20           HB       VAL  20   3.732 -11.564   5.260
  179   HG11  VAL  20          1HG1      VAL  20   4.538 -13.484   6.577
  180   HG12  VAL  20          2HG1      VAL  20   5.858 -12.361   6.248
  181   HG13  VAL  20          3HG1      VAL  20   5.720 -13.855   5.322
  182   HG21  VAL  20          3HG2      VAL  20   4.582 -11.221   2.965
  183   HG22  VAL  20          1HG2      VAL  20   5.756 -12.514   3.206
  184   HG23  VAL  20          2HG2      VAL  20   5.874 -11.027   4.148
  185    H    THR  21           H        THR  21   1.291 -12.952   5.605
  186    HA   THR  21           HA       THR  21   1.759 -15.169   7.463
  187    HB   THR  21           HB       THR  21  -0.337 -13.036   7.042
  188    HG1  THR  21           HG1      THR  21   1.765 -13.586   8.798
  189   HG21  THR  21          3HG2      THR  21  -1.133 -13.962   9.379
  190   HG22  THR  21          1HG2      THR  21  -0.441 -15.472   8.786
  191   HG23  THR  21          2HG2      THR  21  -1.740 -14.686   7.889
  192    H    GLY  22           H        GLY  22  -0.274 -14.534   4.656
  193    HA2  GLY  22           1HA      GLY  22  -1.758 -15.921   3.477
  194    HA3  GLY  22           2HA      GLY  22  -0.721 -17.243   4.017
  Start of MODEL   10
    1    H1   PHE   1           1H       PHE   1  -2.589  16.046  -1.969
    2    H2   PHE   1           2H       PHE   1  -1.384  15.880  -0.783
    3    H3   PHE   1           3H       PHE   1  -2.967  15.349  -0.469
    4    HA   PHE   1           HA       PHE   1  -2.775  13.602  -2.106
    5    HB2  PHE   1           1HB      PHE   1  -0.475  13.436  -3.214
    6    HB3  PHE   1           2HB      PHE   1  -1.468  14.801  -3.723
    7    HD1  PHE   1           HD1      PHE   1  -0.991  17.085  -2.913
    8    HD2  PHE   1           HD2      PHE   1   1.526  13.759  -1.888
    9    HE1  PHE   1           HE1      PHE   1   0.782  18.654  -2.173
   10    HE2  PHE   1           HE2      PHE   1   3.298  15.328  -1.148
   11    HZ   PHE   1           HZ       PHE   1   2.926  17.775  -1.291
   12    H    PHE   2           H        PHE   2  -1.323  14.715   0.675
   13    HA   PHE   2           HA       PHE   2   0.616  12.711   1.303
   14    HB2  PHE   2           1HB      PHE   2  -0.718  14.931   2.506
   15    HB3  PHE   2           2HB      PHE   2  -0.842  13.570   3.621
   16    HD1  PHE   2           HD2      PHE   2   1.718  15.049   1.298
   17    HD2  PHE   2           HD1      PHE   2   0.892  13.328   5.146
   18    HE1  PHE   2           HE2      PHE   2   4.092  15.360   1.946
   19    HE2  PHE   2           HE1      PHE   2   3.266  13.639   5.795
   20    HZ   PHE   2           HZ       PHE   2   4.866  14.655   4.194
   21    H    HIS   3           H        HIS   3  -2.901  12.723   1.439
   22    HA   HIS   3           HA       HIS   3  -3.292  10.456   3.140
   23    HB2  HIS   3           1HB      HIS   3  -4.885  11.614   0.831
   24    HB3  HIS   3           2HB      HIS   3  -5.518  10.431   1.975
   25    HD1  HIS   3           HD1      HIS   3  -4.412  11.507   4.610
   26    HD2  HIS   3           HD2      HIS   3  -6.102  13.958   1.692
   27    HE1  HIS   3           HE1      HIS   3  -5.161  13.618   5.793
   28    H    HIS   4           H        HIS   4  -2.560  10.762  -0.296
   29    HA   HIS   4           HA       HIS   4  -3.107   8.010  -1.009
   30    HB2  HIS   4           1HB      HIS   4  -2.152  10.480  -2.178
   31    HB3  HIS   4           2HB      HIS   4  -1.164   9.123  -2.720
   32    HD1  HIS   4           HD1      HIS   4  -2.088   7.929  -4.695
   33    HD2  HIS   4           HD2      HIS   4  -5.107   9.732  -2.456
   34    HE1  HIS   4           HE1      HIS   4  -4.256   7.477  -5.922
   35    H    ILE   5           H        ILE   5   0.056   9.642  -1.018
   36    HA   ILE   5           HA       ILE   5   1.786   7.508  -1.020
   37    HB   ILE   5           HB       ILE   5   1.960   9.936   0.789
   38   HG12  ILE   5          1HG1      ILE   5   3.338  10.269  -1.689
   39   HG13  ILE   5          2HG1      ILE   5   1.693   9.745  -2.052
   40   HG21  ILE   5          1HG2      ILE   5   4.410   9.700   0.292
   41   HG22  ILE   5          2HG2      ILE   5   4.054   8.171  -0.511
   42   HG23  ILE   5          3HG2      ILE   5   3.746   8.354   1.216
   43   HD11  ILE   5          3HD1      ILE   5   2.640  12.282  -0.890
   44   HD12  ILE   5          1HD1      ILE   5   1.261  11.570  -0.050
   45   HD13  ILE   5          2HD1      ILE   5   1.153  11.933  -1.772
   46    H    PHE   6           H        PHE   6   0.253   8.872   1.880
   47    HA   PHE   6           HA       PHE   6   1.351   7.020   3.764
   48    HB2  PHE   6           1HB      PHE   6  -0.091   9.312   3.840
   49    HB3  PHE   6           2HB      PHE   6  -1.365   8.145   4.195
   50    HD1  PHE   6           HD2      PHE   6   1.819   9.595   5.344
   51    HD2  PHE   6           HD1      PHE   6  -1.303   6.778   6.220
   52    HE1  PHE   6           HE2      PHE   6   2.647   9.402   7.673
   53    HE2  PHE   6           HE1      PHE   6  -0.475   6.585   8.549
   54    HZ   PHE   6           HZ       PHE   6   1.500   7.897   9.276
   55    H    ARG   7           H        ARG   7  -1.610   6.910   1.791
   56    HA   ARG   7           HA       ARG   7  -2.481   4.404   3.063
   57    HB2  ARG   7           1HB      ARG   7  -4.467   4.822   1.932
   58    HB3  ARG   7           2HB      ARG   7  -3.816   6.452   2.024
   59    HG2  ARG   7           1HG      ARG   7  -2.972   6.309  -0.241
   60    HG3  ARG   7           2HG      ARG   7  -3.397   4.601  -0.341
   61    HD2  ARG   7           1HD      ARG   7  -5.309   6.951  -0.119
   62    HD3  ARG   7           2HD      ARG   7  -5.156   5.809  -1.469
   63    HE   ARG   7           HE       ARG   7  -5.845   4.015   0.206
   64   HH11  ARG   7          1HH1      ARG   7  -5.795   6.181   2.443
   65   HH12  ARG   7          2HH1      ARG   7  -7.496   6.398   2.689
   66   HH21  ARG   7          1HH2      ARG   7  -8.393   4.787  -0.248
   67   HH22  ARG   7          2HH2      ARG   7  -8.967   5.608   1.165
   68    H    ALA   8           H        ALA   8  -0.561   5.370   0.338
   69    HA   ALA   8           HA       ALA   8  -0.867   2.867  -1.153
   70    HB1  ALA   8           3HB      ALA   8   0.547   5.461  -1.339
   71    HB2  ALA   8           1HB      ALA   8  -0.248   4.524  -2.604
   72    HB3  ALA   8           2HB      ALA   8   1.387   4.106  -2.092
   73    H    ILE   9           H        ILE   9   1.642   4.332   0.934
   74    HA   ILE   9           HA       ILE   9   3.416   2.032   0.756
   75    HB   ILE   9           HB       ILE   9   4.654   3.309   2.474
   76   HG12  ILE   9          1HG1      ILE   9   3.384   5.658   2.882
   77   HG13  ILE   9          2HG1      ILE   9   1.985   4.592   2.755
   78   HG21  ILE   9          1HG2      ILE   9   4.167   5.658   1.052
   79   HG22  ILE   9          2HG2      ILE   9   3.717   4.376  -0.073
   80   HG23  ILE   9          3HG2      ILE   9   5.336   4.409   0.625
   81   HD11  ILE   9          3HD1      ILE   9   2.933   3.123   4.488
   82   HD12  ILE   9          1HD1      ILE   9   2.765   4.770   5.096
   83   HD13  ILE   9          2HD1      ILE   9   4.349   4.167   4.607
   84    H    VAL  10           H        VAL  10   0.884   3.111   2.983
   85    HA   VAL  10           HA       VAL  10   1.471   1.293   5.134
   86    HB   VAL  10           HB       VAL  10  -0.950   2.812   4.152
   87   HG11  VAL  10          1HG1      VAL  10  -1.832   2.179   6.533
   88   HG12  VAL  10          2HG1      VAL  10  -0.736   0.805   6.386
   89   HG13  VAL  10          3HG1      VAL  10  -2.037   1.025   5.215
   90   HG21  VAL  10          3HG2      VAL  10   0.385   3.127   6.818
   91   HG22  VAL  10          1HG2      VAL  10  -0.399   4.343   5.810
   92   HG23  VAL  10          2HG2      VAL  10   1.207   3.748   5.387
   93    H    HIS  11           H        HIS  11  -0.841   1.076   2.403
   94    HA   HIS  11           HA       HIS  11  -1.878  -1.507   3.017
   95    HB2  HIS  11           1HB      HIS  11  -1.699   0.347   0.703
   96    HB3  HIS  11           2HB      HIS  11  -2.050  -1.336   0.311
   97    HD1  HIS  11           HD1      HIS  11  -4.499  -1.743   0.224
   98    HD2  HIS  11           HD2      HIS  11  -3.535   1.095   3.121
   99    HE1  HIS  11           HE1      HIS  11  -6.682  -1.057   1.309
  100    H    VAL  12           H        VAL  12   0.520  -0.713   0.466
  101    HA   VAL  12           HA       VAL  12   1.346  -3.232  -0.295
  102    HB   VAL  12           HB       VAL  12   2.230  -1.203  -1.265
  103   HG11  VAL  12          1HG1      VAL  12   2.164   0.071   0.919
  104   HG12  VAL  12          2HG1      VAL  12   3.615   0.352  -0.044
  105   HG13  VAL  12          3HG1      VAL  12   3.678  -0.722   1.353
  106   HG21  VAL  12          3HG2      VAL  12   3.709  -3.209  -1.305
  107   HG22  VAL  12          1HG2      VAL  12   4.472  -2.647   0.182
  108   HG23  VAL  12          2HG2      VAL  12   4.627  -1.704  -1.300
  109    H    ALA  13           H        ALA  13   2.254  -1.537   2.692
  110    HA   ALA  13           HA       ALA  13   4.148  -3.600   3.533
  111    HB1  ALA  13           3HB      ALA  13   4.741  -1.891   4.885
  112    HB2  ALA  13           1HB      ALA  13   3.148  -1.897   5.644
  113    HB3  ALA  13           2HB      ALA  13   3.428  -0.941   4.188
  114    H    LYS  14           H        LYS  14   0.857  -2.610   4.549
  115    HA   LYS  14           HA       LYS  14   0.524  -4.614   6.565
  116    HB2  LYS  14           1HB      LYS  14  -0.929  -2.746   6.561
  117    HB3  LYS  14           2HB      LYS  14  -1.292  -2.924   4.844
  118    HG2  LYS  14           1HG      LYS  14  -3.174  -3.680   6.291
  119    HG3  LYS  14           2HG      LYS  14  -2.536  -4.982   5.286
  120    HD2  LYS  14           1HD      LYS  14  -2.581  -6.070   7.323
  121    HD3  LYS  14           2HD      LYS  14  -0.968  -5.362   7.410
  122    HE2  LYS  14           1HE      LYS  14  -1.610  -3.751   8.957
  123    HE3  LYS  14           2HE      LYS  14  -3.292  -3.731   8.391
  124    HZ1  LYS  14           3HZ      LYS  14  -2.273  -6.262   9.422
  125    HZ2  LYS  14           1HZ      LYS  14  -3.818  -5.578   9.569
  126    HZ3  LYS  14           2HZ      LYS  14  -2.554  -5.039  10.568
  127    H    THR  15           H        THR  15  -0.251  -4.605   3.081
  128    HA   THR  15           HA       THR  15  -1.614  -7.134   3.027
  129    HB   THR  15           HB       THR  15   0.056  -6.065   0.800
  130    HG1  THR  15           HG1      THR  15  -0.817  -4.191   1.286
  131   HG21  THR  15          3HG2      THR  15  -2.795  -6.709   0.441
  132   HG22  THR  15          1HG2      THR  15  -1.797  -8.060   0.980
  133   HG23  THR  15          2HG2      THR  15  -1.399  -7.209  -0.515
  134    H    ILE  16           H        ILE  16   1.707  -6.375   1.842
  135    HA   ILE  16           HA       ILE  16   2.585  -8.996   1.416
  136    HB   ILE  16           HB       ILE  16   4.842  -8.035   1.867
  137   HG12  ILE  16          1HG1      ILE  16   3.211  -5.735   2.980
  138   HG13  ILE  16          2HG1      ILE  16   4.349  -6.749   3.869
  139   HG21  ILE  16          1HG2      ILE  16   2.942  -6.135   0.462
  140   HG22  ILE  16          2HG2      ILE  16   3.722  -7.538  -0.269
  141   HG23  ILE  16          3HG2      ILE  16   4.693  -6.165   0.260
  142   HD11  ILE  16          3HD1      ILE  16   6.060  -5.951   2.042
  143   HD12  ILE  16          1HD1      ILE  16   5.665  -4.881   3.386
  144   HD13  ILE  16          2HD1      ILE  16   4.911  -4.632   1.812
  145    H    HIS  17           H        HIS  17   2.611  -7.130   4.461
  146    HA   HIS  17           HA       HIS  17   3.733  -9.155   6.121
  147    HB2  HIS  17           1HB      HIS  17   3.074  -6.614   6.481
  148    HB3  HIS  17           2HB      HIS  17   1.545  -7.298   7.033
  149    HD1  HIS  17           HD1      HIS  17   4.929  -6.559   8.161
  150    HD2  HIS  17           HD2      HIS  17   1.963  -9.289   9.225
  151    HE1  HIS  17           HE1      HIS  17   5.553  -7.439  10.453
  152    H    ARG  18           H        ARG  18   0.528  -8.678   4.744
  153    HA   ARG  18           HA       ARG  18  -0.726 -10.732   6.441
  154    HB2  ARG  18           1HB      ARG  18  -1.781  -8.652   5.319
  155    HB3  ARG  18           2HB      ARG  18  -1.725  -9.583   3.823
  156    HG2  ARG  18           1HG      ARG  18  -2.848 -11.436   5.409
  157    HG3  ARG  18           2HG      ARG  18  -3.414  -9.989   6.243
  158    HD2  ARG  18           1HD      ARG  18  -3.661 -10.042   3.260
  159    HD3  ARG  18           2HD      ARG  18  -4.807 -11.010   4.209
  160    HE   ARG  18           HE       ARG  18  -4.880  -8.168   4.028
  161   HH11  ARG  18          1HH1      ARG  18  -6.665 -10.406   5.434
  162   HH12  ARG  18          2HH1      ARG  18  -6.829  -9.668   6.991
  163   HH21  ARG  18          1HH2      ARG  18  -4.327  -7.331   6.440
  164   HH22  ARG  18          2HH2      ARG  18  -5.505  -7.926   7.561
  165    H    LEU  19           H        LEU  19   0.695 -10.462   3.217
  166    HA   LEU  19           HA       LEU  19  -0.068 -13.119   2.330
  167    HB2  LEU  19           1HB      LEU  19   0.464 -11.283   0.792
  168    HB3  LEU  19           2HB      LEU  19   2.088 -11.159   1.472
  169    HG   LEU  19           HG       LEU  19   2.284 -13.681   0.819
  170   HD11  LEU  19          1HD1      LEU  19  -0.302 -13.461   0.163
  171   HD12  LEU  19          2HD1      LEU  19   0.784 -14.545  -0.705
  172   HD13  LEU  19          3HD1      LEU  19   0.396 -12.962  -1.378
  173   HD21  LEU  19          3HD2      LEU  19   3.609 -11.921  -0.233
  174   HD22  LEU  19          1HD2      LEU  19   2.234 -11.443  -1.230
  175   HD23  LEU  19          2HD2      LEU  19   3.004 -13.010  -1.482
  176    H    VAL  20           H        VAL  20   2.842 -11.668   3.776
  177    HA   VAL  20           HA       VAL  20   4.388 -14.126   3.766
  178    HB   VAL  20           HB       VAL  20   5.977 -12.806   4.945
  179   HG11  VAL  20          1HG1      VAL  20   4.473 -11.600   2.822
  180   HG12  VAL  20          2HG1      VAL  20   6.182 -11.408   3.203
  181   HG13  VAL  20          3HG1      VAL  20   4.988 -10.345   3.944
  182   HG21  VAL  20          3HG2      VAL  20   3.663 -11.050   5.828
  183   HG22  VAL  20          1HG2      VAL  20   5.359 -10.797   6.241
  184   HG23  VAL  20          2HG2      VAL  20   4.508 -12.218   6.844
  185    H    THR  21           H        THR  21   2.413 -12.406   6.145
  186    HA   THR  21           HA       THR  21   2.869 -14.293   8.307
  187    HB   THR  21           HB       THR  21   0.722 -12.217   7.767
  188    HG1  THR  21           HG1      THR  21   2.217 -11.304   9.558
  189   HG21  THR  21          3HG2      THR  21  -0.182 -12.643   9.804
  190   HG22  THR  21          1HG2      THR  21   1.395 -12.924  10.544
  191   HG23  THR  21          2HG2      THR  21   0.601 -14.216   9.644
  192    H    GLY  22           H        GLY  22   0.737 -14.213   5.556
  193    HA2  GLY  22           1HA      GLY  22  -0.126 -16.889   5.819
  194    HA3  GLY  22           2HA      GLY  22  -1.364 -15.882   6.572
  Start of MODEL   11
    1    H1   PHE   1           1H       PHE   1  -3.288  14.682   0.043
    2    H2   PHE   1           2H       PHE   1  -3.620  15.106  -1.568
    3    H3   PHE   1           3H       PHE   1  -2.226  15.701  -0.801
    4    HA   PHE   1           HA       PHE   1  -2.753  13.006  -1.866
    5    HB2  PHE   1           1HB      PHE   1  -1.333  15.269  -2.602
    6    HB3  PHE   1           2HB      PHE   1  -0.091  14.250  -1.873
    7    HD1  PHE   1           HD2      PHE   1  -1.669  11.612  -2.566
    8    HD2  PHE   1           HD1      PHE   1  -0.397  15.011  -4.864
    9    HE1  PHE   1           HE2      PHE   1  -1.617  10.210  -4.612
   10    HE2  PHE   1           HE1      PHE   1  -0.346  13.609  -6.909
   11    HZ   PHE   1           HZ       PHE   1  -0.955  11.209  -6.783
   12    H    PHE   2           H        PHE   2  -1.567  14.632   0.957
   13    HA   PHE   2           HA       PHE   2   0.453  12.872   1.877
   14    HB2  PHE   2           1HB      PHE   2  -1.698  14.369   3.411
   15    HB3  PHE   2           2HB      PHE   2  -0.174  13.793   4.086
   16    HD1  PHE   2           HD1      PHE   2   2.006  14.682   3.133
   17    HD2  PHE   2           HD2      PHE   2  -1.813  16.421   2.219
   18    HE1  PHE   2           HE1      PHE   2   3.133  16.753   2.365
   19    HE2  PHE   2           HE2      PHE   2  -0.687  18.492   1.451
   20    HZ   PHE   2           HZ       PHE   2   1.787  18.658   1.524
   21    H    HIS   3           H        HIS   3  -2.989  12.400   1.621
   22    HA   HIS   3           HA       HIS   3  -3.211  10.277   3.589
   23    HB2  HIS   3           1HB      HIS   3  -4.933  10.945   1.183
   24    HB3  HIS   3           2HB      HIS   3  -5.437  10.061   2.622
   25    HD1  HIS   3           HD1      HIS   3  -4.998  11.556   4.959
   26    HD2  HIS   3           HD2      HIS   3  -5.517  13.632   1.381
   27    HE1  HIS   3           HE1      HIS   3  -5.623  13.927   5.591
   28    H    HIS   4           H        HIS   4  -2.414  10.445   0.163
   29    HA   HIS   4           HA       HIS   4  -2.751   7.614  -0.382
   30    HB2  HIS   4           1HB      HIS   4  -1.410   9.966  -1.712
   31    HB3  HIS   4           2HB      HIS   4  -1.308   8.347  -2.405
   32    HD1  HIS   4           HD1      HIS   4  -3.073   7.977  -4.111
   33    HD2  HIS   4           HD2      HIS   4  -4.419  10.474  -1.056
   34    HE1  HIS   4           HE1      HIS   4  -5.468   8.573  -4.677
   35    H    ILE   5           H        ILE   5   0.179   9.635  -0.039
   36    HA   ILE   5           HA       ILE   5   2.148   7.661  -0.149
   37    HB   ILE   5           HB       ILE   5   3.528   9.218   1.019
   38   HG12  ILE   5          1HG1      ILE   5   0.982  10.260   2.296
   39   HG13  ILE   5          2HG1      ILE   5   2.222   9.299   3.103
   40   HG21  ILE   5          1HG2      ILE   5   3.095  11.218  -0.103
   41   HG22  ILE   5          2HG2      ILE   5   1.351  11.078   0.130
   42   HG23  ILE   5          3HG2      ILE   5   2.166  10.061  -1.059
   43   HD11  ILE   5          3HD1      ILE   5   3.015  11.836   1.729
   44   HD12  ILE   5          1HD1      ILE   5   3.746  11.043   3.125
   45   HD13  ILE   5          2HD1      ILE   5   2.228  11.923   3.305
   46    H    PHE   6           H        PHE   6   0.240   8.643   2.681
   47    HA   PHE   6           HA       PHE   6   1.366   6.900   4.613
   48    HB2  PHE   6           1HB      PHE   6  -0.977   8.560   4.220
   49    HB3  PHE   6           2HB      PHE   6  -1.415   7.082   5.076
   50    HD1  PHE   6           HD2      PHE   6   0.574   6.358   6.838
   51    HD2  PHE   6           HD1      PHE   6  -0.435  10.346   5.605
   52    HE1  PHE   6           HE2      PHE   6   1.568   7.254   8.923
   53    HE2  PHE   6           HE1      PHE   6   0.559  11.242   7.691
   54    HZ   PHE   6           HZ       PHE   6   1.562   9.697   9.351
   55    H    ARG   7           H        ARG   7  -0.925   6.259   2.017
   56    HA   ARG   7           HA       ARG   7  -1.639   3.588   3.007
   57    HB2  ARG   7           1HB      ARG   7  -2.031   4.775   0.247
   58    HB3  ARG   7           2HB      ARG   7  -3.018   3.549   1.044
   59    HG2  ARG   7           1HG      ARG   7  -2.905   5.858   2.736
   60    HG3  ARG   7           2HG      ARG   7  -3.354   6.375   1.110
   61    HD2  ARG   7           1HD      ARG   7  -4.780   3.955   1.704
   62    HD3  ARG   7           2HD      ARG   7  -5.025   5.103   3.035
   63    HE   ARG   7           HE       ARG   7  -5.905   6.707   1.443
   64   HH11  ARG   7          1HH1      ARG   7  -4.268   4.354  -0.339
   65   HH12  ARG   7          2HH1      ARG   7  -5.422   4.286  -1.627
   66   HH21  ARG   7          1HH2      ARG   7  -7.718   6.340  -0.033
   67   HH22  ARG   7          2HH2      ARG   7  -7.376   5.410  -1.455
   68    H    ALA   8           H        ALA   8   0.065   4.779   0.083
   69    HA   ALA   8           HA       ALA   8   1.000   2.444  -1.037
   70    HB1  ALA   8           3HB      ALA   8   2.865   3.802  -1.840
   71    HB2  ALA   8           1HB      ALA   8   2.650   4.935  -0.506
   72    HB3  ALA   8           2HB      ALA   8   1.418   4.808  -1.763
   73    H    ILE   9           H        ILE   9   2.480   4.110   1.764
   74    HA   ILE   9           HA       ILE   9   4.539   2.055   2.092
   75    HB   ILE   9           HB       ILE   9   3.571   4.406   3.745
   76   HG12  ILE   9          1HG1      ILE   9   6.266   4.459   2.613
   77   HG13  ILE   9          2HG1      ILE   9   5.024   4.293   1.371
   78   HG21  ILE   9          1HG2      ILE   9   5.128   2.218   4.601
   79   HG22  ILE   9          2HG2      ILE   9   4.932   3.766   5.422
   80   HG23  ILE   9          3HG2      ILE   9   6.273   3.525   4.301
   81   HD11  ILE   9          3HD1      ILE   9   4.370   6.432   1.636
   82   HD12  ILE   9          1HD1      ILE   9   5.782   6.662   2.668
   83   HD13  ILE   9          2HD1      ILE   9   4.228   6.230   3.382
   84    H    VAL  10           H        VAL  10   1.529   2.961   3.799
   85    HA   VAL  10           HA       VAL  10   1.749   0.956   5.856
   86    HB   VAL  10           HB       VAL  10  -0.452   2.636   4.653
   87   HG11  VAL  10          1HG1      VAL  10  -0.690   0.658   6.942
   88   HG12  VAL  10          2HG1      VAL  10  -1.507   0.546   5.383
   89   HG13  VAL  10          3HG1      VAL  10  -1.915   1.848   6.501
   90   HG21  VAL  10          3HG2      VAL  10   0.949   2.573   7.346
   91   HG22  VAL  10          1HG2      VAL  10  -0.354   3.681   6.916
   92   HG23  VAL  10          2HG2      VAL  10   1.192   3.769   6.073
   93    H    HIS  11           H        HIS  11  -0.041   1.033   2.760
   94    HA   HIS  11           HA       HIS  11  -1.248  -1.549   2.997
   95    HB2  HIS  11           1HB      HIS  11  -0.860   0.581   1.047
   96    HB3  HIS  11           2HB      HIS  11  -0.820  -1.008   0.283
   97    HD1  HIS  11           HD1      HIS  11  -3.094  -1.619  -0.508
   98    HD2  HIS  11           HD2      HIS  11  -3.246   0.451   3.108
   99    HE1  HIS  11           HE1      HIS  11  -5.538  -1.501   0.149
  100    H    VAL  12           H        VAL  12   1.666  -0.571   1.131
  101    HA   VAL  12           HA       VAL  12   2.447  -3.076   0.162
  102    HB   VAL  12           HB       VAL  12   3.505  -0.960  -0.430
  103   HG11  VAL  12          1HG1      VAL  12   4.842   0.303   1.122
  104   HG12  VAL  12          2HG1      VAL  12   4.722  -0.964   2.344
  105   HG13  VAL  12          3HG1      VAL  12   3.299  -0.016   1.912
  106   HG21  VAL  12          3HG2      VAL  12   5.813  -1.663  -0.418
  107   HG22  VAL  12          1HG2      VAL  12   4.825  -3.118  -0.547
  108   HG23  VAL  12          2HG2      VAL  12   5.551  -2.680   1.000
  109    H    ALA  13           H        ALA  13   3.282  -1.646   3.340
  110    HA   ALA  13           HA       ALA  13   4.807  -3.960   4.210
  111    HB1  ALA  13           3HB      ALA  13   3.587  -2.132   6.198
  112    HB2  ALA  13           1HB      ALA  13   4.544  -1.346   4.943
  113    HB3  ALA  13           2HB      ALA  13   5.278  -2.577   5.971
  114    H    LYS  14           H        LYS  14   1.683  -2.652   5.403
  115    HA   LYS  14           HA       LYS  14   0.952  -4.860   7.006
  116    HB2  LYS  14           1HB      LYS  14  -0.221  -2.806   7.192
  117    HB3  LYS  14           2HB      LYS  14  -0.560  -2.748   5.463
  118    HG2  LYS  14           1HG      LYS  14  -2.070  -4.661   5.661
  119    HG3  LYS  14           2HG      LYS  14  -1.684  -4.815   7.376
  120    HD2  LYS  14           1HD      LYS  14  -3.670  -3.586   7.445
  121    HD3  LYS  14           2HD      LYS  14  -2.452  -2.311   7.496
  122    HE2  LYS  14           1HE      LYS  14  -2.646  -2.066   5.015
  123    HE3  LYS  14           2HE      LYS  14  -3.958  -3.261   5.034
  124    HZ1  LYS  14           3HZ      LYS  14  -3.988  -0.925   6.843
  125    HZ2  LYS  14           1HZ      LYS  14  -5.285  -1.904   6.356
  126    HZ3  LYS  14           2HZ      LYS  14  -4.592  -0.806   5.260
  127    H    THR  15           H        THR  15   0.065  -4.211   3.593
  128    HA   THR  15           HA       THR  15  -1.495  -6.553   3.156
  129    HB   THR  15           HB       THR  15   0.303  -5.009   1.295
  130    HG1  THR  15           HG1      THR  15  -1.282  -3.575   1.175
  131   HG21  THR  15          3HG2      THR  15  -1.022  -7.340   0.782
  132   HG22  THR  15          1HG2      THR  15  -0.646  -6.124  -0.441
  133   HG23  THR  15          2HG2      THR  15  -2.237  -6.144   0.324
  134    H    ILE  16           H        ILE  16   1.759  -6.064   1.737
  135    HA   ILE  16           HA       ILE  16   2.357  -8.696   1.079
  136    HB   ILE  16           HB       ILE  16   4.098  -6.501   2.251
  137   HG12  ILE  16          1HG1      ILE  16   3.758  -7.418  -0.619
  138   HG13  ILE  16          2HG1      ILE  16   2.840  -6.088   0.088
  139   HG21  ILE  16          1HG2      ILE  16   4.729  -9.258   1.629
  140   HG22  ILE  16          2HG2      ILE  16   5.769  -8.010   2.315
  141   HG23  ILE  16          3HG2      ILE  16   5.620  -8.170   0.564
  142   HD11  ILE  16          3HD1      ILE  16   5.863  -6.250  -0.099
  143   HD12  ILE  16          1HD1      ILE  16   4.956  -4.930   0.638
  144   HD13  ILE  16          2HD1      ILE  16   4.821  -5.232  -1.094
  145    H    HIS  17           H        HIS  17   3.103  -7.104   4.191
  146    HA   HIS  17           HA       HIS  17   4.005  -9.465   5.530
  147    HB2  HIS  17           1HB      HIS  17   4.386  -7.127   6.272
  148    HB3  HIS  17           2HB      HIS  17   2.657  -6.948   6.579
  149    HD1  HIS  17           HD1      HIS  17   2.192  -7.157   9.009
  150    HD2  HIS  17           HD2      HIS  17   5.254  -9.725   7.822
  151    HE1  HIS  17           HE1      HIS  17   2.882  -8.451  11.075
  152    H    ARG  18           H        ARG  18   0.812  -8.217   4.761
  153    HA   ARG  18           HA       ARG  18  -0.567  -9.955   6.696
  154    HB2  ARG  18           1HB      ARG  18  -1.591  -7.866   6.068
  155    HB3  ARG  18           2HB      ARG  18  -1.404  -8.223   4.351
  156    HG2  ARG  18           1HG      ARG  18  -2.935 -10.178   4.634
  157    HG3  ARG  18           2HG      ARG  18  -3.192  -9.692   6.310
  158    HD2  ARG  18           1HD      ARG  18  -4.208  -7.609   5.636
  159    HD3  ARG  18           2HD      ARG  18  -3.745  -7.872   3.942
  160    HE   ARG  18           HE       ARG  18  -5.882  -9.324   5.390
  161   HH11  ARG  18          1HH1      ARG  18  -3.574  -9.620   2.894
  162   HH12  ARG  18          2HH1      ARG  18  -4.682 -10.292   1.745
  163   HH21  ARG  18          1HH2      ARG  18  -7.452  -9.914   3.797
  164   HH22  ARG  18          2HH2      ARG  18  -6.879 -10.457   2.255
  165    H    LEU  19           H        LEU  19  -0.080  -9.891   3.159
  166    HA   LEU  19           HA       LEU  19  -1.396 -12.443   2.720
  167    HB2  LEU  19           1HB      LEU  19  -0.314 -10.259   1.242
  168    HB3  LEU  19           2HB      LEU  19   0.483 -11.724   0.665
  169    HG   LEU  19           HG       LEU  19  -2.505 -11.648   1.044
  170   HD11  LEU  19          1HD1      LEU  19  -1.115  -9.951  -0.705
  171   HD12  LEU  19          2HD1      LEU  19  -2.827 -10.370  -0.785
  172   HD13  LEU  19          3HD1      LEU  19  -1.649 -11.298  -1.710
  173   HD21  LEU  19          3HD2      LEU  19  -0.502 -13.506   0.065
  174   HD22  LEU  19          1HD2      LEU  19  -1.701 -13.172  -1.184
  175   HD23  LEU  19          2HD2      LEU  19  -2.213 -13.788   0.387
  176    H    VAL  20           H        VAL  20   1.905 -11.373   3.366
  177    HA   VAL  20           HA       VAL  20   3.120 -13.959   2.731
  178    HB   VAL  20           HB       VAL  20   3.983 -11.398   4.089
  179   HG11  VAL  20          1HG1      VAL  20   6.264 -12.330   4.157
  180   HG12  VAL  20          2HG1      VAL  20   5.653 -13.876   3.570
  181   HG13  VAL  20          3HG1      VAL  20   5.167 -13.282   5.157
  182   HG21  VAL  20          3HG2      VAL  20   3.730 -11.344   1.645
  183   HG22  VAL  20          1HG2      VAL  20   4.753 -12.774   1.493
  184   HG23  VAL  20          2HG2      VAL  20   5.439 -11.256   2.076
  185    H    THR  21           H        THR  21   1.778 -12.382   5.579
  186    HA   THR  21           HA       THR  21   2.895 -14.313   7.477
  187    HB   THR  21           HB       THR  21   0.814 -12.117   7.567
  188    HG1  THR  21           HG1      THR  21   3.262 -11.888   7.468
  189   HG21  THR  21          3HG2      THR  21   1.512 -14.208   9.565
  190   HG22  THR  21          1HG2      THR  21  -0.002 -13.334   9.331
  191   HG23  THR  21          2HG2      THR  21   1.344 -12.558  10.167
  192    H    GLY  22           H        GLY  22  -0.001 -14.040   5.522
  193    HA2  GLY  22           1HA      GLY  22  -0.841 -16.630   5.508
  194    HA3  GLY  22           2HA      GLY  22  -1.458 -16.074   7.065
  Start of MODEL   12
    1    H1   PHE   1           1H       PHE   1  -2.115  13.391  -3.871
    2    H2   PHE   1           2H       PHE   1  -2.640  12.267  -2.711
    3    H3   PHE   1           3H       PHE   1  -1.011  12.296  -3.194
    4    HA   PHE   1           HA       PHE   1  -0.885  14.625  -2.281
    5    HB2  PHE   1           1HB      PHE   1  -3.679  13.992  -2.130
    6    HB3  PHE   1           2HB      PHE   1  -3.089  14.302  -0.496
    7    HD1  PHE   1           HD1      PHE   1  -0.998  16.277  -0.848
    8    HD2  PHE   1           HD2      PHE   1  -4.766  15.927  -2.878
    9    HE1  PHE   1           HE1      PHE   1  -0.971  18.712  -1.315
   10    HE2  PHE   1           HE2      PHE   1  -4.741  18.362  -3.346
   11    HZ   PHE   1           HZ       PHE   1  -2.843  19.755  -2.565
   12    H    PHE   2           H        PHE   2  -0.984  14.784   0.389
   13    HA   PHE   2           HA       PHE   2   0.916  13.066   1.451
   14    HB2  PHE   2           1HB      PHE   2  -0.546  15.160   2.323
   15    HB3  PHE   2           2HB      PHE   2  -1.337  13.867   3.223
   16    HD1  PHE   2           HD1      PHE   2   2.090  15.129   2.365
   17    HD2  PHE   2           HD2      PHE   2  -0.410  13.146   5.242
   18    HE1  PHE   2           HE1      PHE   2   3.972  15.098   3.979
   19    HE2  PHE   2           HE2      PHE   2   1.474  13.114   6.856
   20    HZ   PHE   2           HZ       PHE   2   3.664  14.090   6.225
   21    H    HIS   3           H        HIS   3  -2.584  12.696   2.070
   22    HA   HIS   3           HA       HIS   3  -2.641  10.239   3.336
   23    HB2  HIS   3           1HB      HIS   3  -4.391  11.897   1.734
   24    HB3  HIS   3           2HB      HIS   3  -4.729  10.192   1.436
   25    HD1  HIS   3           HD1      HIS   3  -3.500  11.531   4.748
   26    HD2  HIS   3           HD2      HIS   3  -7.012  10.024   3.082
   27    HE1  HIS   3           HE1      HIS   3  -5.116  11.190   6.668
   28    H    HIS   4           H        HIS   4  -2.823  10.652  -0.209
   29    HA   HIS   4           HA       HIS   4  -2.813   8.057  -1.118
   30    HB2  HIS   4           1HB      HIS   4  -1.776  10.656  -1.990
   31    HB3  HIS   4           2HB      HIS   4  -0.916   9.299  -2.717
   32    HD1  HIS   4           HD1      HIS   4  -2.306   7.653  -4.202
   33    HD2  HIS   4           HD2      HIS   4  -4.473  10.933  -2.814
   34    HE1  HIS   4           HE1      HIS   4  -4.455   7.710  -5.541
   35    H    ILE   5           H        ILE   5   0.283   9.795  -0.780
   36    HA   ILE   5           HA       ILE   5   2.063   7.683  -0.930
   37    HB   ILE   5           HB       ILE   5   2.156   9.964   1.067
   38   HG12  ILE   5          1HG1      ILE   5   3.561  10.538  -1.348
   39   HG13  ILE   5          2HG1      ILE   5   1.939  10.002  -1.792
   40   HG21  ILE   5          1HG2      ILE   5   4.095   8.835   1.535
   41   HG22  ILE   5          2HG2      ILE   5   4.667   9.697   0.108
   42   HG23  ILE   5          3HG2      ILE   5   4.124   8.026  -0.032
   43   HD11  ILE   5          3HD1      ILE   5   1.250  11.616   0.215
   44   HD12  ILE   5          1HD1      ILE   5   1.504  12.239  -1.416
   45   HD13  ILE   5          2HD1      ILE   5   2.778  12.390  -0.206
   46    H    PHE   6           H        PHE   6   0.526   8.840   2.073
   47    HA   PHE   6           HA       PHE   6   1.564   6.900   3.852
   48    HB2  PHE   6           1HB      PHE   6  -0.403   8.968   3.772
   49    HB3  PHE   6           2HB      PHE   6  -1.154   7.548   4.500
   50    HD1  PHE   6           HD1      PHE   6   0.379   6.258   6.248
   51    HD2  PHE   6           HD2      PHE   6   0.835  10.384   5.148
   52    HE1  PHE   6           HE1      PHE   6   1.596   6.687   8.363
   53    HE2  PHE   6           HE2      PHE   6   2.053  10.813   7.263
   54    HZ   PHE   6           HZ       PHE   6   2.435   8.964   8.873
   55    H    ARG   7           H        ARG   7  -0.977   6.640   1.446
   56    HA   ARG   7           HA       ARG   7  -2.060   4.132   2.528
   57    HB2  ARG   7           1HB      ARG   7  -2.453   5.396  -0.199
   58    HB3  ARG   7           2HB      ARG   7  -3.557   4.318   0.654
   59    HG2  ARG   7           1HG      ARG   7  -3.043   6.479   2.409
   60    HG3  ARG   7           2HG      ARG   7  -3.358   7.185   0.824
   61    HD2  ARG   7           1HD      ARG   7  -5.206   4.998   1.427
   62    HD3  ARG   7           2HD      ARG   7  -5.312   6.323   2.605
   63    HE   ARG   7           HE       ARG   7  -5.745   7.866   0.755
   64   HH11  ARG   7          1HH1      ARG   7  -4.433   5.370  -0.910
   65   HH12  ARG   7          2HH1      ARG   7  -5.719   5.175  -2.055
   66   HH21  ARG   7          1HH2      ARG   7  -7.904   7.263  -0.358
   67   HH22  ARG   7          2HH2      ARG   7  -7.682   6.247  -1.742
   68    H    ALA   8           H        ALA   8  -0.647   4.898  -0.678
   69    HA   ALA   8           HA       ALA   8  -0.119   2.367  -1.636
   70    HB1  ALA   8           3HB      ALA   8   0.983   5.065  -1.904
   71    HB2  ALA   8           1HB      ALA   8   0.662   3.862  -3.153
   72    HB3  ALA   8           2HB      ALA   8   2.179   3.818  -2.255
   73    H    ILE   9           H        ILE   9   2.082   4.215   0.508
   74    HA   ILE   9           HA       ILE   9   4.060   2.178   0.790
   75    HB   ILE   9           HB       ILE   9   3.138   4.418   2.619
   76   HG12  ILE   9          1HG1      ILE   9   5.551   4.362   0.802
   77   HG13  ILE   9          2HG1      ILE   9   3.972   4.883   0.212
   78   HG21  ILE   9          1HG2      ILE   9   4.457   3.143   4.051
   79   HG22  ILE   9          2HG2      ILE   9   5.681   4.162   3.295
   80   HG23  ILE   9          3HG2      ILE   9   5.447   2.506   2.739
   81   HD11  ILE   9          3HD1      ILE   9   3.871   6.583   2.010
   82   HD12  ILE   9          1HD1      ILE   9   5.278   6.821   0.975
   83   HD13  ILE   9          2HD1      ILE   9   5.467   6.079   2.564
   84    H    VAL  10           H        VAL  10   1.312   3.012   2.948
   85    HA   VAL  10           HA       VAL  10   1.689   1.007   4.897
   86    HB   VAL  10           HB       VAL  10  -0.716   2.409   3.723
   87   HG11  VAL  10          1HG1      VAL  10  -0.671   0.519   6.098
   88   HG12  VAL  10          2HG1      VAL  10  -1.478   0.214   4.560
   89   HG13  VAL  10          3HG1      VAL  10  -2.041   1.517   5.608
   90   HG21  VAL  10          3HG2      VAL  10  -0.555   3.791   5.619
   91   HG22  VAL  10          1HG2      VAL  10   1.136   3.485   5.221
   92   HG23  VAL  10          2HG2      VAL  10   0.363   2.592   6.532
   93    H    HIS  11           H        HIS  11  -0.450   0.825   2.014
   94    HA   HIS  11           HA       HIS  11  -1.400  -1.759   2.175
   95    HB2  HIS  11           1HB      HIS  11  -0.230  -0.327  -0.233
   96    HB3  HIS  11           2HB      HIS  11  -1.329  -1.702  -0.320
   97    HD1  HIS  11           HD1      HIS  11  -1.693   1.569  -1.019
   98    HD2  HIS  11           HD2      HIS  11  -3.556  -0.745   1.903
   99    HE1  HIS  11           HE1      HIS  11  -3.838   2.772  -0.416
  100    H    VAL  12           H        VAL  12   1.817  -0.829   0.902
  101    HA   VAL  12           HA       VAL  12   2.768  -3.390   0.187
  102    HB   VAL  12           HB       VAL  12   4.380  -1.197   1.524
  103   HG11  VAL  12          1HG1      VAL  12   5.750  -3.072   1.044
  104   HG12  VAL  12          2HG1      VAL  12   6.009  -1.968  -0.307
  105   HG13  VAL  12          3HG1      VAL  12   4.948  -3.363  -0.500
  106   HG21  VAL  12          3HG2      VAL  12   2.790  -1.159  -0.938
  107   HG22  VAL  12          1HG2      VAL  12   4.484  -0.740  -1.197
  108   HG23  VAL  12          2HG2      VAL  12   3.515   0.176  -0.043
  109    H    ALA  13           H        ALA  13   3.902  -1.774   3.155
  110    HA   ALA  13           HA       ALA  13   4.721  -4.142   4.485
  111    HB1  ALA  13           3HB      ALA  13   3.726  -1.494   5.591
  112    HB2  ALA  13           1HB      ALA  13   5.375  -1.829   5.064
  113    HB3  ALA  13           2HB      ALA  13   4.713  -2.660   6.472
  114    H    LYS  14           H        LYS  14   1.549  -2.821   4.005
  115    HA   LYS  14           HA       LYS  14   0.293  -4.172   6.276
  116    HB2  LYS  14           1HB      LYS  14  -0.602  -2.097   5.401
  117    HB3  LYS  14           2HB      LYS  14  -0.716  -2.781   3.778
  118    HG2  LYS  14           1HG      LYS  14  -2.924  -2.884   4.689
  119    HG3  LYS  14           2HG      LYS  14  -2.289  -4.528   4.764
  120    HD2  LYS  14           1HD      LYS  14  -3.177  -4.244   6.913
  121    HD3  LYS  14           2HD      LYS  14  -1.478  -3.834   7.151
  122    HE2  LYS  14           1HE      LYS  14  -2.003  -1.436   6.939
  123    HE3  LYS  14           2HE      LYS  14  -3.712  -1.830   6.661
  124    HZ1  LYS  14           3HZ      LYS  14  -2.228  -2.824   9.021
  125    HZ2  LYS  14           1HZ      LYS  14  -3.905  -2.783   8.781
  126    HZ3  LYS  14           2HZ      LYS  14  -3.051  -1.338   9.042
  127    H    THR  15           H        THR  15   0.136  -4.618   2.716
  128    HA   THR  15           HA       THR  15  -1.309  -7.123   2.879
  129    HB   THR  15           HB       THR  15   0.427  -6.319   0.595
  130    HG1  THR  15           HG1      THR  15  -0.941  -4.660   0.084
  131   HG21  THR  15          3HG2      THR  15  -2.394  -6.796   0.095
  132   HG22  THR  15          1HG2      THR  15  -1.663  -8.125   0.997
  133   HG23  THR  15          2HG2      THR  15  -0.988  -7.637  -0.557
  134    H    ILE  16           H        ILE  16   2.055  -6.454   1.779
  135    HA   ILE  16           HA       ILE  16   2.998  -9.069   1.586
  136    HB   ILE  16           HB       ILE  16   4.460  -6.724   2.854
  137   HG12  ILE  16          1HG1      ILE  16   3.555  -5.816   0.864
  138   HG13  ILE  16          2HG1      ILE  16   5.158  -6.363   0.379
  139   HG21  ILE  16          1HG2      ILE  16   6.074  -8.187   1.049
  140   HG22  ILE  16          2HG2      ILE  16   5.233  -9.381   2.039
  141   HG23  ILE  16          3HG2      ILE  16   6.214  -8.131   2.807
  142   HD11  ILE  16          3HD1      ILE  16   2.616  -7.979   0.041
  143   HD12  ILE  16          1HD1      ILE  16   4.224  -8.423  -0.534
  144   HD13  ILE  16          2HD1      ILE  16   3.386  -7.042  -1.241
  145    H    HIS  17           H        HIS  17   2.565  -7.094   4.486
  146    HA   HIS  17           HA       HIS  17   3.631  -9.099   6.308
  147    HB2  HIS  17           1HB      HIS  17   3.550  -6.632   6.722
  148    HB3  HIS  17           2HB      HIS  17   1.790  -6.726   6.770
  149    HD1  HIS  17           HD1      HIS  17   0.858  -8.552   8.637
  150    HD2  HIS  17           HD2      HIS  17   4.706  -7.047   9.197
  151    HE1  HIS  17           HE1      HIS  17   1.458  -8.998  11.057
  152    H    ARG  18           H        ARG  18   0.511  -8.360   4.855
  153    HA   ARG  18           HA       ARG  18  -0.991 -10.099   6.693
  154    HB2  ARG  18           1HB      ARG  18  -1.688  -7.993   5.240
  155    HB3  ARG  18           2HB      ARG  18  -1.931  -9.207   3.986
  156    HG2  ARG  18           1HG      ARG  18  -3.089 -10.298   6.285
  157    HG3  ARG  18           2HG      ARG  18  -3.598  -8.609   6.267
  158    HD2  ARG  18           1HD      ARG  18  -4.431  -8.847   3.971
  159    HD3  ARG  18           2HD      ARG  18  -3.855 -10.525   3.918
  160    HE   ARG  18           HE       ARG  18  -6.328  -9.784   5.036
  161   HH11  ARG  18          1HH1      ARG  18  -4.540  -9.942   7.526
  162   HH12  ARG  18          2HH1      ARG  18  -4.823 -11.577   8.024
  163   HH21  ARG  18          1HH2      ARG  18  -6.206 -12.531   4.991
  164   HH22  ARG  18          2HH2      ARG  18  -5.767 -13.045   6.585
  165    H    LEU  19           H        LEU  19   0.250 -10.245   3.361
  166    HA   LEU  19           HA       LEU  19  -0.724 -12.930   2.847
  167    HB2  LEU  19           1HB      LEU  19   0.948 -10.837   1.577
  168    HB3  LEU  19           2HB      LEU  19   1.327 -12.491   1.092
  169    HG   LEU  19           HG       LEU  19  -1.304 -12.688   0.873
  170   HD11  LEU  19          1HD1      LEU  19  -2.284 -10.702   1.389
  171   HD12  LEU  19          2HD1      LEU  19  -1.767 -10.214  -0.224
  172   HD13  LEU  19          3HD1      LEU  19  -0.782  -9.801   1.180
  173   HD21  LEU  19          3HD2      LEU  19   0.051 -11.062  -1.264
  174   HD22  LEU  19          1HD2      LEU  19  -1.027 -12.446  -1.439
  175   HD23  LEU  19          2HD2      LEU  19   0.636 -12.687  -0.903
  176    H    VAL  20           H        VAL  20   2.277 -11.509   4.081
  177    HA   VAL  20           HA       VAL  20   3.833 -13.950   4.029
  178    HB   VAL  20           HB       VAL  20   3.975 -11.287   5.447
  179   HG11  VAL  20          1HG1      VAL  20   4.999 -12.741   7.031
  180   HG12  VAL  20          2HG1      VAL  20   6.330 -12.059   6.098
  181   HG13  VAL  20          3HG1      VAL  20   5.771 -13.697   5.766
  182   HG21  VAL  20          3HG2      VAL  20   6.128 -12.335   3.688
  183   HG22  VAL  20          1HG2      VAL  20   5.438 -10.715   3.777
  184   HG23  VAL  20          2HG2      VAL  20   4.590 -11.986   2.900
  185    H    THR  21           H        THR  21   1.572 -12.509   6.320
  186    HA   THR  21           HA       THR  21   2.269 -14.326   8.510
  187    HB   THR  21           HB       THR  21  -0.096 -12.484   8.015
  188    HG1  THR  21           HG1      THR  21   1.118 -11.056   9.285
  189   HG21  THR  21          3HG2      THR  21   0.397 -14.421  10.053
  190   HG22  THR  21          1HG2      THR  21  -0.929 -13.262   9.949
  191   HG23  THR  21          2HG2      THR  21   0.566 -12.820  10.773
  192    H    GLY  22           H        GLY  22   0.123 -14.367   5.762
  193    HA2  GLY  22           1HA      GLY  22  -0.452 -17.054   5.699
  194    HA3  GLY  22           2HA      GLY  22  -1.644 -16.431   6.840
  Start of MODEL   13
    1    H1   PHE   1           1H       PHE   1  -2.303  15.203   0.239
    2    H2   PHE   1           2H       PHE   1  -1.913  16.015  -1.201
    3    H3   PHE   1           3H       PHE   1  -0.860  16.088   0.130
    4    HA   PHE   1           HA       PHE   1  -1.474  13.676  -1.503
    5    HB2  PHE   1           1HB      PHE   1   0.143  15.827  -2.009
    6    HB3  PHE   1           2HB      PHE   1   1.254  14.764  -1.146
    7    HD1  PHE   1           HD1      PHE   1   0.667  12.108  -1.880
    8    HD2  PHE   1           HD2      PHE   1   0.366  15.632  -4.317
    9    HE1  PHE   1           HE1      PHE   1   0.925  10.720  -3.919
   10    HE2  PHE   1           HE2      PHE   1   0.624  14.244  -6.355
   11    HZ   PHE   1           HZ       PHE   1   0.903  11.788  -6.157
   12    H    PHE   2           H        PHE   2   0.141  15.076   1.337
   13    HA   PHE   2           HA       PHE   2   1.677  13.003   2.316
   14    HB2  PHE   2           1HB      PHE   2   0.032  15.190   3.404
   15    HB3  PHE   2           2HB      PHE   2   0.346  13.893   4.557
   16    HD1  PHE   2           HD1      PHE   2   2.634  14.695   1.777
   17    HD2  PHE   2           HD2      PHE   2   1.845  15.186   5.971
   18    HE1  PHE   2           HE1      PHE   2   4.939  15.546   2.111
   19    HE2  PHE   2           HE2      PHE   2   4.151  16.036   6.305
   20    HZ   PHE   2           HZ       PHE   2   5.698  16.217   4.375
   21    H    HIS   3           H        HIS   3  -1.855  13.304   2.699
   22    HA   HIS   3           HA       HIS   3  -2.276  10.920   4.192
   23    HB2  HIS   3           1HB      HIS   3  -3.754  13.006   3.049
   24    HB3  HIS   3           2HB      HIS   3  -4.387  11.547   2.285
   25    HD1  HIS   3           HD1      HIS   3  -3.099  11.913   5.846
   26    HD2  HIS   3           HD2      HIS   3  -6.650  11.070   3.832
   27    HE1  HIS   3           HE1      HIS   3  -4.792  11.269   7.616
   28    H    HIS   4           H        HIS   4  -2.616  11.445   0.676
   29    HA   HIS   4           HA       HIS   4  -3.262   8.942  -0.263
   30    HB2  HIS   4           1HB      HIS   4  -1.495  11.163  -1.175
   31    HB3  HIS   4           2HB      HIS   4  -1.409   9.651  -2.078
   32    HD1  HIS   4           HD1      HIS   4  -3.318   9.122  -3.649
   33    HD2  HIS   4           HD2      HIS   4  -4.192  12.318  -1.120
   34    HE1  HIS   4           HE1      HIS   4  -5.508  10.102  -4.463
   35    H    ILE   5           H        ILE   5   0.133   9.965   0.193
   36    HA   ILE   5           HA       ILE   5   1.480   7.597  -0.263
   37    HB   ILE   5           HB       ILE   5   1.906   9.528   2.039
   38   HG12  ILE   5          1HG1      ILE   5   3.585  10.083  -0.176
   39   HG13  ILE   5          2HG1      ILE   5   1.954   9.892  -0.817
   40   HG21  ILE   5          1HG2      ILE   5   4.373   8.865   1.255
   41   HG22  ILE   5          2HG2      ILE   5   3.549   7.388   0.757
   42   HG23  ILE   5          3HG2      ILE   5   3.495   7.901   2.442
   43   HD11  ILE   5          3HD1      ILE   5   1.386  11.387   1.350
   44   HD12  ILE   5          1HD1      ILE   5   1.797  12.099  -0.210
   45   HD13  ILE   5          2HD1      ILE   5   3.029  11.949   1.043
   46    H    PHE   6           H        PHE   6   0.168   8.566   2.909
   47    HA   PHE   6           HA       PHE   6   0.707   6.204   4.344
   48    HB2  PHE   6           1HB      PHE   6  -1.695   8.056   4.510
   49    HB3  PHE   6           2HB      PHE   6  -1.103   7.016   5.804
   50    HD1  PHE   6           HD2      PHE   6   1.882   7.400   5.177
   51    HD2  PHE   6           HD1      PHE   6  -1.373  10.161   5.649
   52    HE1  PHE   6           HE2      PHE   6   3.475   9.158   5.884
   53    HE2  PHE   6           HE1      PHE   6   0.221  11.919   6.358
   54    HZ   PHE   6           HZ       PHE   6   2.649  11.422   6.475
   55    H    ARG   7           H        ARG   7  -1.728   6.820   1.901
   56    HA   ARG   7           HA       ARG   7  -3.363   4.479   2.581
   57    HB2  ARG   7           1HB      ARG   7  -3.307   6.131   0.040
   58    HB3  ARG   7           2HB      ARG   7  -4.663   5.211   0.691
   59    HG2  ARG   7           1HG      ARG   7  -4.241   6.790   2.801
   60    HG3  ARG   7           2HG      ARG   7  -3.570   7.847   1.559
   61    HD2  ARG   7           1HD      ARG   7  -6.026   8.233   1.949
   62    HD3  ARG   7           2HD      ARG   7  -5.670   7.730   0.285
   63    HE   ARG   7           HE       ARG   7  -6.529   5.775   2.387
   64   HH11  ARG   7          1HH1      ARG   7  -5.637   5.932  -0.798
   65   HH12  ARG   7          2HH1      ARG   7  -7.083   5.231  -1.445
   66   HH21  ARG   7          1HH2      ARG   7  -8.806   5.359   1.562
   67   HH22  ARG   7          2HH2      ARG   7  -8.877   4.907  -0.109
   68    H    ALA   8           H        ALA   8  -1.432   5.360  -0.312
   69    HA   ALA   8           HA       ALA   8  -1.430   2.723  -1.436
   70    HB1  ALA   8           3HB      ALA   8  -0.653   5.285  -2.133
   71    HB2  ALA   8           1HB      ALA   8  -0.372   3.842  -3.107
   72    HB3  ALA   8           2HB      ALA   8   0.886   4.432  -2.023
   73    H    ILE   9           H        ILE   9   0.689   4.308   0.906
   74    HA   ILE   9           HA       ILE   9   2.802   2.313   0.775
   75    HB   ILE   9           HB       ILE   9   2.835   4.771   1.562
   76   HG12  ILE   9          1HG1      ILE   9   4.717   3.139   1.824
   77   HG13  ILE   9          2HG1      ILE   9   4.654   4.331   3.120
   78   HG21  ILE   9          1HG2      ILE   9   0.900   4.520   3.115
   79   HG22  ILE   9          2HG2      ILE   9   2.336   5.145   3.924
   80   HG23  ILE   9          3HG2      ILE   9   1.879   3.453   4.121
   81   HD11  ILE   9          3HD1      ILE   9   3.164   2.531   4.326
   82   HD12  ILE   9          1HD1      ILE   9   4.919   2.351   4.325
   83   HD13  ILE   9          2HD1      ILE   9   3.937   1.416   3.198
   84    H    VAL  10           H        VAL  10   0.025   2.876   2.950
   85    HA   VAL  10           HA       VAL  10   0.561   0.820   4.841
   86    HB   VAL  10           HB       VAL  10  -1.882   2.231   3.779
   87   HG11  VAL  10          1HG1      VAL  10  -3.194   1.141   5.598
   88   HG12  VAL  10          2HG1      VAL  10  -1.825   0.072   5.911
   89   HG13  VAL  10          3HG1      VAL  10  -2.672  -0.007   4.365
   90   HG21  VAL  10          3HG2      VAL  10  -1.861   3.254   5.982
   91   HG22  VAL  10          1HG2      VAL  10  -0.236   3.359   5.307
   92   HG23  VAL  10          2HG2      VAL  10  -0.606   2.142   6.529
   93    H    HIS  11           H        HIS  11  -1.259   0.714   1.768
   94    HA   HIS  11           HA       HIS  11  -2.146  -1.988   1.930
   95    HB2  HIS  11           1HB      HIS  11  -1.869   0.175  -0.025
   96    HB3  HIS  11           2HB      HIS  11  -1.703  -1.422  -0.757
   97    HD1  HIS  11           HD1      HIS  11  -3.854  -2.540  -1.328
   98    HD2  HIS  11           HD2      HIS  11  -4.351   0.264   1.716
   99    HE1  HIS  11           HE1      HIS  11  -6.331  -2.482  -0.806
  100    H    VAL  12           H        VAL  12   0.499  -0.829  -0.191
  101    HA   VAL  12           HA       VAL  12   1.671  -3.208  -0.923
  102    HB   VAL  12           HB       VAL  12   2.480  -1.072  -1.689
  103   HG11  VAL  12          1HG1      VAL  12   3.454   0.582  -0.257
  104   HG12  VAL  12          2HG1      VAL  12   3.533  -0.543   1.099
  105   HG13  VAL  12          3HG1      VAL  12   1.972   0.058   0.542
  106   HG21  VAL  12          3HG2      VAL  12   4.162  -2.884  -1.612
  107   HG22  VAL  12          1HG2      VAL  12   4.613  -2.393   0.022
  108   HG23  VAL  12          2HG2      VAL  12   4.913  -1.312  -1.339
  109    H    ALA  13           H        ALA  13   2.318  -1.493   2.156
  110    HA   ALA  13           HA       ALA  13   4.107  -3.573   3.141
  111    HB1  ALA  13           3HB      ALA  13   2.984  -0.973   3.955
  112    HB2  ALA  13           1HB      ALA  13   4.597  -1.632   4.228
  113    HB3  ALA  13           2HB      ALA  13   3.272  -2.076   5.302
  114    H    LYS  14           H        LYS  14   0.714  -2.650   3.782
  115    HA   LYS  14           HA       LYS  14   0.156  -4.532   5.836
  116    HB2  LYS  14           1HB      LYS  14  -1.372  -2.766   5.377
  117    HB3  LYS  14           2HB      LYS  14  -1.465  -3.188   3.667
  118    HG2  LYS  14           1HG      LYS  14  -2.533  -5.354   4.297
  119    HG3  LYS  14           2HG      LYS  14  -2.529  -4.832   5.981
  120    HD2  LYS  14           1HD      LYS  14  -3.739  -3.029   3.914
  121    HD3  LYS  14           2HD      LYS  14  -4.661  -4.426   4.473
  122    HE2  LYS  14           1HE      LYS  14  -3.433  -2.349   6.322
  123    HE3  LYS  14           2HE      LYS  14  -5.139  -2.380   5.834
  124    HZ1  LYS  14           3HZ      LYS  14  -4.988  -4.845   6.543
  125    HZ2  LYS  14           1HZ      LYS  14  -5.160  -3.660   7.743
  126    HZ3  LYS  14           2HZ      LYS  14  -3.635  -4.344   7.439
  127    H    THR  15           H        THR  15  -0.152  -4.848   2.286
  128    HA   THR  15           HA       THR  15  -1.228  -7.512   2.282
  129    HB   THR  15           HB       THR  15   0.561  -6.247   0.223
  130    HG1  THR  15           HG1      THR  15  -2.223  -5.861   0.381
  131   HG21  THR  15          3HG2      THR  15  -0.792  -8.655   0.290
  132   HG22  THR  15          1HG2      THR  15  -0.232  -7.838  -1.169
  133   HG23  THR  15          2HG2      THR  15  -1.889  -7.607  -0.610
  134    H    ILE  16           H        ILE  16   2.085  -6.541   1.276
  135    HA   ILE  16           HA       ILE  16   3.271  -9.066   1.285
  136    HB   ILE  16           HB       ILE  16   5.361  -7.753   1.867
  137   HG12  ILE  16          1HG1      ILE  16   4.638  -5.146   1.780
  138   HG13  ILE  16          2HG1      ILE  16   3.250  -5.809   2.641
  139   HG21  ILE  16          1HG2      ILE  16   3.734  -6.163  -0.094
  140   HG22  ILE  16          2HG2      ILE  16   4.110  -7.851  -0.438
  141   HG23  ILE  16          3HG2      ILE  16   5.415  -6.687  -0.211
  142   HD11  ILE  16          3HD1      ILE  16   4.475  -5.889   4.524
  143   HD12  ILE  16          1HD1      ILE  16   5.879  -5.278   3.650
  144   HD13  ILE  16          2HD1      ILE  16   5.583  -7.015   3.740
  145    H    HIS  17           H        HIS  17   2.688  -6.898   4.045
  146    HA   HIS  17           HA       HIS  17   3.891  -8.710   5.983
  147    HB2  HIS  17           1HB      HIS  17   3.474  -6.141   6.077
  148    HB3  HIS  17           2HB      HIS  17   1.820  -6.567   6.515
  149    HD1  HIS  17           HD1      HIS  17   1.529  -8.013   8.741
  150    HD2  HIS  17           HD2      HIS  17   5.333  -6.413   8.153
  151    HE1  HIS  17           HE1      HIS  17   2.729  -8.181  10.965
  152    H    ARG  18           H        ARG  18   0.761  -8.295   4.464
  153    HA   ARG  18           HA       ARG  18  -0.749  -9.880   6.394
  154    HB2  ARG  18           1HB      ARG  18  -1.905  -8.330   4.966
  155    HB3  ARG  18           2HB      ARG  18  -1.120  -8.971   3.524
  156    HG2  ARG  18           1HG      ARG  18  -2.972 -10.241   3.261
  157    HG3  ARG  18           2HG      ARG  18  -2.366 -11.203   4.610
  158    HD2  ARG  18           1HD      ARG  18  -3.695 -10.034   6.191
  159    HD3  ARG  18           2HD      ARG  18  -4.030  -8.718   5.050
  160    HE   ARG  18           HE       ARG  18  -5.181 -11.463   4.881
  161   HH11  ARG  18          1HH1      ARG  18  -4.721 -10.299   2.174
  162   HH12  ARG  18          2HH1      ARG  18  -6.203  -9.453   1.878
  163   HH21  ARG  18          1HH2      ARG  18  -7.185  -9.470   5.203
  164   HH22  ARG  18          2HH2      ARG  18  -7.598  -8.983   3.593
  165    H    LEU  19           H        LEU  19   0.266 -10.541   3.038
  166    HA   LEU  19           HA       LEU  19  -0.169 -13.343   3.075
  167    HB2  LEU  19           1HB      LEU  19   0.702 -11.388   1.314
  168    HB3  LEU  19           2HB      LEU  19   2.125 -12.416   1.496
  169    HG   LEU  19           HG       LEU  19  -0.657 -13.406   0.810
  170   HD11  LEU  19          1HD1      LEU  19   0.932 -14.025  -1.313
  171   HD12  LEU  19          2HD1      LEU  19   1.645 -12.491  -0.814
  172   HD13  LEU  19          3HD1      LEU  19  -0.067 -12.574  -1.233
  173   HD21  LEU  19          3HD2      LEU  19   0.221 -15.340   1.622
  174   HD22  LEU  19          1HD2      LEU  19   1.862 -14.697   1.620
  175   HD23  LEU  19          2HD2      LEU  19   1.173 -15.355   0.138
  176    H    VAL  20           H        VAL  20   2.716 -11.426   3.947
  177    HA   VAL  20           HA       VAL  20   4.443 -13.685   4.424
  178    HB   VAL  20           HB       VAL  20   4.357 -10.809   5.353
  179   HG11  VAL  20          1HG1      VAL  20   6.572 -12.827   5.823
  180   HG12  VAL  20          2HG1      VAL  20   5.484 -12.217   7.071
  181   HG13  VAL  20          3HG1      VAL  20   6.604 -11.119   6.264
  182   HG21  VAL  20          3HG2      VAL  20   6.089 -10.491   3.731
  183   HG22  VAL  20          1HG2      VAL  20   4.866 -11.480   2.934
  184   HG23  VAL  20          2HG2      VAL  20   6.337 -12.228   3.555
  185    H    THR  21           H        THR  21   2.075 -11.987   6.417
  186    HA   THR  21           HA       THR  21   2.871 -13.326   8.898
  187    HB   THR  21           HB       THR  21   0.498 -11.649   8.025
  188    HG1  THR  21           HG1      THR  21   2.291 -10.416   8.162
  189   HG21  THR  21          3HG2      THR  21   0.001 -11.460  10.452
  190   HG22  THR  21          1HG2      THR  21   1.254 -12.657  10.781
  191   HG23  THR  21          2HG2      THR  21  -0.181 -13.112   9.864
  192    H    GLY  22           H        GLY  22   0.730 -13.992   6.228
  193    HA2  GLY  22           1HA      GLY  22  -1.068 -15.786   7.573
  194    HA3  GLY  22           2HA      GLY  22  -0.770 -15.756   5.834
  Start of MODEL   14
    1    H1   PHE   1           1H       PHE   1  -2.878  14.695  -0.449
    2    H2   PHE   1           2H       PHE   1  -3.694  13.671  -1.531
    3    H3   PHE   1           3H       PHE   1  -2.860  15.033  -2.111
    4    HA   PHE   1           HA       PHE   1  -1.790  12.646  -2.248
    5    HB2  PHE   1           1HB      PHE   1  -0.979  15.415  -2.136
    6    HB3  PHE   1           2HB      PHE   1   0.304  14.397  -1.484
    7    HD1  PHE   1           HD2      PHE   1  -1.790  15.100  -4.449
    8    HD2  PHE   1           HD1      PHE   1   1.474  12.793  -2.874
    9    HE1  PHE   1           HE2      PHE   1  -1.171  14.404  -6.747
   10    HE2  PHE   1           HE1      PHE   1   2.092  12.098  -5.172
   11    HZ   PHE   1           HZ       PHE   1   0.769  12.904  -7.110
   12    H    PHE   2           H        PHE   2  -1.223  14.711   0.634
   13    HA   PHE   2           HA       PHE   2   0.453  13.131   2.155
   14    HB2  PHE   2           1HB      PHE   2  -1.616  15.133   2.572
   15    HB3  PHE   2           2HB      PHE   2  -1.539  14.009   3.929
   16    HD1  PHE   2           HD2      PHE   2   0.818  13.481   4.890
   17    HD2  PHE   2           HD1      PHE   2  -0.040  16.867   2.390
   18    HE1  PHE   2           HE2      PHE   2   2.872  14.605   5.708
   19    HE2  PHE   2           HE1      PHE   2   2.013  17.991   3.207
   20    HZ   PHE   2           HZ       PHE   2   3.469  16.860   4.867
   21    H    HIS   3           H        HIS   3  -3.003  12.601   1.594
   22    HA   HIS   3           HA       HIS   3  -3.168  10.344   3.454
   23    HB2  HIS   3           1HB      HIS   3  -4.940  12.097   2.500
   24    HB3  HIS   3           2HB      HIS   3  -5.142  10.856   1.262
   25    HD1  HIS   3           HD1      HIS   3  -4.339   8.645   3.650
   26    HD2  HIS   3           HD2      HIS   3  -7.584  11.254   3.463
   27    HE1  HIS   3           HE1      HIS   3  -6.127   7.675   5.160
   28    H    HIS   4           H        HIS   4  -2.437  10.805   0.059
   29    HA   HIS   4           HA       HIS   4  -2.912   8.020  -0.700
   30    HB2  HIS   4           1HB      HIS   4  -1.724  10.493  -1.939
   31    HB3  HIS   4           2HB      HIS   4  -1.575   8.935  -2.750
   32    HD1  HIS   4           HD1      HIS   4  -3.198  10.490  -4.471
   33    HD2  HIS   4           HD2      HIS   4  -4.921   8.891  -1.028
   34    HE1  HIS   4           HE1      HIS   4  -5.701  10.494  -4.854
   35    H    ILE   5           H        ILE   5  -0.074  10.026   0.052
   36    HA   ILE   5           HA       ILE   5   1.927   8.062  -0.532
   37    HB   ILE   5           HB       ILE   5   3.382   9.571   0.604
   38   HG12  ILE   5          1HG1      ILE   5   0.936  10.524   2.128
   39   HG13  ILE   5          2HG1      ILE   5   2.228   9.518   2.785
   40   HG21  ILE   5          1HG2      ILE   5   1.127  11.453  -0.006
   41   HG22  ILE   5          2HG2      ILE   5   1.843  10.504  -1.310
   42   HG23  ILE   5          3HG2      ILE   5   2.843  11.619  -0.377
   43   HD11  ILE   5          3HD1      ILE   5   2.762  11.718   3.465
   44   HD12  ILE   5          1HD1      ILE   5   2.369  12.390   1.885
   45   HD13  ILE   5          2HD1      ILE   5   3.818  11.405   2.088
   46    H    PHE   6           H        PHE   6   0.224   8.882   2.470
   47    HA   PHE   6           HA       PHE   6   1.505   6.885   4.113
   48    HB2  PHE   6           1HB      PHE   6  -0.377   8.994   4.327
   49    HB3  PHE   6           2HB      PHE   6  -1.188   7.548   4.929
   50    HD1  PHE   6           HD1      PHE   6   0.338   6.000   6.475
   51    HD2  PHE   6           HD2      PHE   6   0.938  10.203   5.822
   52    HE1  PHE   6           HE1      PHE   6   1.624   6.145   8.587
   53    HE2  PHE   6           HE2      PHE   6   2.226  10.347   7.935
   54    HZ   PHE   6           HZ       PHE   6   2.570   8.318   9.320
   55    H    ARG   7           H        ARG   7  -1.058   6.764   1.762
   56    HA   ARG   7           HA       ARG   7  -2.304   4.320   2.745
   57    HB2  ARG   7           1HB      ARG   7  -2.930   6.352   1.016
   58    HB3  ARG   7           2HB      ARG   7  -2.553   5.026  -0.076
   59    HG2  ARG   7           1HG      ARG   7  -4.306   3.736   0.627
   60    HG3  ARG   7           2HG      ARG   7  -4.259   4.384   2.266
   61    HD2  ARG   7           1HD      ARG   7  -6.000   5.725   1.705
   62    HD3  ARG   7           2HD      ARG   7  -4.918   6.567   0.578
   63    HE   ARG   7           HE       ARG   7  -6.550   4.166  -0.158
   64   HH11  ARG   7          1HH1      ARG   7  -4.022   6.023  -1.288
   65   HH12  ARG   7          2HH1      ARG   7  -4.769   6.464  -2.787
   66   HH21  ARG   7          1HH2      ARG   7  -7.868   5.166  -1.929
   67   HH22  ARG   7          2HH2      ARG   7  -6.946   5.979  -3.150
   68    H    ALA   8           H        ALA   8  -0.765   4.820  -0.422
   69    HA   ALA   8           HA       ALA   8  -0.200   2.223  -1.134
   70    HB1  ALA   8           3HB      ALA   8   1.382   3.177  -2.599
   71    HB2  ALA   8           1HB      ALA   8   1.882   4.385  -1.417
   72    HB3  ALA   8           2HB      ALA   8   0.322   4.535  -2.226
   73    H    ILE   9           H        ILE   9   2.260   4.246   0.536
   74    HA   ILE   9           HA       ILE   9   4.146   2.305   1.138
   75    HB   ILE   9           HB       ILE   9   4.308   4.718   1.644
   76   HG12  ILE   9          1HG1      ILE   9   5.546   4.515   3.692
   77   HG13  ILE   9          2HG1      ILE   9   4.583   3.131   4.209
   78   HG21  ILE   9          1HG2      ILE   9   2.614   4.219   4.088
   79   HG22  ILE   9          2HG2      ILE   9   1.882   4.725   2.566
   80   HG23  ILE   9          3HG2      ILE   9   3.069   5.759   3.360
   81   HD11  ILE   9          3HD1      ILE   9   5.514   1.734   2.489
   82   HD12  ILE   9          1HD1      ILE   9   6.868   2.548   3.273
   83   HD13  ILE   9          2HD1      ILE   9   6.287   3.113   1.707
   84    H    VAL  10           H        VAL  10   1.200   3.033   3.039
   85    HA   VAL  10           HA       VAL  10   1.674   1.023   5.053
   86    HB   VAL  10           HB       VAL  10  -0.708   2.582   4.038
   87   HG11  VAL  10          1HG1      VAL  10  -1.797   1.714   6.213
   88   HG12  VAL  10          2HG1      VAL  10  -0.587   0.432   6.155
   89   HG13  VAL  10          3HG1      VAL  10  -1.749   0.609   4.840
   90   HG21  VAL  10          3HG2      VAL  10   1.213   3.608   5.404
   91   HG22  VAL  10          1HG2      VAL  10   0.630   2.630   6.750
   92   HG23  VAL  10          2HG2      VAL  10  -0.417   3.854   6.032
   93    H    HIS  11           H        HIS  11  -0.406   1.070   2.138
   94    HA   HIS  11           HA       HIS  11  -1.478  -1.542   2.341
   95    HB2  HIS  11           1HB      HIS  11  -1.007   0.531   0.287
   96    HB3  HIS  11           2HB      HIS  11  -1.189  -1.102  -0.353
   97    HD1  HIS  11           HD1      HIS  11  -3.545  -1.829  -0.703
   98    HD2  HIS  11           HD2      HIS  11  -3.279   1.141   2.210
   99    HE1  HIS  11           HE1      HIS  11  -5.920  -1.303   0.004
  100    H    VAL  12           H        VAL  12   1.762  -0.536   1.693
  101    HA   VAL  12           HA       VAL  12   2.576  -2.912   0.193
  102    HB   VAL  12           HB       VAL  12   4.263  -0.916   1.728
  103   HG11  VAL  12          1HG1      VAL  12   5.874  -1.400  -0.107
  104   HG12  VAL  12          2HG1      VAL  12   4.751  -2.604  -0.740
  105   HG13  VAL  12          3HG1      VAL  12   5.485  -2.831   0.849
  106   HG21  VAL  12          3HG2      VAL  12   4.064  -0.234  -1.019
  107   HG22  VAL  12          1HG2      VAL  12   3.506   0.696   0.372
  108   HG23  VAL  12          2HG2      VAL  12   2.421  -0.449  -0.416
  109    H    ALA  13           H        ALA  13   3.888  -1.732   3.285
  110    HA   ALA  13           HA       ALA  13   4.851  -4.231   4.200
  111    HB1  ALA  13           3HB      ALA  13   4.968  -1.646   4.993
  112    HB2  ALA  13           1HB      ALA  13   5.424  -2.984   6.046
  113    HB3  ALA  13           2HB      ALA  13   3.820  -2.264   6.181
  114    H    LYS  14           H        LYS  14   1.853  -2.562   5.262
  115    HA   LYS  14           HA       LYS  14   0.750  -4.485   6.928
  116    HB2  LYS  14           1HB      LYS  14  -0.143  -2.216   6.298
  117    HB3  LYS  14           2HB      LYS  14  -0.728  -2.919   4.790
  118    HG2  LYS  14           1HG      LYS  14  -2.457  -3.989   5.811
  119    HG3  LYS  14           2HG      LYS  14  -1.487  -4.416   7.221
  120    HD2  LYS  14           1HD      LYS  14  -1.909  -1.540   7.047
  121    HD3  LYS  14           2HD      LYS  14  -3.438  -2.418   7.106
  122    HE2  LYS  14           1HE      LYS  14  -1.145  -2.880   9.046
  123    HE3  LYS  14           2HE      LYS  14  -2.562  -1.869   9.393
  124    HZ1  LYS  14           3HZ      LYS  14  -2.494  -4.767   8.782
  125    HZ2  LYS  14           1HZ      LYS  14  -3.919  -3.855   8.657
  126    HZ3  LYS  14           2HZ      LYS  14  -3.132  -4.001  10.157
  127    H    THR  15           H        THR  15  -0.214  -4.271   3.479
  128    HA   THR  15           HA       THR  15  -1.446  -6.817   3.324
  129    HB   THR  15           HB       THR  15   0.093  -5.539   1.094
  130    HG1  THR  15           HG1      THR  15  -1.136  -3.833   1.180
  131   HG21  THR  15          3HG2      THR  15  -1.270  -6.755  -0.233
  132   HG22  THR  15          1HG2      THR  15  -2.701  -6.299   0.693
  133   HG23  THR  15          2HG2      THR  15  -1.695  -7.645   1.228
  134    H    ILE  16           H        ILE  16   1.801  -5.967   2.010
  135    HA   ILE  16           HA       ILE  16   2.709  -8.521   1.360
  136    HB   ILE  16           HB       ILE  16   4.149  -6.199   2.693
  137   HG12  ILE  16          1HG1      ILE  16   4.214  -6.996  -0.218
  138   HG13  ILE  16          2HG1      ILE  16   2.937  -5.955   0.412
  139   HG21  ILE  16          1HG2      ILE  16   5.646  -8.052   0.941
  140   HG22  ILE  16          2HG2      ILE  16   5.152  -8.730   2.492
  141   HG23  ILE  16          3HG2      ILE  16   6.143  -7.273   2.443
  142   HD11  ILE  16          3HD1      ILE  16   4.894  -4.569   1.434
  143   HD12  ILE  16          1HD1      ILE  16   4.562  -4.412  -0.291
  144   HD13  ILE  16          2HD1      ILE  16   5.897  -5.424   0.261
  145    H    HIS  17           H        HIS  17   2.773  -6.943   4.554
  146    HA   HIS  17           HA       HIS  17   3.901  -9.228   5.932
  147    HB2  HIS  17           1HB      HIS  17   3.771  -6.696   6.554
  148    HB3  HIS  17           2HB      HIS  17   2.154  -7.082   7.143
  149    HD1  HIS  17           HD1      HIS  17   5.633  -8.635   7.505
  150    HD2  HIS  17           HD2      HIS  17   2.245  -7.817   9.793
  151    HE1  HIS  17           HE1      HIS  17   6.150  -9.419   9.857
  152    H    ARG  18           H        ARG  18   0.681  -8.236   4.936
  153    HA   ARG  18           HA       ARG  18  -0.701 -10.134   6.706
  154    HB2  ARG  18           1HB      ARG  18  -1.618  -7.942   5.848
  155    HB3  ARG  18           2HB      ARG  18  -1.656  -8.649   4.232
  156    HG2  ARG  18           1HG      ARG  18  -3.091 -10.507   5.189
  157    HG3  ARG  18           2HG      ARG  18  -3.206  -9.556   6.671
  158    HD2  ARG  18           1HD      ARG  18  -3.798  -7.726   4.629
  159    HD3  ARG  18           2HD      ARG  18  -4.658  -9.210   4.173
  160    HE   ARG  18           HE       ARG  18  -5.099  -8.988   6.906
  161   HH11  ARG  18          1HH1      ARG  18  -4.985  -6.310   4.869
  162   HH12  ARG  18          2HH1      ARG  18  -6.600  -5.777   5.195
  163   HH21  ARG  18          1HH2      ARG  18  -7.446  -8.596   7.028
  164   HH22  ARG  18          2HH2      ARG  18  -7.992  -7.070   6.417
  165    H    LEU  19           H        LEU  19   0.262  -9.962   3.290
  166    HA   LEU  19           HA       LEU  19  -0.890 -12.554   2.611
  167    HB2  LEU  19           1HB      LEU  19   0.927 -10.513   1.338
  168    HB3  LEU  19           2HB      LEU  19   0.687 -12.083   0.569
  169    HG   LEU  19           HG       LEU  19  -1.766 -10.673   1.483
  170   HD11  LEU  19          1HD1      LEU  19  -1.816  -9.099  -0.287
  171   HD12  LEU  19          2HD1      LEU  19  -0.445  -9.848  -1.104
  172   HD13  LEU  19          3HD1      LEU  19  -0.194  -8.942   0.388
  173   HD21  LEU  19          3HD2      LEU  19  -0.972 -12.185  -1.027
  174   HD22  LEU  19          1HD2      LEU  19  -2.599 -11.612  -0.660
  175   HD23  LEU  19          2HD2      LEU  19  -1.854 -12.853   0.347
  176    H    VAL  20           H        VAL  20   2.274 -11.300   3.583
  177    HA   VAL  20           HA       VAL  20   3.751 -13.744   3.117
  178    HB   VAL  20           HB       VAL  20   4.120 -11.214   4.720
  179   HG11  VAL  20          1HG1      VAL  20   6.599 -12.466   4.686
  180   HG12  VAL  20          2HG1      VAL  20   5.489 -13.774   5.097
  181   HG13  VAL  20          3HG1      VAL  20   5.542 -12.317   6.089
  182   HG21  VAL  20          3HG2      VAL  20   4.477 -10.975   2.355
  183   HG22  VAL  20          1HG2      VAL  20   5.417 -12.465   2.285
  184   HG23  VAL  20          2HG2      VAL  20   6.075 -11.044   3.097
  185    H    THR  21           H        THR  21   1.836 -12.498   5.817
  186    HA   THR  21           HA       THR  21   2.755 -14.551   7.696
  187    HB   THR  21           HB       THR  21   1.971 -12.234   8.279
  188    HG1  THR  21           HG1      THR  21   0.284 -14.208   9.395
  189   HG21  THR  21          3HG2      THR  21   0.162 -11.781   6.873
  190   HG22  THR  21          1HG2      THR  21  -0.640 -12.131   8.404
  191   HG23  THR  21          2HG2      THR  21  -0.573 -13.361   7.143
  192    H    GLY  22           H        GLY  22   0.219 -14.237   5.311
  193    HA2  GLY  22           1HA      GLY  22  -0.436 -16.890   5.020
  194    HA3  GLY  22           2HA      GLY  22  -1.417 -16.398   6.402
  Start of MODEL   15
    1    H1   PHE   1           1H       PHE   1  -0.416  16.569  -0.958
    2    H2   PHE   1           2H       PHE   1  -0.556  16.109  -2.588
    3    H3   PHE   1           3H       PHE   1   0.625  15.392  -1.599
    4    HA   PHE   1           HA       PHE   1  -2.225  15.145  -0.875
    5    HB2  PHE   1           1HB      PHE   1  -2.098  13.018  -2.306
    6    HB3  PHE   1           2HB      PHE   1  -2.198  14.541  -3.191
    7    HD1  PHE   1           HD2      PHE   1  -0.257  15.452  -4.367
    8    HD2  PHE   1           HD1      PHE   1  -0.017  11.737  -2.226
    9    HE1  PHE   1           HE2      PHE   1   1.891  14.942  -5.495
   10    HE2  PHE   1           HE1      PHE   1   2.132  11.226  -3.354
   11    HZ   PHE   1           HZ       PHE   1   3.086  12.829  -4.988
   12    H    PHE   2           H        PHE   2  -0.412  15.293   1.073
   13    HA   PHE   2           HA       PHE   2   1.223  13.037   1.649
   14    HB2  PHE   2           1HB      PHE   2   0.645  15.457   2.769
   15    HB3  PHE   2           2HB      PHE   2  -0.190  14.377   3.885
   16    HD1  PHE   2           HD1      PHE   2   1.252  12.144   4.443
   17    HD2  PHE   2           HD2      PHE   2   2.859  15.952   3.271
   18    HE1  PHE   2           HE1      PHE   2   3.419  11.554   5.495
   19    HE2  PHE   2           HE2      PHE   2   5.026  15.361   4.322
   20    HZ   PHE   2           HZ       PHE   2   5.306  13.162   5.434
   21    H    HIS   3           H        HIS   3  -2.198  13.307   1.537
   22    HA   HIS   3           HA       HIS   3  -2.818  11.255   3.511
   23    HB2  HIS   3           1HB      HIS   3  -4.205  12.884   1.429
   24    HB3  HIS   3           2HB      HIS   3  -5.016  11.416   1.978
   25    HD1  HIS   3           HD1      HIS   3  -5.450  11.239   4.618
   26    HD2  HIS   3           HD2      HIS   3  -4.304  15.006   3.245
   27    HE1  HIS   3           HE1      HIS   3  -6.006  12.876   6.469
   28    H    HIS   4           H        HIS   4  -3.057  11.317  -0.054
   29    HA   HIS   4           HA       HIS   4  -3.592   8.596  -0.501
   30    HB2  HIS   4           1HB      HIS   4  -2.582  10.923  -1.945
   31    HB3  HIS   4           2HB      HIS   4  -1.911   9.418  -2.574
   32    HD1  HIS   4           HD1      HIS   4  -3.399   9.598  -4.726
   33    HD2  HIS   4           HD2      HIS   4  -5.563   9.323  -1.174
   34    HE1  HIS   4           HE1      HIS   4  -5.791   9.090  -5.383
   35    H    ILE   5           H        ILE   5  -0.356  10.123  -0.642
   36    HA   ILE   5           HA       ILE   5   1.274   7.948  -0.996
   37    HB   ILE   5           HB       ILE   5   1.849  10.371  -0.739
   38   HG12  ILE   5          1HG1      ILE   5   3.441   8.355  -0.565
   39   HG13  ILE   5          2HG1      ILE   5   4.043   9.928  -0.058
   40   HG21  ILE   5          1HG2      ILE   5   2.197  11.286   1.490
   41   HG22  ILE   5          2HG2      ILE   5   1.709   9.759   2.225
   42   HG23  ILE   5          3HG2      ILE   5   0.532  10.728   1.341
   43   HD11  ILE   5          3HD1      ILE   5   3.338   9.285   2.313
   44   HD12  ILE   5          1HD1      ILE   5   4.698   8.381   1.652
   45   HD13  ILE   5          2HD1      ILE   5   3.097   7.651   1.698
   46    H    PHE   6           H        PHE   6  -0.116   9.011   2.098
   47    HA   PHE   6           HA       PHE   6   1.097   7.050   3.769
   48    HB2  PHE   6           1HB      PHE   6  -0.862   9.130   3.886
   49    HB3  PHE   6           2HB      PHE   6  -1.540   7.702   4.666
   50    HD1  PHE   6           HD2      PHE   6   0.768   6.364   5.809
   51    HD2  PHE   6           HD1      PHE   6  -0.125  10.559   5.592
   52    HE1  PHE   6           HE2      PHE   6   2.175   6.767   7.806
   53    HE2  PHE   6           HE1      PHE   6   1.282  10.961   7.592
   54    HZ   PHE   6           HZ       PHE   6   2.434   9.065   8.701
   55    H    ARG   7           H        ARG   7  -1.721   6.888   1.657
   56    HA   ARG   7           HA       ARG   7  -2.670   4.337   2.749
   57    HB2  ARG   7           1HB      ARG   7  -3.375   5.617   0.101
   58    HB3  ARG   7           2HB      ARG   7  -4.391   4.600   1.120
   59    HG2  ARG   7           1HG      ARG   7  -4.013   6.500   2.902
   60    HG3  ARG   7           2HG      ARG   7  -3.628   7.478   1.486
   61    HD2  ARG   7           1HD      ARG   7  -6.003   7.730   1.903
   62    HD3  ARG   7           2HD      ARG   7  -5.840   6.678   0.483
   63    HE   ARG   7           HE       ARG   7  -6.107   5.509   3.223
   64   HH11  ARG   7          1HH1      ARG   7  -5.984   4.556   0.093
   65   HH12  ARG   7          2HH1      ARG   7  -7.532   3.780   0.042
   66   HH21  ARG   7          1HH2      ARG   7  -8.568   5.053   3.097
   67   HH22  ARG   7          2HH2      ARG   7  -8.995   4.062   1.742
   68    H    ALA   8           H        ALA   8  -1.266   5.341  -0.398
   69    HA   ALA   8           HA       ALA   8  -0.996   2.844  -1.621
   70    HB1  ALA   8           3HB      ALA   8   1.092   4.001  -2.641
   71    HB2  ALA   8           1HB      ALA   8   0.667   5.363  -1.602
   72    HB3  ALA   8           2HB      ALA   8  -0.465   4.805  -2.834
   73    H    ILE   9           H        ILE   9   1.124   4.313   0.834
   74    HA   ILE   9           HA       ILE   9   3.093   2.153   0.711
   75    HB   ILE   9           HB       ILE   9   2.540   4.518   2.512
   76   HG12  ILE   9          1HG1      ILE   9   4.896   3.905   0.707
   77   HG13  ILE   9          2HG1      ILE   9   3.475   4.796   0.162
   78   HG21  ILE   9          1HG2      ILE   9   5.136   3.626   3.027
   79   HG22  ILE   9          2HG2      ILE   9   4.164   2.155   3.036
   80   HG23  ILE   9          3HG2      ILE   9   3.753   3.489   4.113
   81   HD11  ILE   9          3HD1      ILE   9   4.679   6.603   0.874
   82   HD12  ILE   9          1HD1      ILE   9   5.653   5.643   1.988
   83   HD13  ILE   9          2HD1      ILE   9   4.025   6.146   2.448
   84    H    VAL  10           H        VAL  10   0.763   3.219   3.226
   85    HA   VAL  10           HA       VAL  10   1.094   1.190   5.101
   86    HB   VAL  10           HB       VAL  10  -1.314   2.691   4.066
   87   HG11  VAL  10          1HG1      VAL  10  -2.537   1.893   6.068
   88   HG12  VAL  10          2HG1      VAL  10  -1.190   0.821   6.453
   89   HG13  VAL  10          3HG1      VAL  10  -2.133   0.562   4.986
   90   HG21  VAL  10          3HG2      VAL  10  -0.778   4.221   5.669
   91   HG22  VAL  10          1HG2      VAL  10   0.815   3.463   5.611
   92   HG23  VAL  10          2HG2      VAL  10  -0.349   2.977   6.844
   93    H    HIS  11           H        HIS  11  -1.008   1.072   2.205
   94    HA   HIS  11           HA       HIS  11  -2.062  -1.536   2.593
   95    HB2  HIS  11           1HB      HIS  11  -1.678   0.421   0.400
   96    HB3  HIS  11           2HB      HIS  11  -1.936  -1.247  -0.115
   97    HD1  HIS  11           HD1      HIS  11  -4.232  -2.321   0.396
   98    HD2  HIS  11           HD2      HIS  11  -3.899   1.603   1.762
   99    HE1  HIS  11           HE1      HIS  11  -6.567  -1.590   1.048
  100    H    VAL  12           H        VAL  12   0.435  -0.773   0.134
  101    HA   VAL  12           HA       VAL  12   1.344  -3.316  -0.434
  102    HB   VAL  12           HB       VAL  12   2.194  -1.349  -1.542
  103   HG11  VAL  12          1HG1      VAL  12   2.042   0.150   0.433
  104   HG12  VAL  12          2HG1      VAL  12   3.598   0.294  -0.384
  105   HG13  VAL  12          3HG1      VAL  12   3.470  -0.628   1.114
  106   HG21  VAL  12          3HG2      VAL  12   4.650  -1.736  -1.398
  107   HG22  VAL  12          1HG2      VAL  12   3.748  -3.249  -1.485
  108   HG23  VAL  12          2HG2      VAL  12   4.394  -2.695   0.059
  109    H    ALA  13           H        ALA  13   2.159  -1.385   2.436
  110    HA   ALA  13           HA       ALA  13   4.127  -3.265   3.460
  111    HB1  ALA  13           3HB      ALA  13   4.459  -1.540   4.895
  112    HB2  ALA  13           1HB      ALA  13   2.770  -1.549   5.402
  113    HB3  ALA  13           2HB      ALA  13   3.253  -0.662   3.955
  114    H    LYS  14           H        LYS  14   0.901  -2.371   4.758
  115    HA   LYS  14           HA       LYS  14   0.594  -4.449   6.607
  116    HB2  LYS  14           1HB      LYS  14  -0.980  -2.663   6.511
  117    HB3  LYS  14           2HB      LYS  14  -1.327  -2.961   4.808
  118    HG2  LYS  14           1HG      LYS  14  -2.302  -5.171   5.427
  119    HG3  LYS  14           2HG      LYS  14  -2.035  -4.782   7.127
  120    HD2  LYS  14           1HD      LYS  14  -4.134  -3.913   7.033
  121    HD3  LYS  14           2HD      LYS  14  -3.345  -2.538   6.259
  122    HE2  LYS  14           1HE      LYS  14  -3.730  -3.622   4.031
  123    HE3  LYS  14           2HE      LYS  14  -4.651  -4.896   4.856
  124    HZ1  LYS  14           3HZ      LYS  14  -5.210  -2.005   5.212
  125    HZ2  LYS  14           1HZ      LYS  14  -6.168  -3.314   5.706
  126    HZ3  LYS  14           2HZ      LYS  14  -6.007  -2.958   4.053
  127    H    THR  15           H        THR  15  -0.245  -4.489   3.131
  128    HA   THR  15           HA       THR  15  -1.359  -7.105   3.013
  129    HB   THR  15           HB       THR  15   0.358  -5.883   0.886
  130    HG1  THR  15           HG1      THR  15  -2.306  -5.103   1.225
  131   HG21  THR  15          3HG2      THR  15  -0.818  -7.221  -0.509
  132   HG22  THR  15          1HG2      THR  15  -2.349  -6.829   0.275
  133   HG23  THR  15          2HG2      THR  15  -1.302  -8.073   0.958
  134    H    ILE  16           H        ILE  16   1.948  -6.169   1.936
  135    HA   ILE  16           HA       ILE  16   3.031  -8.725   1.624
  136    HB   ILE  16           HB       ILE  16   4.217  -6.167   2.757
  137   HG12  ILE  16          1HG1      ILE  16   4.746  -7.330   0.040
  138   HG13  ILE  16          2HG1      ILE  16   3.239  -6.459   0.322
  139   HG21  ILE  16          1HG2      ILE  16   5.410  -8.849   2.267
  140   HG22  ILE  16          2HG2      ILE  16   5.894  -7.594   3.408
  141   HG23  ILE  16          3HG2      ILE  16   6.343  -7.460   1.707
  142   HD11  ILE  16          3HD1      ILE  16   4.412  -4.571  -0.082
  143   HD12  ILE  16          1HD1      ILE  16   5.955  -5.418   0.033
  144   HD13  ILE  16          2HD1      ILE  16   5.162  -4.827   1.494
  145    H    HIS  17           H        HIS  17   2.702  -6.823   4.608
  146    HA   HIS  17           HA       HIS  17   3.872  -8.818   6.344
  147    HB2  HIS  17           1HB      HIS  17   3.524  -6.320   6.749
  148    HB3  HIS  17           2HB      HIS  17   1.816  -6.684   7.006
  149    HD1  HIS  17           HD1      HIS  17   2.288  -5.830   9.526
  150    HD2  HIS  17           HD2      HIS  17   4.156  -9.396   8.442
  151    HE1  HIS  17           HE1      HIS  17   3.012  -6.943  11.682
  152    H    ARG  18           H        ARG  18   0.686  -8.273   4.952
  153    HA   ARG  18           HA       ARG  18  -0.662 -10.175   6.753
  154    HB2  ARG  18           1HB      ARG  18  -1.583  -8.101   5.450
  155    HB3  ARG  18           2HB      ARG  18  -1.644  -9.196   4.071
  156    HG2  ARG  18           1HG      ARG  18  -2.771 -10.314   6.554
  157    HG3  ARG  18           2HG      ARG  18  -3.651  -8.923   5.917
  158    HD2  ARG  18           1HD      ARG  18  -3.373 -10.206   3.611
  159    HD3  ARG  18           2HD      ARG  18  -3.222 -11.618   4.675
  160    HE   ARG  18           HE       ARG  18  -5.400 -10.862   5.728
  161   HH11  ARG  18          1HH1      ARG  18  -4.601  -8.804   3.192
  162   HH12  ARG  18          2HH1      ARG  18  -6.141  -8.893   2.404
  163   HH21  ARG  18          1HH2      ARG  18  -7.342 -11.417   4.458
  164   HH22  ARG  18          2HH2      ARG  18  -7.693 -10.374   3.122
  165    H    LEU  19           H        LEU  19   0.495 -10.118   3.387
  166    HA   LEU  19           HA       LEU  19  -0.262 -12.854   2.800
  167    HB2  LEU  19           1HB      LEU  19   0.002 -11.221   1.040
  168    HB3  LEU  19           2HB      LEU  19   1.634 -10.827   1.578
  169    HG   LEU  19           HG       LEU  19   2.119 -13.359   1.149
  170   HD11  LEU  19          1HD1      LEU  19   0.199 -13.289  -1.059
  171   HD12  LEU  19          2HD1      LEU  19  -0.589 -13.313   0.519
  172   HD13  LEU  19          3HD1      LEU  19   0.548 -14.588   0.082
  173   HD21  LEU  19          3HD2      LEU  19   2.393 -11.017  -0.366
  174   HD22  LEU  19          1HD2      LEU  19   1.738 -12.202  -1.496
  175   HD23  LEU  19          2HD2      LEU  19   3.239 -12.540  -0.634
  176    H    VAL  20           H        VAL  20   2.590 -11.241   4.107
  177    HA   VAL  20           HA       VAL  20   4.374 -13.517   3.901
  178    HB   VAL  20           HB       VAL  20   4.286 -10.907   5.412
  179   HG11  VAL  20          1HG1      VAL  20   5.412 -12.417   6.935
  180   HG12  VAL  20          2HG1      VAL  20   6.639 -11.431   6.140
  181   HG13  VAL  20          3HG1      VAL  20   6.374 -13.095   5.622
  182   HG21  VAL  20          3HG2      VAL  20   5.732 -10.171   3.780
  183   HG22  VAL  20          1HG2      VAL  20   4.950 -11.452   2.853
  184   HG23  VAL  20          2HG2      VAL  20   6.513 -11.744   3.618
  185    H    THR  21           H        THR  21   2.149 -12.312   6.389
  186    HA   THR  21           HA       THR  21   3.010 -14.282   8.379
  187    HB   THR  21           HB       THR  21   2.044 -11.934   8.742
  188    HG1  THR  21           HG1      THR  21   0.601 -12.861  10.476
  189   HG21  THR  21          3HG2      THR  21  -0.074 -13.073   7.237
  190   HG22  THR  21          1HG2      THR  21  -0.009 -11.466   7.959
  191   HG23  THR  21          2HG2      THR  21  -0.689 -12.816   8.869
  192    H    GLY  22           H        GLY  22   0.781 -14.210   5.730
  193    HA2  GLY  22           1HA      GLY  22  -0.830 -16.447   6.797
  194    HA3  GLY  22           2HA      GLY  22  -1.105 -15.613   5.267
  Start of MODEL   16
    1    H1   PHE   1           1H       PHE   1  -3.418  11.670  -2.424
    2    H2   PHE   1           2H       PHE   1  -3.904  13.264  -2.756
    3    H3   PHE   1           3H       PHE   1  -3.806  12.718  -1.149
    4    HA   PHE   1           HA       PHE   1  -1.372  12.610  -2.792
    5    HB2  PHE   1           1HB      PHE   1  -3.007  14.971  -2.133
    6    HB3  PHE   1           2HB      PHE   1  -1.321  15.111  -1.630
    7    HD1  PHE   1           HD1      PHE   1  -2.367  13.007  -4.466
    8    HD2  PHE   1           HD2      PHE   1  -0.742  16.804  -3.288
    9    HE1  PHE   1           HE1      PHE   1  -1.702  13.449  -6.814
   10    HE2  PHE   1           HE2      PHE   1  -0.077  17.248  -5.636
   11    HZ   PHE   1           HZ       PHE   1  -0.557  15.570  -7.399
   12    H    PHE   2           H        PHE   2  -2.800  13.880   0.249
   13    HA   PHE   2           HA       PHE   2  -0.439  13.393   1.828
   14    HB2  PHE   2           1HB      PHE   2  -3.370  13.779   2.513
   15    HB3  PHE   2           2HB      PHE   2  -2.061  13.834   3.695
   16    HD1  PHE   2           HD1      PHE   2   0.069  15.222   2.206
   17    HD2  PHE   2           HD2      PHE   2  -4.155  15.992   2.347
   18    HE1  PHE   2           HE1      PHE   2   0.483  17.601   1.638
   19    HE2  PHE   2           HE2      PHE   2  -3.741  18.370   1.779
   20    HZ   PHE   2           HZ       PHE   2  -1.422  19.174   1.424
   21    H    HIS   3           H        HIS   3  -3.521  11.934   2.734
   22    HA   HIS   3           HA       HIS   3  -2.641   9.679   4.026
   23    HB2  HIS   3           1HB      HIS   3  -4.813   8.659   3.121
   24    HB3  HIS   3           2HB      HIS   3  -4.964  10.226   3.911
   25    HD1  HIS   3           HD1      HIS   3  -4.424   8.886   0.374
   26    HD2  HIS   3           HD2      HIS   3  -6.253  12.083   2.328
   27    HE1  HIS   3           HE1      HIS   3  -5.600  10.242  -1.413
   28    H    HIS   4           H        HIS   4  -2.578  10.220   0.554
   29    HA   HIS   4           HA       HIS   4  -2.284   7.559  -0.383
   30    HB2  HIS   4           1HB      HIS   4  -1.871  10.292  -1.275
   31    HB3  HIS   4           2HB      HIS   4  -0.644   9.211  -1.939
   32    HD1  HIS   4           HD1      HIS   4  -1.479   8.746  -4.266
   33    HD2  HIS   4           HD2      HIS   4  -4.491   8.332  -1.414
   34    HE1  HIS   4           HE1      HIS   4  -3.496   7.817  -5.484
   35    H    ILE   5           H        ILE   5   0.267   9.892   0.534
   36    HA   ILE   5           HA       ILE   5   2.479   8.135   0.125
   37    HB   ILE   5           HB       ILE   5   3.715   9.791   1.291
   38   HG12  ILE   5          1HG1      ILE   5   1.154  10.481   2.763
   39   HG13  ILE   5          2HG1      ILE   5   2.510   9.582   3.437
   40   HG21  ILE   5          1HG2      ILE   5   3.002  11.790   0.319
   41   HG22  ILE   5          2HG2      ILE   5   1.300  11.447   0.632
   42   HG23  ILE   5          3HG2      ILE   5   2.149  10.594  -0.657
   43   HD11  ILE   5          3HD1      ILE   5   2.445  12.049   4.000
   44   HD12  ILE   5          1HD1      ILE   5   2.782  12.365   2.300
   45   HD13  ILE   5          2HD1      ILE   5   3.951  11.481   3.281
   46    H    PHE   6           H        PHE   6   0.518   8.797   3.000
   47    HA   PHE   6           HA       PHE   6   1.890   6.964   4.751
   48    HB2  PHE   6           1HB      PHE   6   0.062   8.965   4.982
   49    HB3  PHE   6           2HB      PHE   6  -0.985   7.559   5.169
   50    HD1  PHE   6           HD1      PHE   6   1.217   5.735   6.344
   51    HD2  PHE   6           HD2      PHE   6  -0.101   9.711   7.282
   52    HE1  PHE   6           HE1      PHE   6   1.992   5.442   8.678
   53    HE2  PHE   6           HE2      PHE   6   0.675   9.419   9.614
   54    HZ   PHE   6           HZ       PHE   6   1.724   7.283  10.317
   55    H    ARG   7           H        ARG   7  -0.666   6.538   2.360
   56    HA   ARG   7           HA       ARG   7  -1.423   3.894   3.419
   57    HB2  ARG   7           1HB      ARG   7  -3.231   4.150   2.027
   58    HB3  ARG   7           2HB      ARG   7  -2.730   5.835   2.062
   59    HG2  ARG   7           1HG      ARG   7  -1.510   5.567  -0.026
   60    HG3  ARG   7           2HG      ARG   7  -1.831   3.835  -0.034
   61    HD2  ARG   7           1HD      ARG   7  -3.833   6.087  -0.374
   62    HD3  ARG   7           2HD      ARG   7  -3.465   4.774  -1.509
   63    HE   ARG   7           HE       ARG   7  -4.418   3.195   0.189
   64   HH11  ARG   7          1HH1      ARG   7  -4.490   6.282   1.498
   65   HH12  ARG   7          2HH1      ARG   7  -6.146   6.225   2.000
   66   HH21  ARG   7          1HH2      ARG   7  -6.806   3.228   0.383
   67   HH22  ARG   7          2HH2      ARG   7  -7.459   4.495   1.368
   68    H    ALA   8           H        ALA   8   0.316   5.172   0.575
   69    HA   ALA   8           HA       ALA   8   0.813   2.713  -0.750
   70    HB1  ALA   8           3HB      ALA   8   1.197   5.147  -1.466
   71    HB2  ALA   8           1HB      ALA   8   2.442   3.992  -1.945
   72    HB3  ALA   8           2HB      ALA   8   2.712   5.062  -0.568
   73    H    ILE   9           H        ILE   9   2.724   4.371   1.783
   74    HA   ILE   9           HA       ILE   9   4.774   2.295   1.829
   75    HB   ILE   9           HB       ILE   9   5.661   3.664   3.629
   76   HG12  ILE   9          1HG1      ILE   9   2.905   4.931   3.630
   77   HG13  ILE   9          2HG1      ILE   9   3.623   3.975   4.927
   78   HG21  ILE   9          1HG2      ILE   9   5.832   5.780   2.500
   79   HG22  ILE   9          2HG2      ILE   9   4.293   5.529   1.675
   80   HG23  ILE   9          3HG2      ILE   9   5.693   4.544   1.250
   81   HD11  ILE   9          3HD1      ILE   9   3.750   6.479   5.275
   82   HD12  ILE   9          1HD1      ILE   9   4.839   6.546   3.890
   83   HD13  ILE   9          2HD1      ILE   9   5.305   5.650   5.335
   84    H    VAL  10           H        VAL  10   1.884   3.084   3.737
   85    HA   VAL  10           HA       VAL  10   2.387   1.140   5.828
   86    HB   VAL  10           HB       VAL  10   0.037   2.751   4.831
   87   HG11  VAL  10          1HG1      VAL  10   0.087   0.723   7.082
   88   HG12  VAL  10          2HG1      VAL  10  -0.960   0.710   5.663
   89   HG13  VAL  10          3HG1      VAL  10  -1.164   1.953   6.897
   90   HG21  VAL  10          3HG2      VAL  10   0.355   3.954   6.909
   91   HG22  VAL  10          1HG2      VAL  10   1.928   3.806   6.128
   92   HG23  VAL  10          2HG2      VAL  10   1.514   2.752   7.479
   93    H    HIS  11           H        HIS  11   0.293   1.131   2.922
   94    HA   HIS  11           HA       HIS  11  -0.738  -1.525   3.325
   95    HB2  HIS  11           1HB      HIS  11  -0.550   0.488   1.111
   96    HB3  HIS  11           2HB      HIS  11  -1.070  -1.152   0.716
   97    HD1  HIS  11           HD1      HIS  11  -3.546  -1.332   0.761
   98    HD2  HIS  11           HD2      HIS  11  -2.165   1.326   3.661
   99    HE1  HIS  11           HE1      HIS  11  -5.592  -0.489   1.994
  100    H    VAL  12           H        VAL  12   1.813  -0.323   1.093
  101    HA   VAL  12           HA       VAL  12   2.626  -2.673  -0.118
  102    HB   VAL  12           HB       VAL  12   3.602  -0.471  -0.538
  103   HG11  VAL  12          1HG1      VAL  12   5.053   0.622   1.051
  104   HG12  VAL  12          2HG1      VAL  12   5.003  -0.771   2.131
  105   HG13  VAL  12          3HG1      VAL  12   3.559   0.211   1.894
  106   HG21  VAL  12          3HG2      VAL  12   5.657  -1.290  -1.132
  107   HG22  VAL  12          1HG2      VAL  12   4.965  -2.819  -0.592
  108   HG23  VAL  12          2HG2      VAL  12   5.999  -1.889   0.491
  109    H    ALA  13           H        ALA  13   3.637  -1.557   3.133
  110    HA   ALA  13           HA       ALA  13   5.177  -3.995   3.643
  111    HB1  ALA  13           3HB      ALA  13   5.135  -2.864   5.997
  112    HB2  ALA  13           1HB      ALA  13   4.346  -1.526   5.162
  113    HB3  ALA  13           2HB      ALA  13   5.967  -2.030   4.684
  114    H    LYS  14           H        LYS  14   2.263  -2.566   5.175
  115    HA   LYS  14           HA       LYS  14   1.535  -4.751   6.790
  116    HB2  LYS  14           1HB      LYS  14   0.515  -2.578   6.975
  117    HB3  LYS  14           2HB      LYS  14  -0.067  -2.648   5.312
  118    HG2  LYS  14           1HG      LYS  14  -1.985  -3.508   6.120
  119    HG3  LYS  14           2HG      LYS  14  -1.075  -4.968   6.514
  120    HD2  LYS  14           1HD      LYS  14  -1.174  -2.573   8.354
  121    HD3  LYS  14           2HD      LYS  14  -2.335  -3.897   8.455
  122    HE2  LYS  14           1HE      LYS  14  -0.138  -5.381   8.465
  123    HE3  LYS  14           2HE      LYS  14   0.584  -3.894   9.105
  124    HZ1  LYS  14           3HZ      LYS  14  -1.307  -3.776  10.678
  125    HZ2  LYS  14           1HZ      LYS  14  -0.318  -5.130  10.932
  126    HZ3  LYS  14           2HZ      LYS  14  -1.814  -5.308  10.146
  127    H    THR  15           H        THR  15   0.323  -4.018   3.488
  128    HA   THR  15           HA       THR  15  -1.333  -6.250   3.100
  129    HB   THR  15           HB       THR  15   0.559  -5.105   1.066
  130    HG1  THR  15           HG1      THR  15  -1.888  -4.040   2.027
  131   HG21  THR  15          3HG2      THR  15  -0.841  -5.987  -0.489
  132   HG22  THR  15          1HG2      THR  15  -2.282  -5.581   0.446
  133   HG23  THR  15          2HG2      THR  15  -1.356  -7.031   0.838
  134    H    ILE  16           H        ILE  16   2.002  -6.066   1.772
  135    HA   ILE  16           HA       ILE  16   2.347  -8.738   1.077
  136    HB   ILE  16           HB       ILE  16   4.174  -6.627   2.234
  137   HG12  ILE  16          1HG1      ILE  16   4.503  -7.890  -0.450
  138   HG13  ILE  16          2HG1      ILE  16   3.101  -6.846  -0.217
  139   HG21  ILE  16          1HG2      ILE  16   6.052  -8.196   1.428
  140   HG22  ILE  16          2HG2      ILE  16   4.844  -9.478   1.495
  141   HG23  ILE  16          3HG2      ILE  16   5.279  -8.599   2.960
  142   HD11  ILE  16          3HD1      ILE  16   5.737  -6.030  -0.764
  143   HD12  ILE  16          1HD1      ILE  16   5.467  -5.634   0.933
  144   HD13  ILE  16          2HD1      ILE  16   4.383  -4.998  -0.304
  145    H    HIS  17           H        HIS  17   3.006  -7.282   4.277
  146    HA   HIS  17           HA       HIS  17   3.624  -9.768   5.584
  147    HB2  HIS  17           1HB      HIS  17   3.832  -7.138   6.175
  148    HB3  HIS  17           2HB      HIS  17   2.357  -7.510   7.068
  149    HD1  HIS  17           HD1      HIS  17   3.647 -10.608   7.378
  150    HD2  HIS  17           HD2      HIS  17   5.081  -6.976   8.840
  151    HE1  HIS  17           HE1      HIS  17   5.156 -11.169   9.332
  152    H    ARG  18           H        ARG  18   0.638  -8.165   4.687
  153    HA   ARG  18           HA       ARG  18  -1.042  -9.758   6.503
  154    HB2  ARG  18           1HB      ARG  18  -1.400  -7.390   5.442
  155    HB3  ARG  18           2HB      ARG  18  -1.937  -8.289   4.023
  156    HG2  ARG  18           1HG      ARG  18  -3.635  -9.440   5.357
  157    HG3  ARG  18           2HG      ARG  18  -3.071  -8.624   6.816
  158    HD2  ARG  18           1HD      ARG  18  -3.745  -6.462   5.954
  159    HD3  ARG  18           2HD      ARG  18  -4.125  -7.165   4.369
  160    HE   ARG  18           HE       ARG  18  -5.524  -8.329   6.706
  161   HH11  ARG  18          1HH1      ARG  18  -5.986  -8.061   3.535
  162   HH12  ARG  18          2HH1      ARG  18  -7.500  -7.220   3.577
  163   HH21  ARG  18          1HH2      ARG  18  -7.289  -6.466   6.955
  164   HH22  ARG  18          2HH2      ARG  18  -8.237  -6.317   5.513
  165    H    LEU  19           H        LEU  19  -0.371  -9.674   2.997
  166    HA   LEU  19           HA       LEU  19  -1.908 -12.051   2.397
  167    HB2  LEU  19           1HB      LEU  19   0.315 -10.548   0.979
  168    HB3  LEU  19           2HB      LEU  19  -0.619 -11.847   0.233
  169    HG   LEU  19           HG       LEU  19  -1.945  -9.431   1.475
  170   HD11  LEU  19          1HD1      LEU  19  -1.032  -9.839  -1.390
  171   HD12  LEU  19          2HD1      LEU  19  -0.464  -8.596  -0.275
  172   HD13  LEU  19          3HD1      LEU  19  -2.127  -8.560  -0.862
  173   HD21  LEU  19          3HD2      LEU  19  -2.885 -11.880   0.469
  174   HD22  LEU  19          1HD2      LEU  19  -3.219 -10.707  -0.806
  175   HD23  LEU  19          2HD2      LEU  19  -3.852 -10.447   0.820
  176    H    VAL  20           H        VAL  20   1.464 -11.399   3.269
  177    HA   VAL  20           HA       VAL  20   2.452 -14.064   2.691
  178    HB   VAL  20           HB       VAL  20   3.355 -11.682   4.313
  179   HG11  VAL  20          1HG1      VAL  20   4.140 -13.679   5.517
  180   HG12  VAL  20          2HG1      VAL  20   5.489 -12.876   4.714
  181   HG13  VAL  20          3HG1      VAL  20   4.792 -14.338   4.016
  182   HG21  VAL  20          3HG2      VAL  20   5.270 -11.967   2.568
  183   HG22  VAL  20          1HG2      VAL  20   3.720 -11.340   2.006
  184   HG23  VAL  20          2HG2      VAL  20   4.138 -13.030   1.731
  185    H    THR  21           H        THR  21   0.823 -12.567   5.425
  186    HA   THR  21           HA       THR  21   1.465 -14.712   7.311
  187    HB   THR  21           HB       THR  21  -0.372 -12.314   7.233
  188    HG1  THR  21           HG1      THR  21   1.065 -11.701   8.927
  189   HG21  THR  21          3HG2      THR  21  -0.138 -14.453   9.358
  190   HG22  THR  21          1HG2      THR  21  -1.601 -13.893   8.546
  191   HG23  THR  21          2HG2      THR  21  -0.768 -12.839   9.689
  192    H    GLY  22           H        GLY  22  -1.109 -13.992   5.025
  193    HA2  GLY  22           1HA      GLY  22  -3.029 -15.869   6.098
  194    HA3  GLY  22           2HA      GLY  22  -3.070 -15.173   4.477
  Start of MODEL   17
    1    H1   PHE   1           1H       PHE   1  -2.963  13.395  -1.212
    2    H2   PHE   1           2H       PHE   1  -2.923  14.336  -2.625
    3    H3   PHE   1           3H       PHE   1  -2.686  15.064  -1.109
    4    HA   PHE   1           HA       PHE   1  -0.824  13.424  -2.694
    5    HB2  PHE   1           1HB      PHE   1  -1.196  16.094  -2.077
    6    HB3  PHE   1           2HB      PHE   1   0.036  15.603  -0.915
    7    HD1  PHE   1           HD1      PHE   1   2.148  14.497  -1.738
    8    HD2  PHE   1           HD2      PHE   1  -0.693  16.315  -4.398
    9    HE1  PHE   1           HE1      PHE   1   3.862  14.554  -3.530
   10    HE2  PHE   1           HE2      PHE   1   1.021  16.373  -6.189
   11    HZ   PHE   1           HZ       PHE   1   3.299  15.492  -5.755
   12    H    PHE   2           H        PHE   2  -0.742  14.817   0.595
   13    HA   PHE   2           HA       PHE   2   1.004  12.783   1.633
   14    HB2  PHE   2           1HB      PHE   2  -0.908  14.651   3.072
   15    HB3  PHE   2           2HB      PHE   2   0.545  13.914   3.750
   16    HD1  PHE   2           HD1      PHE   2   2.772  14.356   2.401
   17    HD2  PHE   2           HD2      PHE   2  -0.757  16.789   2.140
   18    HE1  PHE   2           HE1      PHE   2   4.135  16.240   1.540
   19    HE2  PHE   2           HE2      PHE   2   0.606  18.674   1.279
   20    HZ   PHE   2           HZ       PHE   2   3.052  18.399   0.980
   21    H    HIS   3           H        HIS   3  -2.471  12.990   1.290
   22    HA   HIS   3           HA       HIS   3  -3.133  10.981   3.281
   23    HB2  HIS   3           1HB      HIS   3  -4.503  12.335   0.960
   24    HB3  HIS   3           2HB      HIS   3  -5.309  11.042   1.849
   25    HD1  HIS   3           HD1      HIS   3  -4.110  11.808   4.678
   26    HD2  HIS   3           HD2      HIS   3  -6.001  14.453   2.070
   27    HE1  HIS   3           HE1      HIS   3  -4.953  13.731   6.095
   28    H    HIS   4           H        HIS   4  -2.351  10.934  -0.163
   29    HA   HIS   4           HA       HIS   4  -3.211   8.232  -0.687
   30    HB2  HIS   4           1HB      HIS   4  -1.348  10.234  -1.951
   31    HB3  HIS   4           2HB      HIS   4  -1.501   8.608  -2.618
   32    HD1  HIS   4           HD1      HIS   4  -3.185   8.532  -4.442
   33    HD2  HIS   4           HD2      HIS   4  -4.248  11.299  -1.511
   34    HE1  HIS   4           HE1      HIS   4  -5.386   9.545  -5.178
   35    H    ILE   5           H        ILE   5   0.100   9.524  -0.352
   36    HA   ILE   5           HA       ILE   5   1.563   7.165  -0.285
   37    HB   ILE   5           HB       ILE   5   3.232   8.428   0.868
   38   HG12  ILE   5          1HG1      ILE   5   0.948  10.082   1.988
   39   HG13  ILE   5          2HG1      ILE   5   1.928   8.925   2.891
   40   HG21  ILE   5          1HG2      ILE   5   1.557  10.671  -0.205
   41   HG22  ILE   5          2HG2      ILE   5   2.166   9.432  -1.304
   42   HG23  ILE   5          3HG2      ILE   5   3.294  10.411  -0.364
   43   HD11  ILE   5          3HD1      ILE   5   2.670  11.265   3.235
   44   HD12  ILE   5          1HD1      ILE   5   3.001  11.394   1.509
   45   HD13  ILE   5          2HD1      ILE   5   3.925  10.267   2.502
   46    H    PHE   6           H        PHE   6  -0.128   8.684   2.441
   47    HA   PHE   6           HA       PHE   6   0.555   6.912   4.514
   48    HB2  PHE   6           1HB      PHE   6  -1.596   8.794   3.828
   49    HB3  PHE   6           2HB      PHE   6  -2.101   7.537   4.955
   50    HD1  PHE   6           HD2      PHE   6   0.059   6.961   6.654
   51    HD2  PHE   6           HD1      PHE   6  -0.986  10.751   4.930
   52    HE1  PHE   6           HE2      PHE   6   1.233   8.123   8.500
   53    HE2  PHE   6           HE1      PHE   6   0.189  11.915   6.776
   54    HZ   PHE   6           HZ       PHE   6   1.300  10.602   8.562
   55    H    ARG   7           H        ARG   7  -1.805   6.486   1.912
   56    HA   ARG   7           HA       ARG   7  -2.844   3.969   3.037
   57    HB2  ARG   7           1HB      ARG   7  -3.196   5.136   0.261
   58    HB3  ARG   7           2HB      ARG   7  -4.286   4.040   1.111
   59    HG2  ARG   7           1HG      ARG   7  -4.910   5.730   2.680
   60    HG3  ARG   7           2HG      ARG   7  -3.608   6.793   2.150
   61    HD2  ARG   7           1HD      ARG   7  -5.121   7.749   0.751
   62    HD3  ARG   7           2HD      ARG   7  -5.067   6.245  -0.188
   63    HE   ARG   7           HE       ARG   7  -7.267   7.048   1.453
   64   HH11  ARG   7          1HH1      ARG   7  -5.722   4.440  -0.065
   65   HH12  ARG   7          2HH1      ARG   7  -6.704   3.220   0.675
   66   HH21  ARG   7          1HH2      ARG   7  -8.344   5.439   2.775
   67   HH22  ARG   7          2HH2      ARG   7  -8.188   3.786   2.283
   68    H    ALA   8           H        ALA   8  -1.329   4.767  -0.099
   69    HA   ALA   8           HA       ALA   8  -0.660   2.249  -1.024
   70    HB1  ALA   8           3HB      ALA   8   1.255   4.596  -1.035
   71    HB2  ALA   8           1HB      ALA   8  -0.224   4.580  -1.996
   72    HB3  ALA   8           2HB      ALA   8   1.033   3.378  -2.292
   73    H    ILE   9           H        ILE   9   1.531   4.228   1.026
   74    HA   ILE   9           HA       ILE   9   3.545   2.339   1.488
   75    HB   ILE   9           HB       ILE   9   2.291   4.484   3.218
   76   HG12  ILE   9          1HG1      ILE   9   4.813   4.318   1.536
   77   HG13  ILE   9          2HG1      ILE   9   3.377   5.281   1.185
   78   HG21  ILE   9          1HG2      ILE   9   4.306   2.462   3.893
   79   HG22  ILE   9          2HG2      ILE   9   3.417   3.557   4.951
   80   HG23  ILE   9          3HG2      ILE   9   4.878   4.113   4.133
   81   HD11  ILE   9          3HD1      ILE   9   3.751   6.683   3.106
   82   HD12  ILE   9          1HD1      ILE   9   5.280   6.578   2.234
   83   HD13  ILE   9          2HD1      ILE   9   5.032   5.624   3.697
   84    H    VAL  10           H        VAL  10   0.993   3.000   3.914
   85    HA   VAL  10           HA       VAL  10   1.336   0.768   5.540
   86    HB   VAL  10           HB       VAL  10  -1.109   2.307   4.646
   87   HG11  VAL  10          1HG1      VAL  10  -2.213   1.291   6.682
   88   HG12  VAL  10          2HG1      VAL  10  -0.880   0.140   6.752
   89   HG13  VAL  10          3HG1      VAL  10  -1.956   0.161   5.355
   90   HG21  VAL  10          3HG2      VAL  10  -0.346   2.477   7.435
   91   HG22  VAL  10          1HG2      VAL  10  -0.450   3.765   6.235
   92   HG23  VAL  10          2HG2      VAL  10   1.038   2.833   6.402
   93    H    HIS  11           H        HIS  11  -0.847   0.953   2.699
   94    HA   HIS  11           HA       HIS  11  -1.880  -1.641   2.692
   95    HB2  HIS  11           1HB      HIS  11  -1.234   0.471   0.716
   96    HB3  HIS  11           2HB      HIS  11  -1.489  -1.137   0.042
   97    HD1  HIS  11           HD1      HIS  11  -3.839  -2.251   0.462
   98    HD2  HIS  11           HD2      HIS  11  -3.556   1.708   1.735
   99    HE1  HIS  11           HE1      HIS  11  -6.208  -1.465   0.885
  100    H    VAL  12           H        VAL  12   1.357  -0.579   1.740
  101    HA   VAL  12           HA       VAL  12   2.137  -3.072   0.476
  102    HB   VAL  12           HB       VAL  12   3.886  -0.956   1.757
  103   HG11  VAL  12          1HG1      VAL  12   5.420  -1.565  -0.068
  104   HG12  VAL  12          2HG1      VAL  12   4.253  -2.749  -0.658
  105   HG13  VAL  12          3HG1      VAL  12   5.021  -2.973   0.916
  106   HG21  VAL  12          3HG2      VAL  12   1.900  -0.630  -0.265
  107   HG22  VAL  12          1HG2      VAL  12   3.486  -0.493  -1.026
  108   HG23  VAL  12          2HG2      VAL  12   3.064   0.555   0.327
  109    H    ALA  13           H        ALA  13   3.617  -1.653   3.385
  110    HA   ALA  13           HA       ALA  13   4.692  -4.023   4.445
  111    HB1  ALA  13           3HB      ALA  13   4.999  -1.558   5.098
  112    HB2  ALA  13           1HB      ALA  13   4.979  -2.718   6.426
  113    HB3  ALA  13           2HB      ALA  13   3.546  -1.750   6.080
  114    H    LYS  14           H        LYS  14   1.372  -2.938   4.453
  115    HA   LYS  14           HA       LYS  14   0.520  -4.653   6.668
  116    HB2  LYS  14           1HB      LYS  14  -0.670  -2.617   6.225
  117    HB3  LYS  14           2HB      LYS  14  -0.865  -3.028   4.521
  118    HG2  LYS  14           1HG      LYS  14  -2.951  -3.426   5.811
  119    HG3  LYS  14           2HG      LYS  14  -2.312  -4.917   5.116
  120    HD2  LYS  14           1HD      LYS  14  -2.253  -5.819   7.174
  121    HD3  LYS  14           2HD      LYS  14  -1.073  -4.598   7.650
  122    HE2  LYS  14           1HE      LYS  14  -2.709  -3.182   8.564
  123    HE3  LYS  14           2HE      LYS  14  -4.011  -3.916   7.608
  124    HZ1  LYS  14           3HZ      LYS  14  -2.445  -5.323   9.706
  125    HZ2  LYS  14           1HZ      LYS  14  -3.745  -5.964   8.824
  126    HZ3  LYS  14           2HZ      LYS  14  -4.009  -4.698   9.927
  127    H    THR  15           H        THR  15  -0.386  -4.663   3.193
  128    HA   THR  15           HA       THR  15  -1.503  -7.280   3.173
  129    HB   THR  15           HB       THR  15  -0.053  -6.046   0.868
  130    HG1  THR  15           HG1      THR  15  -2.583  -5.204   1.813
  131   HG21  THR  15          3HG2      THR  15  -1.757  -8.194   1.122
  132   HG22  THR  15          1HG2      THR  15  -1.434  -7.331  -0.382
  133   HG23  THR  15          2HG2      THR  15  -2.842  -6.908   0.592
  134    H    ILE  16           H        ILE  16   1.707  -6.265   1.897
  135    HA   ILE  16           HA       ILE  16   2.780  -8.747   1.251
  136    HB   ILE  16           HB       ILE  16   4.018  -6.346   2.638
  137   HG12  ILE  16          1HG1      ILE  16   4.247  -7.200  -0.253
  138   HG13  ILE  16          2HG1      ILE  16   2.930  -6.171   0.311
  139   HG21  ILE  16          1HG2      ILE  16   6.071  -7.497   1.285
  140   HG22  ILE  16          2HG2      ILE  16   5.180  -8.936   1.780
  141   HG23  ILE  16          3HG2      ILE  16   5.753  -7.793   2.993
  142   HD11  ILE  16          3HD1      ILE  16   5.864  -5.577   0.157
  143   HD12  ILE  16          1HD1      ILE  16   4.896  -4.780   1.397
  144   HD13  ILE  16          2HD1      ILE  16   4.495  -4.568  -0.309
  145    H    HIS  17           H        HIS  17   2.798  -7.214   4.483
  146    HA   HIS  17           HA       HIS  17   3.944  -9.524   5.802
  147    HB2  HIS  17           1HB      HIS  17   3.714  -6.956   6.441
  148    HB3  HIS  17           2HB      HIS  17   2.199  -7.494   7.169
  149    HD1  HIS  17           HD1      HIS  17   5.814  -8.750   7.140
  150    HD2  HIS  17           HD2      HIS  17   2.614  -8.288   9.772
  151    HE1  HIS  17           HE1      HIS  17   6.626  -9.549   9.402
  152    H    ARG  18           H        ARG  18   0.739  -8.595   4.773
  153    HA   ARG  18           HA       ARG  18  -0.654 -10.466   6.562
  154    HB2  ARG  18           1HB      ARG  18  -1.434  -8.241   5.392
  155    HB3  ARG  18           2HB      ARG  18  -1.745  -9.292   4.009
  156    HG2  ARG  18           1HG      ARG  18  -2.940 -10.779   5.874
  157    HG3  ARG  18           2HG      ARG  18  -3.095  -9.214   6.672
  158    HD2  ARG  18           1HD      ARG  18  -5.011  -9.111   5.384
  159    HD3  ARG  18           2HD      ARG  18  -3.868  -8.527   4.159
  160    HE   ARG  18           HE       ARG  18  -3.691 -11.284   3.960
  161   HH11  ARG  18          1HH1      ARG  18  -5.080  -9.187   2.071
  162   HH12  ARG  18          2HH1      ARG  18  -6.583 -10.004   1.797
  163   HH21  ARG  18          1HH2      ARG  18  -6.135 -12.257   4.394
  164   HH22  ARG  18          2HH2      ARG  18  -7.179 -11.743   3.112
  165    H    LEU  19           H        LEU  19   0.227 -10.335   3.105
  166    HA   LEU  19           HA       LEU  19  -0.779 -12.998   2.520
  167    HB2  LEU  19           1HB      LEU  19  -0.627 -11.395   0.749
  168    HB3  LEU  19           2HB      LEU  19   1.044 -11.001   1.158
  169    HG   LEU  19           HG       LEU  19   1.712 -13.317   0.537
  170   HD11  LEU  19          1HD1      LEU  19  -0.575 -14.025  -1.028
  171   HD12  LEU  19          2HD1      LEU  19  -1.116 -13.708   0.620
  172   HD13  LEU  19          3HD1      LEU  19   0.140 -14.911   0.319
  173   HD21  LEU  19          3HD2      LEU  19   1.217 -13.039  -1.954
  174   HD22  LEU  19          1HD2      LEU  19   1.986 -11.659  -1.170
  175   HD23  LEU  19          2HD2      LEU  19   0.256 -11.628  -1.511
  176    H    VAL  20           H        VAL  20   2.353 -11.582   3.389
  177    HA   VAL  20           HA       VAL  20   3.902 -14.002   3.014
  178    HB   VAL  20           HB       VAL  20   4.248 -11.418   4.549
  179   HG11  VAL  20          1HG1      VAL  20   6.609 -12.091   4.874
  180   HG12  VAL  20          2HG1      VAL  20   6.240 -13.677   4.196
  181   HG13  VAL  20          3HG1      VAL  20   5.503 -13.175   5.718
  182   HG21  VAL  20          3HG2      VAL  20   4.354 -11.836   1.895
  183   HG22  VAL  20          1HG2      VAL  20   6.002 -12.306   2.305
  184   HG23  VAL  20          2HG2      VAL  20   5.423 -10.689   2.703
  185    H    THR  21           H        THR  21   2.008 -12.652   5.665
  186    HA   THR  21           HA       THR  21   3.029 -14.524   7.671
  187    HB   THR  21           HB       THR  21   0.746 -12.544   7.491
  188    HG1  THR  21           HG1      THR  21   3.170 -12.111   7.777
  189   HG21  THR  21          3HG2      THR  21   0.959 -13.024  10.140
  190   HG22  THR  21          1HG2      THR  21   1.332 -14.632   9.519
  191   HG23  THR  21          2HG2      THR  21  -0.200 -13.860   9.106
  192    H    GLY  22           H        GLY  22   0.427 -14.471   5.326
  193    HA2  GLY  22           1HA      GLY  22  -1.107 -16.141   4.716
  194    HA3  GLY  22           2HA      GLY  22  -0.116 -17.272   5.638
  Start of MODEL   18
    1    H1   PHE   1           1H       PHE   1  -4.036  13.210  -1.216
    2    H2   PHE   1           2H       PHE   1  -4.047  14.407  -2.421
    3    H3   PHE   1           3H       PHE   1  -3.476  14.771  -0.863
    4    HA   PHE   1           HA       PHE   1  -2.199  12.919  -2.814
    5    HB2  PHE   1           1HB      PHE   1  -2.076  15.349  -3.296
    6    HB3  PHE   1           2HB      PHE   1  -1.446  15.631  -1.672
    7    HD1  PHE   1           HD2      PHE   1  -0.735  14.103  -4.968
    8    HD2  PHE   1           HD1      PHE   1   0.831  15.081  -1.090
    9    HE1  PHE   1           HE2      PHE   1   1.559  13.606  -5.769
   10    HE2  PHE   1           HE1      PHE   1   3.125  14.584  -1.890
   11    HZ   PHE   1           HZ       PHE   1   3.489  13.847  -4.230
   12    H    PHE   2           H        PHE   2  -1.676  14.698   0.264
   13    HA   PHE   2           HA       PHE   2   0.471  13.073   1.201
   14    HB2  PHE   2           1HB      PHE   2  -1.332  15.166   2.136
   15    HB3  PHE   2           2HB      PHE   2  -0.931  14.031   3.425
   16    HD1  PHE   2           HD2      PHE   2   1.476  13.565   3.972
   17    HD2  PHE   2           HD1      PHE   2   0.299  16.684   1.264
   18    HE1  PHE   2           HE2      PHE   2   3.716  14.604   4.197
   19    HE2  PHE   2           HE1      PHE   2   2.540  17.725   1.489
   20    HZ   PHE   2           HZ       PHE   2   4.248  16.684   2.956
   21    H    HIS   3           H        HIS   3  -3.038  12.735   1.507
   22    HA   HIS   3           HA       HIS   3  -3.042  10.613   3.446
   23    HB2  HIS   3           1HB      HIS   3  -4.854  12.165   1.894
   24    HB3  HIS   3           2HB      HIS   3  -5.246  10.470   1.602
   25    HD1  HIS   3           HD1      HIS   3  -5.973  13.106   3.904
   26    HD2  HIS   3           HD2      HIS   3  -5.346   9.004   4.298
   27    HE1  HIS   3           HE1      HIS   3  -6.963  12.442   6.138
   28    H    HIS   4           H        HIS   4  -2.520  10.690  -0.020
   29    HA   HIS   4           HA       HIS   4  -3.020   7.874  -0.508
   30    HB2  HIS   4           1HB      HIS   4  -1.886  10.246  -1.909
   31    HB3  HIS   4           2HB      HIS   4  -1.437   8.660  -2.539
   32    HD1  HIS   4           HD1      HIS   4  -3.015   7.843  -4.272
   33    HD2  HIS   4           HD2      HIS   4  -4.950  10.245  -1.468
   34    HE1  HIS   4           HE1      HIS   4  -5.440   7.969  -4.990
   35    H    ILE   5           H        ILE   5  -0.183   9.788   0.373
   36    HA   ILE   5           HA       ILE   5   1.792   7.745  -0.111
   37    HB   ILE   5           HB       ILE   5   3.263   9.249   0.941
   38   HG12  ILE   5          1HG1      ILE   5   2.160  11.016   2.595
   39   HG13  ILE   5          2HG1      ILE   5   0.943   9.752   2.767
   40   HG21  ILE   5          1HG2      ILE   5   1.022  11.194   0.483
   41   HG22  ILE   5          2HG2      ILE   5   1.708  10.300  -0.874
   42   HG23  ILE   5          3HG2      ILE   5   2.733  11.364   0.090
   43   HD11  ILE   5          3HD1      ILE   5   3.194   8.259   2.972
   44   HD12  ILE   5          1HD1      ILE   5   2.382   8.973   4.366
   45   HD13  ILE   5          2HD1      ILE   5   3.776   9.781   3.646
   46    H    PHE   6           H        PHE   6  -0.384   8.474   2.526
   47    HA   PHE   6           HA       PHE   6   0.811   6.752   4.511
   48    HB2  PHE   6           1HB      PHE   6  -1.268   8.609   4.298
   49    HB3  PHE   6           2HB      PHE   6  -2.085   7.091   4.663
   50    HD1  PHE   6           HD1      PHE   6   0.352   5.864   6.147
   51    HD2  PHE   6           HD2      PHE   6  -1.703   9.620   6.467
   52    HE1  PHE   6           HE1      PHE   6   1.045   6.041   8.518
   53    HE2  PHE   6           HE2      PHE   6  -1.009   9.798   8.838
   54    HZ   PHE   6           HZ       PHE   6   0.366   8.008   9.868
   55    H    ARG   7           H        ARG   7  -1.479   6.228   1.874
   56    HA   ARG   7           HA       ARG   7  -2.167   3.508   2.780
   57    HB2  ARG   7           1HB      ARG   7  -2.712   4.882   0.134
   58    HB3  ARG   7           2HB      ARG   7  -3.622   3.554   0.858
   59    HG2  ARG   7           1HG      ARG   7  -3.928   5.243   2.856
   60    HG3  ARG   7           2HG      ARG   7  -3.573   6.454   1.624
   61    HD2  ARG   7           1HD      ARG   7  -5.586   4.336   0.955
   62    HD3  ARG   7           2HD      ARG   7  -6.079   5.655   2.033
   63    HE   ARG   7           HE       ARG   7  -5.297   7.245   0.260
   64   HH11  ARG   7          1HH1      ARG   7  -4.860   4.031  -0.732
   65   HH12  ARG   7          2HH1      ARG   7  -5.489   4.270  -2.327
   66   HH21  ARG   7          1HH2      ARG   7  -6.521   7.524  -1.721
   67   HH22  ARG   7          2HH2      ARG   7  -6.429   6.247  -2.888
   68    H    ALA   8           H        ALA   8  -0.803   4.750  -0.289
   69    HA   ALA   8           HA       ALA   8   0.138   2.445  -1.453
   70    HB1  ALA   8           3HB      ALA   8   2.192   4.132  -1.971
   71    HB2  ALA   8           1HB      ALA   8   1.037   5.274  -1.282
   72    HB3  ALA   8           2HB      ALA   8   0.596   4.321  -2.698
   73    H    ILE   9           H        ILE   9   1.762   4.221   1.187
   74    HA   ILE   9           HA       ILE   9   4.015   2.355   1.280
   75    HB   ILE   9           HB       ILE   9   3.009   4.558   3.109
   76   HG12  ILE   9          1HG1      ILE   9   5.440   4.671   1.343
   77   HG13  ILE   9          2HG1      ILE   9   3.846   4.975   0.654
   78   HG21  ILE   9          1HG2      ILE   9   5.280   4.488   4.088
   79   HG22  ILE   9          2HG2      ILE   9   5.667   3.094   3.080
   80   HG23  ILE   9          3HG2      ILE   9   4.433   2.961   4.332
   81   HD11  ILE   9          3HD1      ILE   9   5.468   6.789   2.105
   82   HD12  ILE   9          1HD1      ILE   9   4.093   6.403   3.139
   83   HD13  ILE   9          2HD1      ILE   9   3.825   7.050   1.520
   84    H    VAL  10           H        VAL  10   1.120   2.973   3.288
   85    HA   VAL  10           HA       VAL  10   1.712   0.942   5.250
   86    HB   VAL  10           HB       VAL  10  -0.747   2.444   4.340
   87   HG11  VAL  10          1HG1      VAL  10  -1.897   1.514   6.335
   88   HG12  VAL  10          2HG1      VAL  10  -0.520   0.446   6.611
   89   HG13  VAL  10          3HG1      VAL  10  -1.504   0.260   5.158
   90   HG21  VAL  10          3HG2      VAL  10   0.806   2.489   6.946
   91   HG22  VAL  10          1HG2      VAL  10  -0.458   3.613   6.448
   92   HG23  VAL  10          2HG2      VAL  10   1.094   3.604   5.610
   93    H    HIS  11           H        HIS  11  -0.442   0.965   2.390
   94    HA   HIS  11           HA       HIS  11  -1.451  -1.672   2.626
   95    HB2  HIS  11           1HB      HIS  11  -1.212   0.464   0.642
   96    HB3  HIS  11           2HB      HIS  11  -1.213  -1.139  -0.094
   97    HD1  HIS  11           HD1      HIS  11  -3.570  -1.496  -0.859
   98    HD2  HIS  11           HD2      HIS  11  -3.417   0.082   2.996
   99    HE1  HIS  11           HE1      HIS  11  -5.956  -1.449  -0.008
  100    H    VAL  12           H        VAL  12   1.324  -0.561   0.626
  101    HA   VAL  12           HA       VAL  12   2.159  -3.076  -0.331
  102    HB   VAL  12           HB       VAL  12   3.016  -0.917  -1.101
  103   HG11  VAL  12          1HG1      VAL  12   4.490   0.434   0.289
  104   HG12  VAL  12          2HG1      VAL  12   4.415  -0.759   1.585
  105   HG13  VAL  12          3HG1      VAL  12   2.976   0.165   1.153
  106   HG21  VAL  12          3HG2      VAL  12   4.500  -2.750  -1.546
  107   HG22  VAL  12          1HG2      VAL  12   5.075  -2.773   0.121
  108   HG23  VAL  12          2HG2      VAL  12   5.509  -1.436  -0.943
  109    H    ALA  13           H        ALA  13   3.063  -1.445   2.720
  110    HA   ALA  13           HA       ALA  13   4.802  -3.644   3.560
  111    HB1  ALA  13           3HB      ALA  13   4.521  -0.971   4.123
  112    HB2  ALA  13           1HB      ALA  13   5.456  -2.098   5.105
  113    HB3  ALA  13           2HB      ALA  13   3.793  -1.709   5.550
  114    H    LYS  14           H        LYS  14   1.574  -2.435   4.523
  115    HA   LYS  14           HA       LYS  14   1.136  -4.450   6.548
  116    HB2  LYS  14           1HB      LYS  14  -0.038  -2.351   6.593
  117    HB3  LYS  14           2HB      LYS  14  -0.644  -2.588   4.954
  118    HG2  LYS  14           1HG      LYS  14  -2.449  -3.131   6.447
  119    HG3  LYS  14           2HG      LYS  14  -1.839  -4.656   5.805
  120    HD2  LYS  14           1HD      LYS  14  -2.145  -4.888   8.207
  121    HD3  LYS  14           2HD      LYS  14  -0.418  -4.895   7.851
  122    HE2  LYS  14           1HE      LYS  14  -0.235  -2.537   8.486
  123    HE3  LYS  14           2HE      LYS  14  -1.988  -2.451   8.752
  124    HZ1  LYS  14           3HZ      LYS  14  -0.080  -4.242  10.164
  125    HZ2  LYS  14           1HZ      LYS  14  -1.764  -4.275  10.360
  126    HZ3  LYS  14           2HZ      LYS  14  -0.882  -2.903  10.835
  127    H    THR  15           H        THR  15  -0.115  -4.106   3.201
  128    HA   THR  15           HA       THR  15  -1.639  -6.489   3.086
  129    HB   THR  15           HB       THR  15   0.044  -5.307   0.891
  130    HG1  THR  15           HG1      THR  15  -2.359  -4.423   2.082
  131   HG21  THR  15          3HG2      THR  15  -1.702  -7.442   0.916
  132   HG22  THR  15          1HG2      THR  15  -1.231  -6.527  -0.517
  133   HG23  THR  15          2HG2      THR  15  -2.714  -6.114   0.344
  134    H    ILE  16           H        ILE  16   1.585  -6.116   1.546
  135    HA   ILE  16           HA       ILE  16   2.143  -8.812   1.086
  136    HB   ILE  16           HB       ILE  16   3.970  -6.576   2.037
  137   HG12  ILE  16          1HG1      ILE  16   3.465  -7.561  -0.782
  138   HG13  ILE  16          2HG1      ILE  16   2.553  -6.233  -0.062
  139   HG21  ILE  16          1HG2      ILE  16   4.572  -9.288   1.765
  140   HG22  ILE  16          2HG2      ILE  16   5.735  -7.963   1.785
  141   HG23  ILE  16          3HG2      ILE  16   5.120  -8.573   0.249
  142   HD11  ILE  16          3HD1      ILE  16   5.272  -6.246  -1.131
  143   HD12  ILE  16          1HD1      ILE  16   5.201  -5.595   0.508
  144   HD13  ILE  16          2HD1      ILE  16   4.217  -4.879  -0.769
  145    H    HIS  17           H        HIS  17   2.828  -6.946   4.054
  146    HA   HIS  17           HA       HIS  17   3.837  -9.180   5.557
  147    HB2  HIS  17           1HB      HIS  17   4.057  -6.664   5.984
  148    HB3  HIS  17           2HB      HIS  17   2.403  -6.715   6.593
  149    HD1  HIS  17           HD1      HIS  17   2.105  -8.818   8.472
  150    HD2  HIS  17           HD2      HIS  17   5.864  -7.073   8.019
  151    HE1  HIS  17           HE1      HIS  17   3.410  -9.373  10.571
  152    H    ARG  18           H        ARG  18   0.639  -8.087   4.679
  153    HA   ARG  18           HA       ARG  18  -0.741  -9.617   6.779
  154    HB2  ARG  18           1HB      ARG  18  -1.596  -7.518   5.712
  155    HB3  ARG  18           2HB      ARG  18  -1.724  -8.384   4.181
  156    HG2  ARG  18           1HG      ARG  18  -3.004  -9.838   6.362
  157    HG3  ARG  18           2HG      ARG  18  -3.699  -8.232   6.143
  158    HD2  ARG  18           1HD      ARG  18  -3.846  -8.764   3.649
  159    HD3  ARG  18           2HD      ARG  18  -3.468 -10.444   4.083
  160    HE   ARG  18           HE       ARG  18  -5.598 -10.616   5.120
  161   HH11  ARG  18          1HH1      ARG  18  -4.650  -7.329   4.802
  162   HH12  ARG  18          2HH1      ARG  18  -6.254  -6.704   4.993
  163   HH21  ARG  18          1HH2      ARG  18  -7.736  -9.833   5.186
  164   HH22  ARG  18          2HH2      ARG  18  -8.000  -8.121   5.211
  165    H    LEU  19           H        LEU  19  -0.293  -9.926   3.237
  166    HA   LEU  19           HA       LEU  19  -1.520 -12.550   3.110
  167    HB2  LEU  19           1HB      LEU  19  -0.885 -12.430   0.815
  168    HB3  LEU  19           2HB      LEU  19  -1.189 -10.757   1.280
  169    HG   LEU  19           HG       LEU  19   1.364 -10.740   1.876
  170   HD11  LEU  19          1HD1      LEU  19   1.017 -13.370   0.797
  171   HD12  LEU  19          2HD1      LEU  19   2.500 -12.618   1.386
  172   HD13  LEU  19          3HD1      LEU  19   2.037 -12.447  -0.307
  173   HD21  LEU  19          3HD2      LEU  19   1.876 -10.055  -0.442
  174   HD22  LEU  19          1HD2      LEU  19   0.313  -9.420   0.070
  175   HD23  LEU  19          2HD2      LEU  19   0.387 -10.821  -0.998
  176    H    VAL  20           H        VAL  20   1.747 -11.314   3.615
  177    HA   VAL  20           HA       VAL  20   3.092 -13.869   3.270
  178    HB   VAL  20           HB       VAL  20   3.756 -11.204   4.534
  179   HG11  VAL  20          1HG1      VAL  20   5.138 -12.566   5.823
  180   HG12  VAL  20          2HG1      VAL  20   6.167 -12.271   4.421
  181   HG13  VAL  20          3HG1      VAL  20   5.280 -13.789   4.559
  182   HG21  VAL  20          3HG2      VAL  20   4.751 -12.672   2.069
  183   HG22  VAL  20          1HG2      VAL  20   5.323 -11.093   2.608
  184   HG23  VAL  20          2HG2      VAL  20   3.653 -11.292   2.077
  185    H    THR  21           H        THR  21   1.583 -12.166   5.972
  186    HA   THR  21           HA       THR  21   2.647 -13.879   8.059
  187    HB   THR  21           HB       THR  21   0.351 -11.928   7.787
  188    HG1  THR  21           HG1      THR  21   2.015 -10.704   8.132
  189   HG21  THR  21          3HG2      THR  21   0.638 -12.220  10.471
  190   HG22  THR  21          1HG2      THR  21   0.933 -13.877   9.941
  191   HG23  THR  21          2HG2      THR  21  -0.582 -13.074   9.525
  192    H    GLY  22           H        GLY  22  -0.141 -14.005   5.918
  193    HA2  GLY  22           1HA      GLY  22  -0.648 -16.781   6.751
  194    HA3  GLY  22           2HA      GLY  22  -1.969 -15.655   7.068
  Start of MODEL   19
    1    H1   PHE   1           1H       PHE   1  -1.919  15.501  -3.107
    2    H2   PHE   1           2H       PHE   1  -0.927  15.646  -1.736
    3    H3   PHE   1           3H       PHE   1  -2.533  15.115  -1.573
    4    HA   PHE   1           HA       PHE   1  -2.053  13.065  -2.698
    5    HB2  PHE   1           1HB      PHE   1   0.341  12.783  -3.497
    6    HB3  PHE   1           2HB      PHE   1  -0.586  14.000  -4.374
    7    HD1  PHE   1           HD1      PHE   1   1.692  13.642  -1.418
    8    HD2  PHE   1           HD2      PHE   1   0.266  16.170  -4.584
    9    HE1  PHE   1           HE1      PHE   1   3.362  15.367  -0.794
   10    HE2  PHE   1           HE2      PHE   1   1.936  17.895  -3.960
   11    HZ   PHE   1           HZ       PHE   1   3.483  17.493  -2.066
   12    H    PHE   2           H        PHE   2  -1.162  14.791  -0.053
   13    HA   PHE   2           HA       PHE   2   0.856  13.352   1.289
   14    HB2  PHE   2           1HB      PHE   2  -1.162  15.287   1.830
   15    HB3  PHE   2           2HB      PHE   2  -1.275  14.054   3.084
   16    HD1  PHE   2           HD2      PHE   2   1.332  16.011   1.220
   17    HD2  PHE   2           HD1      PHE   2   0.123  14.230   4.938
   18    HE1  PHE   2           HE2      PHE   2   3.351  16.939   2.322
   19    HE2  PHE   2           HE1      PHE   2   2.141  15.159   6.039
   20    HZ   PHE   2           HZ       PHE   2   3.755  16.514   4.732
   21    H    HIS   3           H        HIS   3  -2.515  12.919   2.302
   22    HA   HIS   3           HA       HIS   3  -2.355  10.467   3.527
   23    HB2  HIS   3           1HB      HIS   3  -4.444  11.744   1.771
   24    HB3  HIS   3           2HB      HIS   3  -4.752  10.196   2.554
   25    HD1  HIS   3           HD1      HIS   3  -3.110  10.900   5.193
   26    HD2  HIS   3           HD2      HIS   3  -6.113  13.244   3.498
   27    HE1  HIS   3           HE1      HIS   3  -4.014  12.362   7.054
   28    H    HIS   4           H        HIS   4  -2.831  10.960   0.029
   29    HA   HIS   4           HA       HIS   4  -3.146   8.410  -0.951
   30    HB2  HIS   4           1HB      HIS   4  -1.951  10.922  -1.815
   31    HB3  HIS   4           2HB      HIS   4  -1.175   9.535  -2.580
   32    HD1  HIS   4           HD1      HIS   4  -2.283   9.893  -4.884
   33    HD2  HIS   4           HD2      HIS   4  -5.032   9.458  -1.780
   34    HE1  HIS   4           HE1      HIS   4  -4.549   9.583  -5.972
   35    H    ILE   5           H        ILE   5  -0.007   9.838  -0.034
   36    HA   ILE   5           HA       ILE   5   1.567   7.509  -0.636
   37    HB   ILE   5           HB       ILE   5   3.316   8.710   0.391
   38   HG12  ILE   5          1HG1      ILE   5   2.676  10.576   2.117
   39   HG13  ILE   5          2HG1      ILE   5   1.170   9.675   2.269
   40   HG21  ILE   5          1HG2      ILE   5   3.127  10.890  -0.429
   41   HG22  ILE   5          2HG2      ILE   5   1.428  11.014   0.031
   42   HG23  ILE   5          3HG2      ILE   5   1.896  10.032  -1.357
   43   HD11  ILE   5          3HD1      ILE   5   2.165   8.085   3.516
   44   HD12  ILE   5          1HD1      ILE   5   3.593   9.118   3.573
   45   HD13  ILE   5          2HD1      ILE   5   3.447   7.880   2.323
   46    H    PHE   6           H        PHE   6  -0.264   8.536   2.172
   47    HA   PHE   6           HA       PHE   6   0.729   6.509   3.992
   48    HB2  PHE   6           1HB      PHE   6  -0.896   8.794   4.027
   49    HB3  PHE   6           2HB      PHE   6  -1.972   7.476   4.489
   50    HD1  PHE   6           HD1      PHE   6  -1.245   5.903   6.357
   51    HD2  PHE   6           HD2      PHE   6   0.724   9.632   5.542
   52    HE1  PHE   6           HE1      PHE   6  -0.236   5.866   8.622
   53    HE2  PHE   6           HE2      PHE   6   1.734   9.594   7.807
   54    HZ   PHE   6           HZ       PHE   6   1.252   7.712   9.348
   55    H    ARG   7           H        ARG   7  -1.660   6.518   1.441
   56    HA   ARG   7           HA       ARG   7  -3.067   4.130   2.447
   57    HB2  ARG   7           1HB      ARG   7  -3.189   5.467  -0.270
   58    HB3  ARG   7           2HB      ARG   7  -4.430   4.467   0.486
   59    HG2  ARG   7           1HG      ARG   7  -4.422   6.225   2.378
   60    HG3  ARG   7           2HG      ARG   7  -3.553   7.251   1.239
   61    HD2  ARG   7           1HD      ARG   7  -6.081   7.554   1.218
   62    HD3  ARG   7           2HD      ARG   7  -5.385   7.133  -0.359
   63    HE   ARG   7           HE       ARG   7  -6.498   5.030   1.459
   64   HH11  ARG   7          1HH1      ARG   7  -5.062   4.711  -1.314
   65   HH12  ARG   7          2HH1      ARG   7  -6.433   4.347  -2.307
   66   HH21  ARG   7          1HH2      ARG   7  -8.754   5.364   0.060
   67   HH22  ARG   7          2HH2      ARG   7  -8.523   4.717  -1.530
   68    H    ALA   8           H        ALA   8  -1.522   4.747  -0.715
   69    HA   ALA   8           HA       ALA   8  -1.165   2.090  -1.518
   70    HB1  ALA   8           3HB      ALA   8  -0.562   3.486  -3.209
   71    HB2  ALA   8           1HB      ALA   8   1.050   3.414  -2.499
   72    HB3  ALA   8           2HB      ALA   8  -0.033   4.744  -2.091
   73    H    ILE   9           H        ILE   9   0.965   4.045   0.568
   74    HA   ILE   9           HA       ILE   9   3.095   2.101   0.718
   75    HB   ILE   9           HB       ILE   9   2.214   4.399   2.489
   76   HG12  ILE   9          1HG1      ILE   9   4.294   4.115   0.298
   77   HG13  ILE   9          2HG1      ILE   9   2.834   5.102   0.244
   78   HG21  ILE   9          1HG2      ILE   9   4.975   3.952   2.761
   79   HG22  ILE   9          2HG2      ILE   9   4.231   2.359   2.896
   80   HG23  ILE   9          3HG2      ILE   9   3.733   3.659   3.977
   81   HD11  ILE   9          3HD1      ILE   9   4.271   6.754   0.912
   82   HD12  ILE   9          1HD1      ILE   9   5.412   5.614   1.624
   83   HD13  ILE   9          2HD1      ILE   9   3.957   6.072   2.507
   84    H    VAL  10           H        VAL  10   1.054   3.127   3.470
   85    HA   VAL  10           HA       VAL  10   1.468   1.031   5.207
   86    HB   VAL  10           HB       VAL  10  -0.011   3.105   5.407
   87   HG11  VAL  10          1HG1      VAL  10  -1.374   2.614   3.384
   88   HG12  VAL  10          2HG1      VAL  10  -2.371   2.835   4.820
   89   HG13  VAL  10          3HG1      VAL  10  -2.056   1.212   4.208
   90   HG21  VAL  10          3HG2      VAL  10  -1.683   0.904   6.442
   91   HG22  VAL  10          1HG2      VAL  10  -0.877   2.208   7.313
   92   HG23  VAL  10          2HG2      VAL  10   0.028   0.769   6.846
   93    H    HIS  11           H        HIS  11  -0.854   1.014   2.486
   94    HA   HIS  11           HA       HIS  11  -2.063  -1.493   2.909
   95    HB2  HIS  11           1HB      HIS  11  -1.423   0.292   0.610
   96    HB3  HIS  11           2HB      HIS  11  -1.911  -1.357   0.216
   97    HD1  HIS  11           HD1      HIS  11  -4.370  -1.593  -0.052
   98    HD2  HIS  11           HD2      HIS  11  -3.420   1.400   2.692
   99    HE1  HIS  11           HE1      HIS  11  -6.571  -0.623   0.739
  100    H    VAL  12           H        VAL  12   0.991  -0.760   1.192
  101    HA   VAL  12           HA       VAL  12   1.600  -3.429   0.389
  102    HB   VAL  12           HB       VAL  12   3.548  -1.253   1.194
  103   HG11  VAL  12          1HG1      VAL  12   3.589  -3.610  -0.679
  104   HG12  VAL  12          2HG1      VAL  12   4.744  -3.181   0.583
  105   HG13  VAL  12          3HG1      VAL  12   4.685  -2.247  -0.912
  106   HG21  VAL  12          3HG2      VAL  12   2.750   0.072  -0.427
  107   HG22  VAL  12          1HG2      VAL  12   1.398  -1.041  -0.627
  108   HG23  VAL  12          2HG2      VAL  12   2.855  -1.240  -1.601
  109    H    ALA  13           H        ALA  13   3.374  -1.678   2.934
  110    HA   ALA  13           HA       ALA  13   4.509  -3.876   4.235
  111    HB1  ALA  13           3HB      ALA  13   3.420  -1.307   5.434
  112    HB2  ALA  13           1HB      ALA  13   4.993  -1.485   4.658
  113    HB3  ALA  13           2HB      ALA  13   4.651  -2.335   6.166
  114    H    LYS  14           H        LYS  14   1.184  -2.770   4.355
  115    HA   LYS  14           HA       LYS  14   0.481  -4.299   6.750
  116    HB2  LYS  14           1HB      LYS  14  -0.701  -2.264   6.182
  117    HB3  LYS  14           2HB      LYS  14  -1.078  -2.878   4.571
  118    HG2  LYS  14           1HG      LYS  14  -2.984  -3.742   5.394
  119    HG3  LYS  14           2HG      LYS  14  -2.016  -4.824   6.398
  120    HD2  LYS  14           1HD      LYS  14  -2.860  -3.751   8.193
  121    HD3  LYS  14           2HD      LYS  14  -1.895  -2.356   7.711
  122    HE2  LYS  14           1HE      LYS  14  -3.748  -1.498   6.349
  123    HE3  LYS  14           2HE      LYS  14  -4.722  -2.926   6.749
  124    HZ1  LYS  14           3HZ      LYS  14  -3.699  -0.849   8.600
  125    HZ2  LYS  14           1HZ      LYS  14  -4.276  -2.347   9.143
  126    HZ3  LYS  14           2HZ      LYS  14  -5.316  -1.286   8.318
  127    H    THR  15           H        THR  15  -0.448  -4.588   3.293
  128    HA   THR  15           HA       THR  15  -1.599  -7.222   3.599
  129    HB   THR  15           HB       THR  15  -0.483  -6.152   1.052
  130    HG1  THR  15           HG1      THR  15  -2.509  -4.848   1.058
  131   HG21  THR  15          3HG2      THR  15  -2.103  -7.426   0.102
  132   HG22  THR  15          1HG2      THR  15  -3.310  -6.933   1.289
  133   HG23  THR  15          2HG2      THR  15  -2.165  -8.216   1.678
  134    H    ILE  16           H        ILE  16   1.415  -6.163   1.935
  135    HA   ILE  16           HA       ILE  16   2.506  -8.654   1.310
  136    HB   ILE  16           HB       ILE  16   3.628  -6.001   2.197
  137   HG12  ILE  16          1HG1      ILE  16   4.551  -6.111  -0.148
  138   HG13  ILE  16          2HG1      ILE  16   3.690  -7.636  -0.356
  139   HG21  ILE  16          1HG2      ILE  16   5.207  -8.527   1.647
  140   HG22  ILE  16          2HG2      ILE  16   5.265  -7.522   3.094
  141   HG23  ILE  16          3HG2      ILE  16   5.911  -6.912   1.571
  142   HD11  ILE  16          3HD1      ILE  16   2.234  -5.173   0.583
  143   HD12  ILE  16          1HD1      ILE  16   1.579  -6.609  -0.201
  144   HD13  ILE  16          2HD1      ILE  16   2.520  -5.446  -1.135
  145    H    HIS  17           H        HIS  17   2.662  -6.919   4.419
  146    HA   HIS  17           HA       HIS  17   4.138  -8.996   5.794
  147    HB2  HIS  17           1HB      HIS  17   3.903  -6.536   6.399
  148    HB3  HIS  17           2HB      HIS  17   2.257  -6.897   6.924
  149    HD1  HIS  17           HD1      HIS  17   5.563  -6.651   8.241
  150    HD2  HIS  17           HD2      HIS  17   2.369  -9.245   8.914
  151    HE1  HIS  17           HE1      HIS  17   6.004  -7.767  10.470
  152    H    ARG  18           H        ARG  18   0.772  -8.436   4.994
  153    HA   ARG  18           HA       ARG  18  -0.266 -10.380   6.941
  154    HB2  ARG  18           1HB      ARG  18  -1.506  -8.379   6.067
  155    HB3  ARG  18           2HB      ARG  18  -1.509  -9.123   4.467
  156    HG2  ARG  18           1HG      ARG  18  -2.456 -11.130   6.171
  157    HG3  ARG  18           2HG      ARG  18  -3.241  -9.657   6.742
  158    HD2  ARG  18           1HD      ARG  18  -3.390  -9.470   3.950
  159    HD3  ARG  18           2HD      ARG  18  -3.758 -11.168   4.309
  160    HE   ARG  18           HE       ARG  18  -5.163  -9.740   6.238
  161   HH11  ARG  18          1HH1      ARG  18  -4.827  -8.581   3.113
  162   HH12  ARG  18          2HH1      ARG  18  -6.517  -8.601   2.731
  163   HH21  ARG  18          1HH2      ARG  18  -7.420 -10.286   5.625
  164   HH22  ARG  18          2HH2      ARG  18  -7.986  -9.566   4.155
  165    H    LEU  19           H        LEU  19   0.330 -10.266   3.425
  166    HA   LEU  19           HA       LEU  19  -0.473 -13.019   2.964
  167    HB2  LEU  19           1HB      LEU  19  -0.510 -11.239   1.249
  168    HB3  LEU  19           2HB      LEU  19   1.241 -11.071   1.382
  169    HG   LEU  19           HG       LEU  19   0.839 -13.807   0.966
  170   HD11  LEU  19          1HD1      LEU  19  -0.791 -12.279  -1.072
  171   HD12  LEU  19          2HD1      LEU  19  -1.535 -13.071   0.318
  172   HD13  LEU  19          3HD1      LEU  19  -0.655 -14.027  -0.875
  173   HD21  LEU  19          3HD2      LEU  19   2.429 -13.364  -0.579
  174   HD22  LEU  19          1HD2      LEU  19   2.265 -11.665  -0.138
  175   HD23  LEU  19          2HD2      LEU  19   1.340 -12.318  -1.489
  176    H    VAL  20           H        VAL  20   2.559 -11.333   3.662
  177    HA   VAL  20           HA       VAL  20   4.306 -13.590   3.174
  178    HB   VAL  20           HB       VAL  20   4.467 -10.981   4.694
  179   HG11  VAL  20          1HG1      VAL  20   6.958 -11.497   4.831
  180   HG12  VAL  20          2HG1      VAL  20   6.544 -13.170   4.454
  181   HG13  VAL  20          3HG1      VAL  20   5.931 -12.421   5.928
  182   HG21  VAL  20          3HG2      VAL  20   6.405 -11.468   2.591
  183   HG22  VAL  20          1HG2      VAL  20   5.205 -10.183   2.716
  184   HG23  VAL  20          2HG2      VAL  20   4.767 -11.732   1.995
  185    H    THR  21           H        THR  21   2.393 -12.496   5.921
  186    HA   THR  21           HA       THR  21   3.699 -14.231   7.871
  187    HB   THR  21           HB       THR  21   1.181 -12.563   7.744
  188    HG1  THR  21           HG1      THR  21   3.606 -12.434   9.206
  189   HG21  THR  21          3HG2      THR  21   0.314 -13.820   9.401
  190   HG22  THR  21          1HG2      THR  21   1.626 -13.225  10.419
  191   HG23  THR  21          2HG2      THR  21   1.803 -14.754   9.558
  192    H    GLY  22           H        GLY  22   0.996 -14.504   5.640
  193    HA2  GLY  22           1HA      GLY  22   0.531 -16.919   4.989
  194    HA3  GLY  22           2HA      GLY  22   0.447 -17.240   6.722
  Start of MODEL   20
    1    H1   PHE   1           1H       PHE   1  -0.957  12.931  -3.478
    2    H2   PHE   1           2H       PHE   1  -2.081  14.205  -3.417
    3    H3   PHE   1           3H       PHE   1  -2.162  12.941  -2.286
    4    HA   PHE   1           HA       PHE   1   0.231  14.678  -2.483
    5    HB2  PHE   1           1HB      PHE   1  -2.311  15.601  -2.053
    6    HB3  PHE   1           2HB      PHE   1  -1.812  15.204  -0.410
    7    HD1  PHE   1           HD1      PHE   1   1.234  15.656  -1.095
    8    HD2  PHE   1           HD2      PHE   1  -2.319  18.019  -1.592
    9    HE1  PHE   1           HE1      PHE   1   2.598  17.726  -1.006
   10    HE2  PHE   1           HE2      PHE   1  -0.954  20.088  -1.503
   11    HZ   PHE   1           HZ       PHE   1   1.504  19.942  -1.210
   12    H    PHE   2           H        PHE   2   0.238  14.952   0.376
   13    HA   PHE   2           HA       PHE   2   1.639  12.653   1.220
   14    HB2  PHE   2           1HB      PHE   2   1.482  15.008   2.218
   15    HB3  PHE   2           2HB      PHE   2  -0.011  14.474   2.989
   16    HD1  PHE   2           HD2      PHE   2   3.456  13.125   2.444
   17    HD2  PHE   2           HD1      PHE   2   0.197  13.725   5.178
   18    HE1  PHE   2           HE2      PHE   2   4.770  12.044   4.248
   19    HE2  PHE   2           HE1      PHE   2   1.512  12.644   6.982
   20    HZ   PHE   2           HZ       PHE   2   3.798  11.804   6.517
   21    H    HIS   3           H        HIS   3  -1.770  13.107   0.864
   22    HA   HIS   3           HA       HIS   3  -2.613  11.136   2.832
   23    HB2  HIS   3           1HB      HIS   3  -3.840  13.154   1.684
   24    HB3  HIS   3           2HB      HIS   3  -4.185  11.980   0.412
   25    HD1  HIS   3           HD1      HIS   3  -5.320  13.082   3.710
   26    HD2  HIS   3           HD2      HIS   3  -5.604   9.587   1.456
   27    HE1  HIS   3           HE1      HIS   3  -7.164  11.699   4.761
   28    H    HIS   4           H        HIS   4  -2.119  11.119  -0.693
   29    HA   HIS   4           HA       HIS   4  -2.993   8.389  -1.075
   30    HB2  HIS   4           1HB      HIS   4  -1.231  10.240  -2.708
   31    HB3  HIS   4           2HB      HIS   4  -1.974   8.758  -3.307
   32    HD1  HIS   4           HD1      HIS   4  -2.795  11.321  -4.692
   33    HD2  HIS   4           HD2      HIS   4  -4.781   9.867  -1.327
   34    HE1  HIS   4           HE1      HIS   4  -5.108  12.352  -4.724
   35    H    ILE   5           H        ILE   5   0.112   9.877  -0.303
   36    HA   ILE   5           HA       ILE   5   1.751   7.580  -0.936
   37    HB   ILE   5           HB       ILE   5   3.473   8.844   0.064
   38   HG12  ILE   5          1HG1      ILE   5   2.773  10.718   1.766
   39   HG13  ILE   5          2HG1      ILE   5   1.307   9.753   1.940
   40   HG21  ILE   5          1HG2      ILE   5   3.221  10.995  -0.803
   41   HG22  ILE   5          2HG2      ILE   5   1.533  11.098  -0.302
   42   HG23  ILE   5          3HG2      ILE   5   1.981  10.103  -1.687
   43   HD11  ILE   5          3HD1      ILE   5   2.421   8.410   3.359
   44   HD12  ILE   5          1HD1      ILE   5   3.928   9.271   3.048
   45   HD13  ILE   5          2HD1      ILE   5   3.454   7.921   2.017
   46    H    PHE   6           H        PHE   6  -0.127   8.597   1.839
   47    HA   PHE   6           HA       PHE   6   0.904   6.672   3.732
   48    HB2  PHE   6           1HB      PHE   6  -0.838   8.854   3.672
   49    HB3  PHE   6           2HB      PHE   6  -1.879   7.490   4.077
   50    HD1  PHE   6           HD1      PHE   6   0.268   5.791   5.431
   51    HD2  PHE   6           HD2      PHE   6  -0.823   9.924   5.827
   52    HE1  PHE   6           HE1      PHE   6   1.133   5.796   7.751
   53    HE2  PHE   6           HE2      PHE   6   0.043   9.930   8.148
   54    HZ   PHE   6           HZ       PHE   6   1.022   7.866   9.114
   55    H    ARG   7           H        ARG   7  -1.524   6.538   1.192
   56    HA   ARG   7           HA       ARG   7  -2.684   4.008   2.162
   57    HB2  ARG   7           1HB      ARG   7  -3.016   5.365  -0.525
   58    HB3  ARG   7           2HB      ARG   7  -4.161   4.306   0.298
   59    HG2  ARG   7           1HG      ARG   7  -3.982   6.153   2.198
   60    HG3  ARG   7           2HG      ARG   7  -3.503   7.172   0.841
   61    HD2  ARG   7           1HD      ARG   7  -5.994   7.180   1.282
   62    HD3  ARG   7           2HD      ARG   7  -5.571   6.628  -0.351
   63    HE   ARG   7           HE       ARG   7  -6.060   4.705   1.894
   64   HH11  ARG   7          1HH1      ARG   7  -5.239   4.756  -1.303
   65   HH12  ARG   7          2HH1      ARG   7  -6.566   3.799  -1.870
   66   HH21  ARG   7          1HH2      ARG   7  -8.271   3.903   1.149
   67   HH22  ARG   7          2HH2      ARG   7  -8.285   3.318  -0.481
   68    H    ALA   8           H        ALA   8  -0.775   5.056  -0.681
   69    HA   ALA   8           HA       ALA   8  -0.402   2.441  -1.786
   70    HB1  ALA   8           3HB      ALA   8   1.718   3.836  -2.691
   71    HB2  ALA   8           1HB      ALA   8   0.774   5.169  -2.025
   72    HB3  ALA   8           2HB      ALA   8   0.080   4.134  -3.274
   73    H    ILE   9           H        ILE   9   1.489   4.308   0.586
   74    HA   ILE   9           HA       ILE   9   3.659   2.349   0.674
   75    HB   ILE   9           HB       ILE   9   3.695   4.887   1.120
   76   HG12  ILE   9          1HG1      ILE   9   5.579   3.319   1.609
   77   HG13  ILE   9          2HG1      ILE   9   5.499   4.655   2.758
   78   HG21  ILE   9          1HG2      ILE   9   1.712   4.619   2.763
   79   HG22  ILE   9          2HG2      ILE   9   3.032   5.684   3.246
   80   HG23  ILE   9          3HG2      ILE   9   2.922   4.057   3.918
   81   HD11  ILE   9          3HD1      ILE   9   5.615   2.989   4.311
   82   HD12  ILE   9          1HD1      ILE   9   5.025   1.765   3.188
   83   HD13  ILE   9          2HD1      ILE   9   3.886   2.844   3.993
   84    H    VAL  10           H        VAL  10   0.736   3.005   2.574
   85    HA   VAL  10           HA       VAL  10   1.443   1.173   4.728
   86    HB   VAL  10           HB       VAL  10  -1.046   2.615   3.799
   87   HG11  VAL  10          1HG1      VAL  10  -1.710   1.786   6.287
   88   HG12  VAL  10          2HG1      VAL  10  -0.759   0.399   5.757
   89   HG13  VAL  10          3HG1      VAL  10  -2.171   0.906   4.830
   90   HG21  VAL  10          3HG2      VAL  10   0.513   2.839   6.386
   91   HG22  VAL  10          1HG2      VAL  10  -0.674   3.973   5.740
   92   HG23  VAL  10          2HG2      VAL  10   0.897   3.799   4.958
   93    H    HIS  11           H        HIS  11  -1.005   1.019   2.107
   94    HA   HIS  11           HA       HIS  11  -1.945  -1.581   2.462
   95    HB2  HIS  11           1HB      HIS  11  -1.587   0.345   0.248
   96    HB3  HIS  11           2HB      HIS  11  -1.796  -1.331  -0.264
   97    HD1  HIS  11           HD1      HIS  11  -4.206  -1.643  -0.820
   98    HD2  HIS  11           HD2      HIS  11  -3.714   0.650   2.627
   99    HE1  HIS  11           HE1      HIS  11  -6.531  -1.188   0.076
  100    H    VAL  12           H        VAL  12   0.927  -0.619   0.533
  101    HA   VAL  12           HA       VAL  12   1.717  -3.223  -0.281
  102    HB   VAL  12           HB       VAL  12   2.626  -1.145  -1.197
  103   HG11  VAL  12          1HG1      VAL  12   3.952  -0.782   1.508
  104   HG12  VAL  12          2HG1      VAL  12   2.552   0.132   0.952
  105   HG13  VAL  12          3HG1      VAL  12   4.096   0.292   0.119
  106   HG21  VAL  12          3HG2      VAL  12   4.348  -2.526  -1.699
  107   HG22  VAL  12          1HG2      VAL  12   4.286  -3.294  -0.113
  108   HG23  VAL  12          2HG2      VAL  12   5.190  -1.796  -0.332
  109    H    ALA  13           H        ALA  13   2.593  -1.371   2.641
  110    HA   ALA  13           HA       ALA  13   4.293  -3.504   3.693
  111    HB1  ALA  13           3HB      ALA  13   4.214  -0.855   4.004
  112    HB2  ALA  13           1HB      ALA  13   4.824  -1.904   5.284
  113    HB3  ALA  13           2HB      ALA  13   3.173  -1.286   5.360
  114    H    LYS  14           H        LYS  14   0.911  -2.590   3.983
  115    HA   LYS  14           HA       LYS  14   0.454  -4.170   6.403
  116    HB2  LYS  14           1HB      LYS  14  -1.338  -2.796   6.411
  117    HB3  LYS  14           2HB      LYS  14  -0.839  -2.162   4.848
  118    HG2  LYS  14           1HG      LYS  14  -3.111  -2.968   4.637
  119    HG3  LYS  14           2HG      LYS  14  -2.062  -4.086   3.764
  120    HD2  LYS  14           1HD      LYS  14  -3.088  -5.698   4.986
  121    HD3  LYS  14           2HD      LYS  14  -2.043  -5.154   6.299
  122    HE2  LYS  14           1HE      LYS  14  -3.771  -3.674   7.150
  123    HE3  LYS  14           2HE      LYS  14  -4.804  -4.008   5.746
  124    HZ1  LYS  14           3HZ      LYS  14  -3.755  -6.228   7.376
  125    HZ2  LYS  14           1HZ      LYS  14  -5.133  -6.188   6.388
  126    HZ3  LYS  14           2HZ      LYS  14  -5.142  -5.389   7.887
  127    H    THR  15           H        THR  15  -0.215  -4.585   2.912
  128    HA   THR  15           HA       THR  15  -1.503  -7.160   3.207
  129    HB   THR  15           HB       THR  15  -0.029  -6.282   0.771
  130    HG1  THR  15           HG1      THR  15  -2.124  -4.947   2.068
  131   HG21  THR  15          3HG2      THR  15  -2.855  -6.913   0.534
  132   HG22  THR  15          1HG2      THR  15  -1.975  -8.193   1.370
  133   HG23  THR  15          2HG2      THR  15  -1.471  -7.684  -0.242
  134    H    ILE  16           H        ILE  16   1.739  -6.285   1.899
  135    HA   ILE  16           HA       ILE  16   2.817  -8.835   1.564
  136    HB   ILE  16           HB       ILE  16   3.900  -6.170   2.467
  137   HG12  ILE  16          1HG1      ILE  16   4.889  -6.144   0.287
  138   HG13  ILE  16          2HG1      ILE  16   4.610  -7.872   0.068
  139   HG21  ILE  16          1HG2      ILE  16   6.214  -7.320   2.045
  140   HG22  ILE  16          2HG2      ILE  16   5.352  -8.808   2.435
  141   HG23  ILE  16          3HG2      ILE  16   5.446  -7.507   3.622
  142   HD11  ILE  16          3HD1      ILE  16   2.153  -7.449   0.147
  143   HD12  ILE  16          1HD1      ILE  16   2.939  -6.624  -1.199
  144   HD13  ILE  16          2HD1      ILE  16   2.483  -5.719   0.245
  145    H    HIS  17           H        HIS  17   2.615  -6.933   4.570
  146    HA   HIS  17           HA       HIS  17   3.803  -8.970   6.246
  147    HB2  HIS  17           1HB      HIS  17   2.195  -6.448   6.591
  148    HB3  HIS  17           2HB      HIS  17   2.489  -7.483   7.988
  149    HD1  HIS  17           HD1      HIS  17   3.789  -4.561   7.286
  150    HD2  HIS  17           HD2      HIS  17   5.656  -8.283   7.094
  151    HE1  HIS  17           HE1      HIS  17   6.276  -4.124   7.472
  152    H    ARG  18           H        ARG  18   0.581  -8.337   4.986
  153    HA   ARG  18           HA       ARG  18  -0.754 -10.155   6.875
  154    HB2  ARG  18           1HB      ARG  18  -1.603  -8.066   5.480
  155    HB3  ARG  18           2HB      ARG  18  -1.859  -9.274   4.220
  156    HG2  ARG  18           1HG      ARG  18  -2.852 -10.355   6.668
  157    HG3  ARG  18           2HG      ARG  18  -3.500  -8.723   6.501
  158    HD2  ARG  18           1HD      ARG  18  -4.596  -9.225   4.482
  159    HD3  ARG  18           2HD      ARG  18  -3.549 -10.621   4.154
  160    HE   ARG  18           HE       ARG  18  -5.026 -11.903   5.468
  161   HH11  ARG  18          1HH1      ARG  18  -5.373  -8.539   6.112
  162   HH12  ARG  18          2HH1      ARG  18  -6.485  -8.768   7.420
  163   HH21  ARG  18          1HH2      ARG  18  -6.365 -12.229   7.275
  164   HH22  ARG  18          2HH2      ARG  18  -7.048 -10.853   8.077
  165    H    LEU  19           H        LEU  19   0.371 -10.231   3.502
  166    HA   LEU  19           HA       LEU  19  -0.527 -12.956   3.016
  167    HB2  LEU  19           1HB      LEU  19  -0.112 -11.080   1.336
  168    HB3  LEU  19           2HB      LEU  19   1.612 -11.350   1.589
  169    HG   LEU  19           HG       LEU  19   0.648 -12.594  -0.385
  170   HD11  LEU  19          1HD1      LEU  19   2.206 -14.223  -0.066
  171   HD12  LEU  19          2HD1      LEU  19   1.479 -14.751   1.452
  172   HD13  LEU  19          3HD1      LEU  19   2.555 -13.354   1.427
  173   HD21  LEU  19          3HD2      LEU  19  -0.611 -14.388   1.695
  174   HD22  LEU  19          1HD2      LEU  19  -0.867 -14.390  -0.051
  175   HD23  LEU  19          2HD2      LEU  19  -1.521 -13.081   0.936
  176    H    VAL  20           H        VAL  20   2.486 -11.387   4.029
  177    HA   VAL  20           HA       VAL  20   4.138 -13.756   3.922
  178    HB   VAL  20           HB       VAL  20   4.234 -11.057   5.266
  179   HG11  VAL  20          1HG1      VAL  20   6.251 -13.306   5.533
  180   HG12  VAL  20          2HG1      VAL  20   5.327 -12.566   6.839
  181   HG13  VAL  20          3HG1      VAL  20   6.559 -11.631   5.992
  182   HG21  VAL  20          3HG2      VAL  20   5.100 -10.586   3.231
  183   HG22  VAL  20          1HG2      VAL  20   5.198 -12.296   2.808
  184   HG23  VAL  20          2HG2      VAL  20   6.508 -11.534   3.710
  185    H    THR  21           H        THR  21   1.902 -12.429   6.293
  186    HA   THR  21           HA       THR  21   2.815 -14.138   8.488
  187    HB   THR  21           HB       THR  21   0.355 -12.425   8.011
  188    HG1  THR  21           HG1      THR  21   1.955 -11.042   8.247
  189   HG21  THR  21          3HG2      THR  21   0.256 -12.544  10.575
  190   HG22  THR  21          1HG2      THR  21   1.329 -13.937  10.437
  191   HG23  THR  21          2HG2      THR  21  -0.271 -13.979   9.694
  192    H    GLY  22           H        GLY  22   0.495 -14.365   5.872
  193    HA2  GLY  22           1HA      GLY  22  -0.580 -16.347   5.114
  194    HA3  GLY  22           2HA      GLY  22  -0.017 -17.175   6.566